Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6jct_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N GLY 191.A O no hydrogen 3.459 N/A HIS 11.A N THR 26.A OG1 no hydrogen 3.058 N/A SER 14.A N ASP 13.A OD1 no hydrogen 2.823 N/A SER 14.A OG ASP 78.A OD2 no hydrogen 2.833 N/A THR 15.A N VAL 22.A O no hydrogen 2.919 N/A MET 17.A N ARG 20.A O no hydrogen 2.717 N/A ARG 20.A NH1 GLU 464.A OE2 no hydrogen 3.163 N/A VAL 21.A N TRP 465.A O no hydrogen 3.011 N/A VAL 22.A N THR 15.A O no hydrogen 3.193 N/A THR 23.A N MET 463.A O no hydrogen 3.250 N/A SER 25.A N VAL 461.A O no hydrogen 3.067 N/A SER 25.A OG LYS 24.A O no hydrogen 2.812 N/A SER 25.A OG SER 72.A O no hydrogen 3.300 N/A THR 26.A OG1 HIS 11.A O no hydrogen 2.380 N/A THR 26.A OG1 THR 460.A OG1 no hydrogen 3.197 N/A ARG 27.A N VAL 459.A O no hydrogen 2.862 N/A ARG 27.A NE PRO 146.A O no hydrogen 3.073 N/A ARG 27.A NH2 PRO 146.A O no hydrogen 2.508 N/A TRP 29.A N GLY 457.A O no hydrogen 2.787 N/A VAL 30.A N PHE 153.A O no hydrogen 3.115 N/A LEU 31.A N SER 455.A O no hydrogen 2.811 N/A SER 33.A OG SER 33.A O no hydrogen 2.530 N/A SER 33.A OG GLN 453.A O no hydrogen 3.369 N/A TYR 34.A OH LEU 155.A O no hydrogen 2.296 N/A ASN 35.A ND2 GLN 38.A O no hydrogen 3.529 N/A ASN 35.A ND2 SER 59.A OG no hydrogen 3.089 N/A HIS 37.A N TYR 34.A O no hydrogen 3.208 N/A TYR 39.A OH GLU 181.A OE1 no hydrogen 2.568 N/A ARG 40.A N SER 59.A O no hydrogen 3.086 N/A ILE 42.A N GLY 57.A O no hydrogen 2.870 N/A SER 44.A N TYR 55.A O no hydrogen 3.187 N/A SER 44.A OG GLY 45.A O no hydrogen 3.407 N/A VAL 47.A N GLY 45.A O no hydrogen 2.823 N/A ALA 52.A N SER 50.A OG no hydrogen 3.258 N/A TYR 55.A N SER 44.A O no hydrogen 3.272 N/A GLY 57.A N ILE 42.A O no hydrogen 2.830 N/A TYR 58.A N TYR 160.A O no hydrogen 3.062 N/A SER 59.A N ARG 40.A O no hydrogen 2.958 N/A THR 60.A N TYR 158.A O no hydrogen 2.975 N/A THR 60.A OG1 TRP 62.A O no hydrogen 3.543 N/A THR 60.A OG1 TYR 158.A O no hydrogen 2.393 N/A TRP 62.A N THR 60.A OG1 no hydrogen 3.340 N/A TRP 62.A NE1 GLU 181.A OE2 no hydrogen 3.166 N/A GLY 63.A N ILE 430.A O no hydrogen 2.594 N/A TYR 64.A N PRO 156.A O no hydrogen 3.225 N/A PHE 65.A N MET 428.A O no hydrogen 3.111 N/A ASN 68.A N ASP 66.A OD1 no hydrogen 3.402 N/A ASN 68.A ND2 TRP 400.A O no hydrogen 3.112 N/A ARG 69.A NH2 GLN 396.A O no hydrogen 2.885 N/A PHE 70.A