Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2iaj_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 10.A N ASP 121.A OD2 no hydrogen 3.442 N/A LYS 11.A N GLN 85.A OE1 no hydrogen 2.890 N/A LYS 13.A N ARG 83.A O no hydrogen 2.815 N/A MET 16.A N LYS 13.A O no hydrogen 3.072 N/A VAL 21.A N ASN 57.A O no hydrogen 3.014 N/A GLN 23.A NE2 TRP 24.A O no hydrogen 2.868 N/A GLN 23.A NE2 VAL 60.A O no hydrogen 2.836 N/A LYS 30.A N THR 27.A OG1 no hydrogen 3.386 N/A LYS 30.A NZ THR 391.A O no hydrogen 3.231 N/A LYS 30.A NZ GLU 392.A OE2 no hydrogen 3.227 N/A ILE 31.A N THR 27.A O no hydrogen 2.944 N/A LYS 32.A N GLU 28.A O no hydrogen 3.042 N/A ALA 33.A N GLU 29.A O no hydrogen 3.110 N/A LEU 34.A N LYS 30.A O no hydrogen 2.839 N/A VAL 35.A N ILE 31.A O no hydrogen 2.776 N/A GLU 36.A N LYS 32.A O no hydrogen 3.170 N/A ILE 37.A N ALA 33.A O no hydrogen 3.129 N/A CYS 38.A N LEU 34.A O no hydrogen 2.961 N/A CYS 38.A SG LEU 34.A O no hydrogen 3.497 N/A THR 39.A N VAL 35.A O no hydrogen 3.033 N/A GLU 40.A N GLU 36.A O no hydrogen 3.168 N/A MET 41.A N ILE 37.A O no hydrogen 2.718 N/A GLU 42.A N CYS 38.A O no hydrogen 2.665 N/A LYS 43.A N THR 39.A O no hydrogen 3.245 N/A GLU 44.A N GLU 40.A O no hydrogen 3.084 N/A GLY 45.A N GLU 42.A O no hydrogen 3.212 N/A LYS 46.A N MET 41.A O no hydrogen 2.992 N/A LYS 46.A NZ GLU 44.A OE1 no hydrogen 2.814 N/A SER 48.A N GLN 145.A O no hydrogen 2.972 N/A SER 48.A OG ILE 47.A O no hydrogen 3.412 N/A ILE 50.A N ARG 143.A O no hydrogen 3.033 N/A GLU 53.A N GLU 53.A OE1 no hydrogen 2.746 N/A ASN 54.A ND2 LYS 126.A O no hydrogen 2.667 N/A TYR 56.A N ASN 54.A OD1 no hydrogen 2.739 N/A TYR 56.A OH ASP 17.A OD1 no hydrogen 3.057 N/A ASN 57.A N PRO 19.A O no hydrogen 3.075 N/A ASN 57.A ND2 VAL 21.A O no hydrogen 2.918 N/A THR 58.A N ALA 129.A O no hydrogen 2.824 N/A VAL 60.A N GLN 23.A OE1 no hydrogen 2.753 N/A PHE 61.A N LEU 74.A O no hydrogen 3.188 N/A ILE 63.A N ARG 72.A O no hydrogen 3.176 N/A ARG 72.A N ILE 63.A O no hydrogen 2.945 N/A LYS 73.A NZ TYR 146.A OH no hydrogen 2.601 N/A LEU 74.A N PHE 61.A O no hydrogen 2.897 N/A ASP 76.A N PRO 59.A O no hydrogen 3.085 N/A ARG 78.A N ASP 76.A OD1 no hydrogen 3.266 N/A ARG 78.A NE ASP 76.A OD1 no hydrogen 2.810 N/A ARG 78.A NE ASP 76.A OD2 no hydrogen 3.437 N/A ARG 78.A NH1 PRO 400.A O no hydrogen 2.881 N/A ARG 78.A NH2 ASP 76.A OD2 no hydrogen 2.701 N/A ASN 81.A N PHE 77.A O no hydrogen 2.710 