Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7k1j_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N GLU 123.A OE2 no hydrogen 3.417 N/A ASN 1.A ND2 GLU 123.A OE1 no hydrogen 2.450 N/A VAL 5.A N GLU 48.A O no hydrogen 2.939 N/A VAL 6.A N HIS 126.A O no hydrogen 2.937 N/A LEU 7.A N ALA 50.A O no hydrogen 2.891 N/A CYS 8.A N GLU 128.A O no hydrogen 2.871 N/A MET 9.A N VAL 52.A O no hydrogen 2.969 N/A ASP 10.A N PHE 130.A O no hydrogen 3.022 N/A VAL 11.A N PHE 54.A O no hydrogen 2.437 N/A GLY 12.A N ASP 10.A OD1 no hydrogen 2.775 N/A SER 16.A N GLY 12.A O no hydrogen 2.419 N/A SER 16.A OG GLY 12.A O no hydrogen 2.944 N/A SER 18.A N ASN 17.A OD1 no hydrogen 2.789 N/A SER 24.A OG GLU 27.A OE1 no hydrogen 2.912 N/A GLN 28.A N SER 24.A O no hydrogen 3.001 N/A ALA 29.A N PRO 25.A O no hydrogen 2.923 N/A LYS 30.A N PHE 26.A O no hydrogen 3.017 N/A LYS 30.A NZ LYS 92.A O no hydrogen 2.549 N/A LYS 31.A N GLU 27.A O no hydrogen 2.939 N/A LYS 31.A NZ GLU 27.A OE2 no hydrogen 2.699 N/A VAL 32.A N GLN 28.A O no hydrogen 3.014 N/A ILE 33.A N ALA 29.A O no hydrogen 3.008 N/A THR 34.A N LYS 30.A O no hydrogen 2.990 N/A MET 35.A N LYS 31.A O no hydrogen 2.947 N/A PHE 36.A N VAL 32.A O no hydrogen 3.066 N/A VAL 37.A N ILE 33.A O no hydrogen 2.998 N/A GLN 38.A N THR 34.A O no hydrogen 2.912 N/A ARG 39.A N MET 35.A O no hydrogen 3.112 N/A GLN 40.A N PHE 36.A O no hydrogen 3.039 N/A VAL 41.A N VAL 37.A O no hydrogen 2.941 N/A PHE 42.A N GLN 38.A O no hydrogen 2.956 N/A LYS 46.A NZ ASN 1.A O no hydrogen 2.445 N/A GLU 48.A N ALA 3.A O no hydrogen 2.945 N/A ILE 49.A N MET 79.A O no hydrogen 2.884 N/A ALA 50.A N VAL 5.A O no hydrogen 3.001 N/A LEU 51.A N ARG 76.A O no hydrogen 3.160 N/A VAL 52.A N LEU 7.A O no hydrogen 2.902 N/A PHE 54.A N MET 9.A O no hydrogen 3.016 N/A GLY 55.A N ASN 71.A O no hydrogen 3.290 N/A THR 56.A OG1 THR 73.A OG1 no hydrogen 3.404 N/A ASP 60.A N ILE 72.A O no hydrogen 2.525 N/A ASN 61.A ND2 LEU 63.A O no hydrogen 2.444 N/A SER 64.A OG TYR 69.A O no hydrogen 2.657 N/A GLN 68.A N GLY 65.A O no hydrogen 3.112 N/A TYR 69.A N ASP 104.A OD2 no hydrogen 3.301 N/A THR 73.A N LEU 53.A O no hydrogen 3.275 N/A THR 73.A OG1 LEU 53.A O no hydrogen 3.287 N/A THR 73.A OG1 THR 56.A OG1 no hydrogen 3.404 N/A HIS 75.A ND1 ASP 88.A OD1 no hydrogen 2.575 N/A MET 79.A N ILE 49.A O no hydrogen 2.970 N/A LEU 85.A N ASP 82.A O no hydrogen 3.349 N/A LEU 85.A N ASP 84.A OD1 no hydrogen 2.622 N/A GLU 87.A N PHE 83.A O no hydrogen 2.889 N/A ASP 88.A N ASP 84.A O no hydrogen 2.884 N/A ILE 89.A N LEU 85.A O no hydrogen 2.900 N/A GLU 90.A N LEU 86.A O no hydrogen 2.874 N/A SER 91.A N GLU 87.A O no hydrogen 2.877 N/A SER 91.A OG GLU 87.A O no hydrogen 2.584 N/A GLN 98.A N GLY 