N GLY 397.A O no hydrogen 2.906 N/A SER 72.A N ARG 69.A O no hydrogen 3.396 N/A SER 72.A OG LEU 145.A O no hydrogen 2.551 N/A HIS 73.A N PHE 70.A O no hydrogen 3.325 N/A HIS 73.A NE2 PHE 67.A O no hydrogen 3.102 N/A TRP 74.A N PHE 70.A O no hydrogen 3.161 N/A SER 75.A OG ASP 78.A OD2 no hydrogen 2.862 N/A ARG 77.A NH1 ARG 77.A O no hydrogen 3.070 N/A ASP 78.A N SER 75.A OG no hydrogen 3.222 N/A TRP 79.A N SER 75.A O no hydrogen 2.796 N/A GLN 80.A N PRO 76.A O no hydrogen 3.331 N/A GLN 80.A NE2 TYR 481.A O no hydrogen 2.736 N/A ARG 81.A N ARG 77.A O no hydrogen 2.936 N/A LEU 82.A N ASP 78.A O no hydrogen 3.344 N/A ILE 83.A N TRP 79.A O no hydrogen 3.020 N/A ASN 85.A N LEU 82.A O no hydrogen 3.399 N/A ASN 85.A ND2 ARG 81.A O no hydrogen 2.957 N/A TYR 86.A N LEU 82.A O no hydrogen 3.333 N/A TRP 87.A N LYS 468.A O no hydrogen 2.775 N/A ARG 90.A N GLU 466.A O no hydrogen 3.245 N/A ARG 90.A NE GLU 466.A OE1 no hydrogen 2.919 N/A ARG 90.A NH1 GLU 202.A OE2 no hydrogen 3.485 N/A ARG 90.A NH1 VAL 203.A O no hydrogen 2.710 N/A ARG 90.A NH2 GLU 466.A OE1 no hydrogen 2.873 N/A ARG 92.A N GLU 464.A O no hydrogen 2.661 N/A SER 93.A OG ASN 199.A OD1 no hydrogen 3.208 N/A SER 93.A OG GLU 464.A OE1 no hydrogen 3.273 N/A LEU 94.A N TYR 198.A O no hydrogen 2.765 N/A VAL 96.A N PHE 196.A O no hydrogen 2.877 N/A LYS 97.A N THR 460.A O no hydrogen 2.876 N/A ILE 98.A N PHE 194.A O no hydrogen 3.186 N/A PHE 99.A N GLN 458.A O no hydrogen 2.909 N/A ASN 100.A N SER 7.A OG no hydrogen 3.171 N/A GLN 102.A N THR 456.A O no hydrogen 2.944 N/A LYS 104.A N TYR 454.A O no hydrogen 2.783 N/A GLU 105.A N ALA 116.A O no hydrogen 2.883 N/A THR 107.A N THR 114.A O no hydrogen 3.007 N/A THR 107.A OG1 THR 114.A O no hydrogen 3.043 N/A GLN 109.A N THR 112.A O no hydrogen 3.222 N/A SER 111.A OG SER 111.A O no hydrogen 2.518 N/A THR 112.A N GLN 109.A O no hydrogen 3.148 N/A THR 112.A OG1 ASP 110.A O no hydrogen 3.370 N/A THR 114.A N THR 107.A O no hydrogen 2.918 N/A ALA 116.A N GLU 105.A O no hydrogen 2.854 N/A SER 121.A OG GLN 453.A OE1 no hydrogen 3.413 N/A THR 122.A OG1 THR 433.A OG1 no hydrogen 2.633 N/A VAL 123.A N LEU 188.A O no hydrogen 2.755 N/A GLN 124.A N LYS 431.A O no hydrogen 3.252 N/A VAL 125.A N LYS 186.A O no hydrogen 3.140 N/A PHE 126.A N LEU 429.A O no hydrogen 3.090 N/A ASP 128.A N MET 427.A O no hydrogen 3.278 N/A TYR 131.A