N/A ASN 81.A ND2 GLY 152.A O no hydrogen 3.091 N/A LYS 82.A N ARG 78.A O no hydrogen 3.092 N/A LYS 82.A NZ GLU 79.A OE2 no hydrogen 3.459 N/A LYS 82.A NZ GLU 401.A OE1 no hydrogen 2.861 N/A ARG 83.A N GLU 79.A O no hydrogen 3.116 N/A ARG 83.A N LEU 80.A O no hydrogen 2.879 N/A ARG 83.A NH1 ASP 17.A O no hydrogen 2.753 N/A THR 84.A OG1 LEU 80.A O no hydrogen 2.739 N/A GLN 85.A N LYS 11.A O no hydrogen 3.025 N/A VAL 90.A N PHE 87.A O no hydrogen 3.249 N/A GLY 93.A N VAL 90.A O no hydrogen 2.987 N/A ILE 94.A N GLN 91.A O no hydrogen 2.481 N/A HIS 96.A NE2 VAL 369.A O no hydrogen 2.868 N/A LYS 101.A NZ ALA 98.A O no hydrogen 3.513 N/A LYS 102.A N GLY 99.A O no hydrogen 2.651 N/A ASN 103.A N GLY 99.A O no hydrogen 2.973 N/A LYS 104.A N ASP 192.A OD1 no hydrogen 2.972 N/A SER 105.A N SER 191.A O no hydrogen 3.141 N/A SER 105.A OG HIS 223.A ND1 no hydrogen 3.102 N/A VAL 106.A N LEU 222.A O no hydrogen 3.011 N/A THR 107.A N VAL 189.A O no hydrogen 2.931 N/A THR 107.A OG1 HIS 198.A NE2 no hydrogen 2.878 N/A VAL 108.A N TYR 220.A O no hydrogen 2.856 N/A LEU 109.A N LEU 187.A O no hydrogen 2.761 N/A VAL 111.A N ASP 185.A O no hydrogen 2.698 N/A ALA 114.A N VAL 111.A O no hydrogen 2.822 N/A TYR 115.A OH MET 184.A O no hydrogen 3.141 N/A PHE 116.A N ASP 113.A O no hydrogen 3.259 N/A SER 117.A N TYR 115.A O no hydrogen 2.669 N/A SER 117.A OG ILE 2.A O no hydrogen 3.569 N/A SER 117.A OG ALA 114.A O no hydrogen 3.221 N/A VAL 118.A N TYR 115.A O no hydrogen 3.049 N/A LEU 120.A N ASN 147.A O no hydrogen 3.256 N/A PHE 124.A N ASP 121.A O no hydrogen 2.819 N/A ARG 125.A NE LEU 120.A O no hydrogen 2.760 N/A ARG 125.A NH1 ASN 147.A OD1 no hydrogen 3.191 N/A ARG 125.A NH2 LEU 120.A O no hydrogen 2.741 N/A TYR 127.A N PHE 124.A O no hydrogen 3.098 N/A THR 128.A N ARG 125.A O no hydrogen 2.730 N/A THR 128.A OG1 ARG 125.A O no hydrogen 2.819 N/A PHE 130.A N TYR 144.A O no hydrogen 2.916 N/A THR 131.A OG1 ASN 57.A OD1 no hydrogen 2.628 N/A ILE 132.A N ILE 142.A O no hydrogen 2.668 N/A SER 134.A OG THR 139.A O no hydrogen 3.076 N/A ASN 136.A ND2 GLU 138.A OE2 no hydrogen 2.845 N/A ASN 137.A N SER 134.A O no hydrogen 3.384 N/A THR 139.A N SER 134.A OG no hydrogen 3.343 N/A ARG 143.A NE THR 131.A OG1 no hydrogen 2.921 N/A ARG 143.A NH1 TYR 56.A O no hydrogen 3.280 N/A ARG 143.A NH2 TYR 56.A O no hydrogen 2.462 N/A ARG 143.A NH2 ASN 57.A OD1 no hydrogen 2.508 N/A ARG 143.A NH2 THR 131.A OG1 