55.A O no hydrogen 3.212 N/A GLN 98.A NE2 ASP 57.A OD1 no hydrogen 2.845 N/A GLN 99.A NE2 ASP 101.A O no hydrogen 2.432 N/A PHE 102.A N ASP 101.A OD1 no hydrogen 2.641 N/A LEU 103.A N ASP 101.A OD1 no hydrogen 2.883 N/A ASP 104.A N ASP 104.A OD1 no hydrogen 2.359 N/A VAL 108.A N ASP 104.A O no hydrogen 3.019 N/A SER 109.A N ALA 105.A O no hydrogen 2.942 N/A SER 109.A OG ALA 105.A O no hydrogen 2.817 N/A SER 109.A OG LEU 106.A O no hydrogen 2.497 N/A MET 110.A N LEU 106.A O no hydrogen 3.008 N/A ASP 111.A N ILE 107.A O no hydrogen 2.928 N/A VAL 112.A N VAL 108.A O no hydrogen 2.930 N/A ILE 113.A N SER 109.A O no hydrogen 2.965 N/A GLN 114.A N MET 110.A O no hydrogen 3.007 N/A HIS 115.A N ASP 111.A O no hydrogen 2.906 N/A HIS 115.A ND1 ASP 111.A O no hydrogen 3.215 N/A GLU 116.A N ILE 113.A O no hydrogen 3.224 N/A THR 117.A N ILE 113.A O no hydrogen 2.965 N/A LYS 121.A NZ THR 117.A OG1 no hydrogen 3.129 N/A GLU 123.A N LYS 2.A O no hydrogen 3.125 N/A LYS 124.A NZ GLU 123.A OE2 no hydrogen 2.754 N/A LYS 124.A NZ ILE 225.A O no hydrogen 3.322 N/A HIS 126.A N ALA 4.A O no hydrogen 2.997 N/A HIS 126.A NE2 GLN 157.A OE1 no hydrogen 2.930 N/A ILE 127.A N SER 155.A O no hydrogen 2.938 N/A GLU 128.A N VAL 6.A O no hydrogen 2.910 N/A ILE 129.A N GLN 157.A O no hydrogen 2.925 N/A PHE 130.A N CYS 8.A O no hydrogen 2.914 N/A SER 134.A OG LEU 133.A O no hydrogen 2.936 N/A SER 138.A OG ASP 101.A OD2 no hydrogen 3.436 N/A ILE 146.A N LEU 142.A O no hydrogen 2.953 N/A HIS 147.A N ASP 143.A O no hydrogen 2.915 N/A SER 148.A N ILE 144.A O no hydrogen 2.888 N/A LEU 149.A N ILE 145.A O no hydrogen 2.938 N/A LYS 150.A N ILE 146.A O no hydrogen 2.908 N/A LYS 150.A NZ LEU 200.A O no hydrogen 3.011 N/A LYS 151.A N HIS 147.A O no hydrogen 2.904 N/A CYS 152.A N SER 148.A O no hydrogen 2.934 N/A CYS 152.A SG SER 148.A O no hydrogen 3.234 N/A ASP 153.A N LEU 149.A O no hydrogen 3.190 N/A SER 155.A N ARG 125.A O no hydrogen 2.925 N/A GLN 157.A N ILE 127.A O no hydrogen 2.859 N/A GLN 157.A NE2 CYS 220.A O no hydrogen 2.658 N/A LEU 160.A N TYR 210.A O no hydrogen 2.910 N/A SER 176.A OG PHE 162.A O no hydrogen 2.312 N/A THR 183.A OG1 GLN 186.A OE1 no hydrogen 2.717 N/A GLN 185.A NE2 SER 134.A O no hydrogen 2.799 N/A GLN 186.A NE2 LEU 133.A O no hydrogen 2.412 N/A LYS 187.A N THR 183.A O no hydrogen 2.917 N/A LYS 187.A NZ LYS 187.A O no hydrogen 3.348 N/A GLU 188.A N GLU 184.A O no hydrogen 2.874 N/A GLY 189.A N GLN 185.A O no hydrogen 2.993 N/A LEU 190.A N GLN 186.A O no hydrogen 2.944 N/A GLU 191.A N LYS 187.A O no hydrogen 2.944 N/A ILE 192.A N GLU 188.A O no hydrogen 3.017 N/A VAL 193.A N GLY 189.A O no hydrogen 2.993 N/A LYS 194.A N LEU 190.A O no hydrogen 2.924 N/A MET 195.A N GLU 191.A