OH PRO 424.A O no hydrogen 2.349 N/A TYR 135.A OH PRO 425.A O no hydrogen 3.140 N/A ASN 139.A N VAL 137.A O no hydrogen 2.773 N/A THR 141.A OG1 ASP 66.A OD2 no hydrogen 3.522 N/A CYS 144.A SG ASP 66.A O no hydrogen 3.240 N/A CYS 144.A SG THR 141.A O no hydrogen 3.935 N/A GLN 151.A N PHE 148.A O no hydrogen 3.252 N/A PHE 153.A N THR 28.A O no hydrogen 3.242 N/A THR 154.A OG1 VAL 30.A O no hydrogen 3.235 N/A LEU 155.A N VAL 30.A O no hydrogen 2.968 N/A GLN 157.A NE2 THR 60.A O no hydrogen 2.914 N/A TYR 158.A N TRP 62.A O no hydrogen 2.785 N/A TYR 158.A OH PRO 134.A O no hydrogen 2.822 N/A TYR 160.A N TYR 58.A O no hydrogen 3.099 N/A THR 162.A N PHE 56.A O no hydrogen 2.559 N/A THR 162.A OG1 SER 176.A O no hydrogen 3.455 N/A ASN 164.A ND2 THR 168.A O no hydrogen 2.862 N/A ARG 165.A N ASN 170.A O no hydrogen 2.884 N/A THR 168.A N ARG 165.A O no hydrogen 3.066 N/A THR 168.A OG1 ARG 165.A O no hydrogen 2.399 N/A GLU 169.A N GLU 169.A OE1 no hydrogen 2.686 N/A ASN 170.A N THR 168.A OG1 no hydrogen 3.417 N/A SER 175.A N THR 172.A O no hydrogen 3.336 N/A SER 175.A OG THR 172.A O no hydrogen 2.808 N/A PHE 178.A N TYR 160.A OH no hydrogen 2.798 N/A CYS 179.A SG GLU 181.A OE1 no hydrogen 3.634 N/A LEU 180.A N TYR 39.A OH no hydrogen 2.731 N/A TYR 182.A N CYS 179.A O no hydrogen 3.421 N/A LYS 186.A N VAL 125.A O no hydrogen 2.890 N/A LYS 186.A NZ ASN 193.A O no hydrogen 3.370 N/A LEU 188.A N VAL 123.A O no hydrogen 2.567 N/A THR 190.A OG1 ILE 101.A O no hydrogen 2.904 N/A THR 190.A OG1 THR 190.A O no hydrogen 2.548 N/A ASN 192.A N ARG 189.A O no hydrogen 3.470 N/A ASN 193.A ND2 SER 7.A O no hydrogen 3.321 N/A PHE 194.A N ILE 98.A O no hydrogen 3.024 N/A TYR 198.A N LEU 94.A O no hydrogen 2.765 N/A TYR 198.A OH HIS 423.A O no hydrogen 2.302 N/A PHE 200.A N ARG 92.A O no hydrogen 2.714 N/A HIS 206.A N PHE 89.A O no hydrogen 3.222 N/A SER 207.A OG SER 207.A O no hydrogen 2.547 N/A SER 208.A N TRP 87.A O no hydrogen 3.222 N/A SER 208.A OG TYR 86.A O no hydrogen 2.958 N/A ALA 210.A N LEU 512.A O no hydrogen 2.540 N/A SER 212.A N ARG 514.A O no hydrogen 2.794 N/A SER 212.A OG SER 212.A O no hydrogen 2.580 N/A GLN 213.A NE2 LYS 217.A O no hydrogen 3.664 N/A LEU 215.A N ASN 214.A OD1 no hydrogen 2.677 N/A LEU 215.A N PRO 349.A O no hydrogen 3.044 N/A GLN 225.A N ASN 244.A O no hydrogen 3.244 N/A GLN 225.A NE2 TYR 253.A