no hydrogen 3.427 N/A TYR 144.A N PHE 130.A O no hydrogen 2.957 N/A GLN 145.A N SER 48.A O no hydrogen 3.009 N/A TYR 146.A N THR 128.A OG1 no hydrogen 2.811 N/A ASN 147.A N LYS 46.A O no hydrogen 2.933 N/A ASN 147.A ND2 GLY 45.A O no hydrogen 3.365 N/A ASN 147.A ND2 SER 48.A OG no hydrogen 3.128 N/A LEU 149.A N VAL 118.A O no hydrogen 3.092 N/A GLY 152.A N ASP 185.A OD1 no hydrogen 3.339 N/A TRP 153.A N PRO 150.A O no hydrogen 3.066 N/A TRP 153.A NE1 THR 84.A OG1 no hydrogen 3.313 N/A LYS 154.A N ASN 81.A OD1 no hydrogen 2.529 N/A LYS 154.A NZ ASN 81.A O no hydrogen 3.224 N/A LYS 154.A NZ THR 84.A O no hydrogen 3.162 N/A LYS 154.A NZ ASP 86.A OD2 no hydrogen 3.080 N/A SER 156.A N TRP 153.A O no hydrogen 3.119 N/A SER 156.A OG PRO 150.A O no hydrogen 2.874 N/A ILE 159.A N GLY 155.A O no hydrogen 2.861 N/A PHE 160.A N SER 156.A O no hydrogen 2.974 N/A GLN 161.A N PRO 157.A O no hydrogen 2.791 N/A GLN 161.A N ALA 158.A O no hydrogen 3.233 N/A MET 164.A N PHE 160.A O no hydrogen 2.927 N/A THR 165.A N GLN 161.A O no hydrogen 2.820 N/A THR 165.A OG1 GLN 161.A O no hydrogen 3.555 N/A LYS 166.A N SER 162.A O no hydrogen 2.991 N/A ILE 167.A N MET 164.A O no hydrogen 2.728 N/A LEU 168.A N MET 164.A O no hydrogen 2.981 N/A LEU 168.A N THR 165.A O no hydrogen 2.964 N/A GLU 169.A N THR 165.A O no hydrogen 2.887 N/A LYS 172.A N LEU 168.A O no hydrogen 2.971 N/A LYS 173.A N GLU 169.A O no hydrogen 3.184 N/A LYS 173.A N PRO 170.A O no hydrogen 2.636 N/A GLN 174.A N PRO 170.A O no hydrogen 3.210 N/A ASN 175.A ND2 PHE 171.A O no hydrogen 3.546 N/A VAL 179.A N GLY 190.A O no hydrogen 3.139 N/A CYS 181.A N TYR 188.A O no hydrogen 2.895 N/A CYS 181.A SG HIS 96.A ND1 no hydrogen 3.175 N/A TYR 183.A N ASP 186.A O no hydrogen 2.998 N/A ASP 186.A N TYR 183.A O no hydrogen 2.822 N/A LEU 187.A N LEU 109.A O no hydrogen 2.641 N/A TYR 188.A N CYS 181.A O no hydrogen 2.513 N/A VAL 189.A N THR 107.A O no hydrogen 2.935 N/A GLY 190.A N VAL 179.A O no hydrogen 2.842 N/A SER 191.A N SER 105.A O no hydrogen 2.854 N/A SER 191.A OG HIS 198.A ND1 no hydrogen 2.583 N/A GLY 196.A N GLU 194.A OE2 no hydrogen 2.932 N/A GLN 197.A N GLU 194.A OE1 no hydrogen 2.938 N/A HIS 198.A N GLU 194.A O no hydrogen 2.899 N/A HIS 198.A N ILE 195.A O no hydrogen 2.678 N/A HIS 198.A ND1 SER 191.A OG no hydrogen 2.583 N/A HIS 198.A NE2 THR 107.A OG1 no hydrogen 2.878 N/A ARG 199.A N ILE 195.A O no hydrogen 2.880 N/A THR 