O no hydrogen 2.916 N/A VAL 196.A N ILE 192.A O no hydrogen 2.993 N/A MET 197.A N VAL 193.A O no hydrogen 2.969 N/A ILE 198.A N LYS 194.A O no hydrogen 2.894 N/A SER 199.A N MET 195.A O no hydrogen 2.971 N/A SER 199.A OG MET 195.A O no hydrogen 2.309 N/A SER 199.A OG VAL 196.A O no hydrogen 3.254 N/A LEU 200.A N VAL 196.A O no hydrogen 2.937 N/A GLU 201.A N MET 197.A O no hydrogen 2.950 N/A GLY 202.A N ILE 198.A O no hydrogen 2.888 N/A GLY 205.A N GLY 202.A O no hydrogen 3.140 N/A LEU 206.A N GLU 203.A O no hydrogen 2.951 N/A ASP 207.A N ASP 204.A O no hydrogen 2.916 N/A GLU 208.A N ASP 204.A O no hydrogen 2.565 N/A TYR 210.A N PHE 158.A O no hydrogen 2.915 N/A SER 211.A OG SER 213.A OG no hydrogen 2.364 N/A SER 213.A OG SER 211.A OG no hydrogen 2.364 N/A SER 215.A OG SER 211.A O no hydrogen 2.673 N/A LYS 218.A NZ GLU 214.A OE2 no hydrogen 2.653 N/A CYS 220.A SG GLU 214.A O no hydrogen 4.029 N/A PHE 222.A N LEU 219.A O no hydrogen 2.753 N/A GLU 226.A N GLU 226.A OE1 no hydrogen 2.830 N/A TRP 232.A N ALA 248.A O no hydrogen 3.087 N/A CYS 234.A N ILE 246.A O no hydrogen 2.944 N/A LEU 236.A N ILE 244.A O no hydrogen 2.848 N/A ILE 244.A N LEU 236.A O no hydrogen 2.913 N/A ARG 245.A NH2 ASP 354.A O no hydrogen 2.700 N/A ILE 246.A N CYS 234.A O no hydrogen 2.909 N/A ALA 247.A N ALA 351.A O no hydrogen 2.682 N/A ALA 248.A N TRP 232.A O no hydrogen 2.871 N/A TYR 249.A N LYS 348.A O no hydrogen 2.923 N/A THR 268.A OG1 ASP 265.A O no hydrogen 3.357 N/A THR 268.A OG1 ASP 265.A OD1 no hydrogen 2.921 N/A THR 268.A OG1 ASP 265.A OD2 no hydrogen 3.183 N/A THR 268.A OG1 ASP 273.A OD2 no hydrogen 3.021 N/A LYS 271.A NZ LYS 271.A O no hydrogen 3.328 N/A GLU 272.A N GLU 272.A OE1 no hydrogen 2.925 N/A CYS 281.A SG THR 288.A O no hydrogen 3.294 N/A ASN 283.A ND2 GLU 287.A OE2 no hydrogen 2.915 N/A ASP 284.A N ASN 283.A OD1 no hydrogen 2.688 N/A THR 288.A OG1 LEU 282.A O no hydrogen 2.297 N/A PHE 299.A N VAL 306.A O no hydrogen 2.912 N/A TYR 301.A N ASP 304.A O no hydrogen 2.911 N/A SER 303.A OG SER 303.A O no hydrogen 2.332 N/A ASP 304.A N TYR 301.A O no hydrogen 2.937 N/A VAL 306.A N PHE 299.A O no hydrogen 2.847 N/A GLU 314.A N LYS 310.A O no hydrogen 2.624 N/A GLN 315.A N VAL 311.A O no hydrogen 2.904 N/A MET 316.A N ASP 312.A O no hydrogen 2.825 N/A LYS 319.A NZ GLN 315.A O no hydrogen 2.461 N/A SER 320.A OG LYS 384.A O no hydrogen 3.427 N/A CYS 324.A SG ARG 379.A O no hydrogen 3.513 N/A LEU 328.A N ILE 377.A O no hydrogen 2.967 N/A CYS 331.A N VAL 375.A O no hydrogen 3.195 N/A CYS 331.A SG SER 333.A O no hydrogen 3.231 N/A CYS 331.A SG SER 333.A OG no hydrogen 2.686 N/A SER 334.A OG ASP 373.A O no hydrogen 2.313 N/A GLN 337.A N GLN 337.A OE1 no hydrogen 2.611 N/A LEU 347.A