O no hydrogen 3.497 N/A ARG 229.A N ASN 242.A O no hydrogen 2.945 N/A VAL 231.A N GLN 240.A O no hydrogen 3.302 N/A THR 233.A OG1 THR 236.A O no hydrogen 3.563 N/A THR 233.A OG1 GLY 238.A O no hydrogen 2.542 N/A ASN 234.A N GLY 238.A O no hydrogen 3.141 N/A THR 236.A OG1 ASN 235.A OD1 no hydrogen 3.236 N/A GLN 240.A N SER 232.A O no hydrogen 3.034 N/A ASN 242.A N ARG 229.A O no hydrogen 3.139 N/A LYS 243.A NZ ASP 224.A OD1 no hydrogen 3.559 N/A LYS 243.A NZ ASP 224.A OD2 no hydrogen 3.360 N/A ASN 244.A N LEU 227.A O no hydrogen 3.443 N/A ASN 244.A ND2 GLN 225.A OE1 no hydrogen 3.311 N/A TYR 249.A OH ALA 219.A O no hydrogen 2.381 N/A TYR 253.A N GLN 225.A OE1 no hydrogen 3.335 N/A LYS 254.A NZ TYR 249.A O no hydrogen 2.647 N/A LYS 254.A NZ THR 252.A O no hydrogen 3.148 N/A LYS 254.A NZ THR 252.A OG1 no hydrogen 3.289 N/A PHE 257.A N GLY 385.A O no hydrogen 3.263 N/A MET 261.A N GLN 380.A O no hydrogen 2.793 N/A ARG 263.A N ASN 378.A O no hydrogen 2.790 N/A ARG 263.A NH1 ASN 378.A OD1 no hydrogen 3.449 N/A THR 264.A N ALA 354.A O no hydrogen 2.531 N/A THR 264.A OG1 ALA 354.A O no hydrogen 3.310 N/A TRP 267.A N TYR 313.A O no hydrogen 2.703 N/A ASN 268.A N ASN 274.A OD1 no hydrogen 2.803 N/A ASN 268.A ND2 VAL 273.A O no hydrogen 2.752 N/A LEU 269.A N ASN 311.A O no hydrogen 2.651 N/A ASN 274.A ND2 ASN 268.A O no hydrogen 2.603 N/A PHE 281.A N SER 279.A O no hydrogen 2.679 N/A THR 284.A OG1 PHE 281.A O no hydrogen 3.107 N/A ASN 285.A ND2 ARG 263.A O no hydrogen 3.303 N/A MET 287.A N TYR 294.A O no hydrogen 2.778 N/A LEU 289.A N ALA 292.A O no hydrogen 3.039 N/A TYR 294.A N MET 287.A O no hydrogen 3.398 N/A GLN 295.A NE2 THR 284.A OG1 no hydrogen 2.791 N/A GLN 299.A N GLN 299.A OE1 no hydrogen 2.868 N/A THR 304.A N ARG 352.A O no hydrogen 2.951 N/A THR 304.A OG1 ASN 305.A O no hydrogen 3.043 N/A THR 304.A OG1 GLU 344.A O no hydrogen 2.279 N/A ASN 305.A ND2 ALA 314.A O no hydrogen 3.118 N/A ASN 306.A ND2 SER 343.A OG no hydrogen 2.615 N/A SER 310.A OG ASN 306.A OD1 no hydrogen 3.018 N/A SER 310.A OG THR 312.A O no hydrogen 3.481 N/A THR 312.A OG1 ASN 268.A OD1 no hydrogen 2.327 N/A TYR 313.A N TRP 267.A O no hydrogen 2.759 N/A ASN 317.A N ALA 314.A O no hydrogen 2.837 N/A ASN 317.A ND2 GLN 299.A O no hydrogen 3.623 N/A THR 318.A OG1 THR 342.A O no hydrogen 2.344 N/A PHE 321.A N LEU 340.A O no hydrogen 2.947 