200.A OG1 GLY 196.A O no hydrogen 3.438 N/A LYS 201.A NZ ASN 175.A OD1 no hydrogen 2.713 N/A LYS 201.A NZ GLU 204.A OE1 no hydrogen 2.691 N/A ILE 202.A N HIS 198.A O no hydrogen 3.044 N/A GLU 204.A N THR 200.A O no hydrogen 3.132 N/A LEU 205.A N LYS 201.A O no hydrogen 2.898 N/A ARG 206.A N ILE 202.A O no hydrogen 2.723 N/A ARG 206.A NE THR 216.A OG1 no hydrogen 3.066 N/A ARG 206.A NH2 THR 216.A O no hydrogen 3.258 N/A ARG 206.A NH2 ASP 218.A OD1 no hydrogen 3.177 N/A GLN 207.A N GLU 203.A O no hydrogen 3.275 N/A HIS 208.A N GLU 204.A O no hydrogen 2.876 N/A HIS 208.A NE2 ILE 167.A O no hydrogen 2.938 N/A LEU 209.A N LEU 205.A O no hydrogen 2.871 N/A LEU 210.A N ARG 206.A O no hydrogen 2.664 N/A ARG 211.A N GLN 207.A O no hydrogen 2.880 N/A ARG 211.A N HIS 208.A O no hydrogen 3.221 N/A TRP 212.A N LEU 209.A O no hydrogen 2.762 N/A LEU 214.A N LEU 209.A O no hydrogen 3.247 N/A LEU 222.A N VAL 106.A O no hydrogen 2.797 N/A HIS 223.A ND1 LYS 104.A O no hydrogen 2.820 N/A LYS 226.A N HIS 223.A O no hydrogen 3.293 N/A TRP 227.A N PRO 224.A O no hydrogen 3.462 N/A GLN 230.A N THR 339.A O no hydrogen 2.799 N/A LYS 237.A NZ ASP 244.A OD1 no hydrogen 2.593 N/A THR 241.A N ASP 244.A OD2 no hydrogen 2.913 N/A THR 241.A OG1 ASP 244.A OD2 no hydrogen 2.608 N/A ASN 243.A N LEU 277.A O no hydrogen 3.058 N/A ASP 244.A N THR 241.A OG1 no hydrogen 3.000 N/A ILE 245.A N THR 241.A O no hydrogen 2.917 N/A GLN 246.A N VAL 242.A O no hydrogen 2.823 N/A LYS 247.A N ASN 243.A O no hydrogen 2.907 N/A LEU 248.A N ILE 245.A O no hydrogen 3.227 N/A VAL 249.A N ILE 245.A O no hydrogen 2.712 N/A GLY 250.A N GLN 246.A O no hydrogen 2.758 N/A LYS 251.A N LYS 247.A O no hydrogen 3.326 N/A LYS 251.A NZ VAL 233.A O no hydrogen 2.818 N/A LEU 252.A N LEU 248.A O no hydrogen 3.199 N/A ASN 253.A N VAL 249.A O no hydrogen 3.221 N/A ASN 253.A N GLY 250.A O no hydrogen 2.992 N/A TRP 254.A N GLY 250.A O no hydrogen 3.274 N/A ALA 255.A N LYS 251.A O no hydrogen 2.954 N/A SER 256.A N LEU 252.A O no hydrogen 3.241 N/A SER 256.A OG ASN 253.A O no hydrogen 3.035 N/A GLN 257.A N TRP 254.A O no hydrogen 2.846 N/A ILE 258.A N ALA 255.A O no hydrogen 2.768 N/A TYR 259.A N ALA 255.A O no hydrogen 2.953 N/A ILE 262.A N PRO 260.A O no hydrogen 2.632 N/A LYS 263.A N ASN 294.A OD1 no hydrogen 2.970 N/A GLN 266.A N GLU 290.A OE2 no hydrogen 3.381 N/A LEU 267.A N VAL 264.A O no hydrogen 2.674 N/A SER 268.A N VAL 264.A O no hydrogen 2.569 N/A SER 268.A OG VAL 264.A O no hydrogen 2.941 N/A LYS 269.A N ARG 265.A O no hydrogen 3.115 N/A ARG 272.A N LYS 269.A O no hydrogen 2.573 N/A ALA 287.A N THR 284.A O no hydrogen 2.658 N/A LEU 289.A N GLU 286.A O no hydrogen 2.396 N/A LEU 291.A N ALA 287.A O no hydrogen 2.834 N/A ALA 292.A N GLU 288.A O no hydrogen 2.430 N/A GLU 293.A N LEU 289.A O no hydrogen 2.642 N/A ASN 294.A N GLU 290.A O no hydrogen 2.590 N/A ARG 295.A N LEU 291.A O no hydrogen 2.613 N/A ARG 295.A NH1 PRO 235.A O no hydrogen 3.213 N/A GLU 296.A N ALA 292.A O no hydrogen 3.217 N/A ILE 297.A N GLU 293.A O no hydrogen 3.195 N/A LYS 299.A NZ GLU 296.A OE2 no hydrogen 3.076 N/A ASP 308.A N GLN 331.A OE1 no hydrogen 2.990 N/A SER 310.A N ASP 308.A OD1 no hydrogen 2.883 N/A SER 310.A OG ASP 308.A OD1 no hydrogen 2.768 N/A SER 310.A OG ASP 308.A OD2 no hydrogen 3.369 N/A LYS 311.A N ASP 308.A O no hydrogen 3.300 N/A ILE 314.A N TYR 330.A O no hydrogen 2.674 N/A ALA 315.A N LYS 376.A O no hydrogen 2.952 N/A GLU 316.A N GLN 328.A O no hydrogen 3.018 N/A GLN 318.A N THR 326.A O no hydrogen 2.846 N/A GLN 318.A NE2 GLN 328.A OE1 no hydrogen 3.145 N/A LYS 319.A NZ ASP 352.A OD1 no hydrogen 2.548 N/A GLN 320.A N GLN 324.A O no hydrogen 2.976 N/A GLN 320.A NE2 THR 326.A OG1 no hydrogen 2.727 N/A GLN 320.A NE2 VAL 411.A O no hydrogen 3.373 N/A GLY 321.A N GLN 324.A O no hydrogen 3.332 N/A GLN 324.A N GLY 321.A O no hydrogen 3.154 N/A TRP 325.A N TYR 342.A O no hydrogen 2.926 N/A TRP 325.A NE1 GLN 355.A OE1 no hydrogen 2.963 N/A THR 326.A N GLN 318.A O no hydrogen 3.103 N/A TYR 327.A N GLY 340.A O no hydrogen 3.313 N/A GLN 328.A N GLU 316.A O no hydrogen 3.155 N/A GLN 328.A NE2 GLN 318.A OE1 no hydrogen 2.695 N/A ILE 329.A N LYS 338.A O no hydrogen 2.899 N/A TYR 330.A N ILE 314.A O no hydrogen 2.861 N/A TYR 330.A OH GLU 316.A OE2 no hydrogen 3.075 N/A GLN 331.A NE2 ASP 308.A O no hydrogen 2.826 N/A LYS 335.A N GLU 332.A O no hydrogen 2.811 N/A LEU 337.A N ILE 329.A O no hydrogen 2.858 N/A LYS 338.A N ILE 329.A O no hydrogen 3.364 N/A LYS 338.A NZ GLU 366.A OE1 no hydrogen 2.930 N/A THR 339.A OG1 GLN 230.A O no hydrogen 2.677 N/A GLY 340.A N TYR 327.A O no hydrogen 2.741 N/A LYS 341.A NZ GLN 324.A OE1 no hydrogen 3.503 N/A TYR 342.A OH GLU 358.A OE1 no hydrogen 3.374 N/A ARG 346.A NH1 ALA 343.A O no hydrogen 3.517 N/A ASN 351.A ND2 TYR 393.A OH no hydrogen 2.797 N/A LYS 354.A N ASN 351.A OD1 