N/A ASN 322.A ND2 ASN 338.A O no hydrogen 3.668 N/A SER 323.A OG ASN 338.A O no hydrogen 2.780 N/A LEU 340.A N PHE 321.A O no hydrogen 2.621 N/A THR 342.A OG1 MET 319.A O no hydrogen 2.880 N/A SER 345.A OG GLU 346.A OE1 no hydrogen 3.476 N/A GLU 346.A N GLU 346.A OE1 no hydrogen 2.761 N/A THR 347.A OG1 GLU 344.A O no hydrogen 3.177 N/A THR 347.A OG1 ASN 351.A OD1 no hydrogen 3.326 N/A GLN 348.A N SER 345.A O no hydrogen 3.456 N/A VAL 350.A N THR 347.A O no hydrogen 3.263 N/A ASN 351.A N THR 347.A O no hydrogen 2.956 N/A ARG 352.A NH1 GLN 380.A OE1 no hydrogen 2.902 N/A ARG 352.A NH2 GLY 259.A O no hydrogen 2.810 N/A ARG 352.A NH2 GLN 380.A OE1 no hydrogen 3.334 N/A MET 361.A N GLY 375.A O no hydrogen 3.230 N/A THR 363.A N ALA 373.A O no hydrogen 2.965 N/A ASN 364.A ND2 ALA 371.A O no hydrogen 3.125 N/A SER 367.A N THR 370.A O no hydrogen 3.278 N/A THR 370.A N SER 367.A O no hydrogen 3.307 N/A THR 370.A OG1 ASN 365.A O no hydrogen 3.283 N/A ALA 373.A N ASN 364.A OD1 no hydrogen 2.832 N/A THR 374.A OG1 GLN 360.A OE1 no hydrogen 3.035 N/A TYR 377.A OH GLN 380.A OE1 no hydrogen 2.767 N/A GLN 380.A N MET 261.A O no hydrogen 3.236 N/A VAL 383.A N SER 386.A OG no hydrogen 3.304 N/A SER 386.A N VAL 383.A O no hydrogen 3.136 N/A SER 386.A OG PRO 258.A O no hydrogen 3.455 N/A SER 386.A OG VAL 383.A O no hydrogen 2.630 N/A VAL 387.A N PHE 257.A O no hydrogen 2.721 N/A ARG 391.A NE ALA 415.A O no hydrogen 2.911 N/A ARG 391.A NH1 ASN 317.A O no hydrogen 3.046 N/A ARG 391.A NH2 ASN 317.A O no hydrogen 3.229 N/A ASP 392.A N GLU 344.A OE1 no hydrogen 3.285 N/A TYR 394.A OH SER 343.A O no hydrogen 3.312 N/A TYR 394.A OH GLU 344.A OE2 no hydrogen 2.584 N/A LEU 395.A N ILE 507.A O no hydrogen 3.400 N/A ILE 399.A N ASN 68.A OD1 no hydrogen 2.832 N/A TRP 400.A N ASN 68.A OD1 no hydrogen 2.832 N/A TRP 400.A NE1 TYR 135.A OH no hydrogen 2.416 N/A ALA 401.A N PHE 419.A O no hydrogen 2.919 N/A LYS 402.A NZ ILE 403.A O no hydrogen 3.252 N/A ILE 403.A N LEU 421.A O no hydrogen 3.022 N/A THR 406.A OG1 ALA 408.A O no hydrogen 2.875 N/A SER 413.A N HIS 411.A O no hydrogen 2.659 N/A SER 413.A OG ASN 301.A OD1 no hydrogen 2.671 N/A GLY 417.A N PRO 414.A O no hydrogen 3.096 N/A PHE 419.A N ILE 399.A O no hydrogen 2.993 N/A LEU 421.A N ALA 401.A O no hydrogen 2.986 N/A LYS 422.A N GLU 201.A OE2 no hydrogen 2.895 N/A LYS 422.A NZ PRO 