no hydrogen 2.669 N/A LYS 354.A NZ GLU 358.A OE2 no hydrogen 3.234 N/A GLN 355.A N ASN 351.A O no hydrogen 2.959 N/A LEU 356.A N ASP 352.A O no hydrogen 2.677 N/A THR 357.A N VAL 353.A O no hydrogen 2.929 N/A THR 357.A OG1 VAL 353.A O no hydrogen 2.964 N/A GLU 358.A N LYS 354.A O no hydrogen 3.039 N/A ALA 359.A N GLN 355.A O no hydrogen 2.870 N/A VAL 360.A N LEU 356.A O no hydrogen 3.021 N/A GLN 361.A N THR 357.A O no hydrogen 3.377 N/A GLN 361.A NE2 THR 357.A O no hydrogen 2.446 N/A GLN 361.A NE2 TYR 393.A O no hydrogen 3.598 N/A LYS 362.A N GLU 358.A O no hydrogen 3.064 N/A LYS 362.A NZ GLU 366.A OE1 no hydrogen 3.076 N/A LYS 362.A NZ GLU 366.A OE2 no hydrogen 3.203 N/A ILE 363.A N ALA 359.A O no hydrogen 2.709 N/A THR 364.A N VAL 360.A O no hydrogen 2.971 N/A THR 364.A OG1 VAL 360.A O no hydrogen 2.588 N/A THR 365.A N GLN 361.A O no hydrogen 2.922 N/A THR 365.A OG1 GLN 361.A O no hydrogen 3.105 N/A GLU 366.A N LYS 362.A O no hydrogen 3.117 N/A SER 367.A N ILE 363.A O no hydrogen 2.921 N/A SER 367.A OG LYS 373.A O no hydrogen 2.800 N/A ILE 368.A N THR 364.A O no hydrogen 3.018 N/A VAL 369.A N THR 365.A O no hydrogen 2.949 N/A ILE 370.A N GLU 366.A O no hydrogen 3.000 N/A TRP 371.A N SER 367.A O no hydrogen 2.825 N/A GLY 372.A N ILE 368.A O no hydrogen 2.433 N/A LYS 373.A NZ TYR 307.A OH no hydrogen 3.034 N/A LYS 373.A NZ LYS 311.A O no hydrogen 2.378 N/A LYS 376.A N LEU 313.A O no hydrogen 2.862 N/A PHE 377.A N GLU 401.A O no hydrogen 3.020 N/A LYS 378.A N ALA 315.A O no hydrogen 2.784 N/A LEU 379.A N GLU 403.A O no hydrogen 3.058 N/A LYS 383.A NZ GLU 387.A OE1 no hydrogen 3.091 N/A LYS 383.A NZ GLU 387.A OE2 no hydrogen 2.755 N/A TRP 386.A N GLN 382.A O no hydrogen 2.999 N/A GLU 387.A N LYS 383.A O no hydrogen 2.891 N/A THR 388.A N GLU 384.A O no hydrogen 3.146 N/A THR 388.A N THR 385.A O no hydrogen 3.276 N/A THR 388.A OG1 GLU 384.A O no hydrogen 2.407 N/A TRP 389.A N THR 385.A O no hydrogen 3.460 N/A TRP 390.A N TRP 386.A O no hydrogen 2.941 N/A GLU 392.A N TRP 389.A O no hydrogen 2.756 N/A TYR 393.A N TRP 390.A O no hydrogen 3.019 N/A TRP 394.A NE1 TRP 398.A O no hydrogen 2.823 N/A GLN 395.A N GLN 361.A OE1 no hydrogen 2.666 N/A THR 397.A OG1 ASP 186.A OD2 no hydrogen 3.434 N/A GLU 403.A N PHE 377.A O no hydrogen 3.033 N/A VAL 405.A N LEU 379.A O no hydrogen 3.199 N/A TRP 414.A N VAL 411.A O no hydrogen 2.829 N/A TYR 415.A N VAL 411.A O no hydrogen 3.132 N/A