404.A O no hydrogen 3.558 N/A LEU 429.A N PHE 126.A O no hydrogen 2.990 N/A ILE 430.A N GLY 63.A O no hydrogen 2.772 N/A LYS 431.A N GLN 124.A O no hydrogen 3.213 N/A LYS 431.A NZ ASN 432.A O no hydrogen 2.429 N/A ASN 432.A ND2 LEU 31.A O no hydrogen 3.357 N/A THR 433.A OG1 THR 122.A O no hydrogen 2.891 N/A THR 433.A OG1 THR 122.A OG1 no hydrogen 2.633 N/A ILE 451.A N VAL 435.A O no hydrogen 2.761 N/A TYR 454.A N LYS 104.A O no hydrogen 3.161 N/A SER 455.A N LEU 31.A O no hydrogen 3.205 N/A SER 455.A OG ASN 432.A OD1 no hydrogen 2.558 N/A THR 456.A N GLN 102.A O no hydrogen 2.812 N/A THR 456.A OG1 TRP 29.A O no hydrogen 2.608 N/A GLY 457.A N TRP 29.A O no hydrogen 3.238 N/A GLN 458.A N PHE 99.A O no hydrogen 2.925 N/A GLN 458.A NE2 THR 28.A OG1 no hydrogen 3.284 N/A VAL 459.A N ARG 27.A O no hydrogen 2.874 N/A THR 460.A N LYS 97.A O no hydrogen 2.872 N/A THR 460.A OG1 SER 25.A O no hydrogen 3.500 N/A THR 460.A OG1 THR 26.A OG1 no hydrogen 3.197 N/A VAL 461.A N SER 25.A O no hydrogen 3.023 N/A GLU 462.A N ARG 95.A O no hydrogen 2.718 N/A MET 463.A N THR 23.A O no hydrogen 3.310 N/A GLU 464.A N SER 93.A O no hydrogen 3.157 N/A TRP 465.A N VAL 21.A O no hydrogen 2.839 N/A TRP 465.A NE1 THR 23.A OG1 no hydrogen 3.338 N/A GLU 466.A N ARG 90.A O no hydrogen 2.989 N/A LEU 467.A N ASP 19.A O no hydrogen 3.254 N/A LYS 468.A N GLY 88.A O no hydrogen 2.863 N/A SER 472.A OG GLU 470.A OE2 no hydrogen 2.323 N/A ARG 474.A NE ASN 476.A OD1 no hydrogen 2.618 N/A ARG 474.A NH1 THR 513.A OG1 no hydrogen 2.479 N/A ARG 474.A NH2 ASN 476.A OD1 no hydrogen 3.468 N/A ASP 487.A N TYR 485.A O no hydrogen 2.836 N/A PHE 493.A N ASP 492.A OD1 no hydrogen 2.739 N/A PHE 493.A N ARG 502.A O no hydrogen 2.905 N/A GLY 499.A N ASP 496.A OD1 no hydrogen 3.163 N/A GLU 500.A N ASP 496.A OD1 no hydrogen 2.681 N/A ARG 502.A N ALA 494.A O no hydrogen 3.440 N/A THR 503.A OG1 SER 323.A O no hydrogen 3.037 N/A THR 504.A N ASP 492.A OD1 no hydrogen 3.119 N/A THR 504.A OG1 ASP 492.A OD1 no hydrogen 3.048 N/A ARG 505.A NE TYR 481.A OH no hydrogen 3.086 N/A ARG 505.A NH1 ASN 484.A OD1 no hydrogen 3.160 N/A ARG 505.A NH2 TYR 481.A OH no hydrogen 3.557 N/A ARG 505.A NH2 ASN 484.A OD1 no hydrogen 2.741 N/A THR 509.A N ASP 392.A OD2 no hydrogen 2.922 N/A THR 509.A OG1 ASP 392.A OD1 no hydrogen 3.210 N/A THR 509.A OG1 VAL 393.A O no hydrogen 2.699 N/A