N TYR 406.A O no hydrogen 3.066 N/A VAL 349.A N LEU 404.A O no hydrogen 2.875 N/A PHE 350.A N ALA 247.A O no hydrogen 2.890 N/A ARG 353.A NH1 TYR 249.A OH no hydrogen 2.455 N/A ASP 354.A N GLU 356.A OE1 no hydrogen 2.533 N/A GLU 356.A N GLU 356.A OE2 no hydrogen 2.797 N/A ALA 357.A N ASP 355.A O no hydrogen 2.868 N/A VAL 360.A N GLU 356.A O no hydrogen 2.949 N/A ALA 361.A N ALA 357.A O no hydrogen 2.939 N/A LEU 362.A N ALA 358.A O no hydrogen 2.921 N/A SER 363.A N ALA 359.A O no hydrogen 2.890 N/A SER 363.A OG ALA 359.A O no hydrogen 3.191 N/A SER 363.A OG VAL 360.A O no hydrogen 2.791 N/A SER 364.A N VAL 360.A O no hydrogen 2.944 N/A SER 364.A OG ALA 361.A O no hydrogen 2.280 N/A LEU 365.A N ALA 361.A O no hydrogen 2.921 N/A ILE 366.A N LEU 362.A O no hydrogen 2.909 N/A HIS 367.A N SER 363.A O no hydrogen 2.830 N/A HIS 367.A ND1 ASP 370.A OD2 no hydrogen 2.981 N/A ALA 368.A N LEU 365.A O no hydrogen 3.152 N/A LEU 369.A N LEU 365.A O no hydrogen 2.923 N/A MET 374.A N LEU 372.A O no hydrogen 2.771 N/A VAL 375.A N CYS 331.A O no hydrogen 2.685 N/A ILE 377.A N GLY 329.A O no hydrogen 3.481 N/A VAL 378.A N GLY 391.A O no hydrogen 2.873 N/A ARG 379.A N SER 326.A O no hydrogen 2.870 N/A TYR 380.A N GLN 389.A O no hydrogen 2.910 N/A ALA 381.A N CYS 324.A O no hydrogen 2.923 N/A ALA 386.A N ASP 383.A OD1 no hydrogen 3.090 N/A GLN 389.A N TYR 380.A O no hydrogen 2.956 N/A GLY 391.A N VAL 378.A O no hydrogen 2.948 N/A VAL 392.A N VAL 407.A O no hydrogen 2.955 N/A ALA 393.A N ALA 376.A O no hydrogen 2.964 N/A PHE 394.A N VAL 405.A O no hydrogen 2.906 N/A HIS 396.A N CYS 403.A O no hydrogen 2.884 N/A LYS 398.A N TYR 401.A O no hydrogen 3.208 N/A CYS 403.A N HIS 396.A O no hydrogen 2.960 N/A LEU 404.A N VAL 349.A O no hydrogen 2.993 N/A VAL 405.A N PHE 394.A O no hydrogen 2.884 N/A TYR 406.A N LEU 347.A O no hydrogen 2.813 N/A VAL 407.A N VAL 392.A O no hydrogen 3.036 N/A GLN 408.A NE2 GLN 389.A OE1 no hydrogen 3.627 N/A ASP 414.A N PHE 411.A O no hydrogen 2.977 N/A SER 426.A OG LEU 423.A O no hydrogen 2.685 N/A THR 432.A N GLN 435.A OE1 no hydrogen 2.883 N/A LEU 436.A N THR 432.A O no hydrogen 2.912 N/A ASN 437.A N GLU 433.A O no hydrogen 2.843 N/A ALA 438.A N ALA 434.A O no hydrogen 2.896 N/A VAL 439.A N GLN 435.A O no hydrogen 2.994 N/A ASP 440.A N LEU 436.A O no hydrogen 2.917 N/A ALA 441.A N ASN 437.A O no hydrogen 2.850 N/A LEU 442.A N ALA 438.A O no hydrogen 2.960 N/A ILE 443.A N VAL 439.A O no hydrogen 2.894 N/A ASP 444.A N ASP 440.A O no hydrogen 2.913 N/A SER 445.A N ALA 441.A O no hydrogen 2.907 N/A SER 445.A OG ALA 441.A O no hydrogen 2.317 N/A SER 445.A OG LEU 442.A O no hydrogen 3.225 N/A MET 446.A N LEU 442.A O no hydrogen 2.895 N/A SER 447.A OG ILE 443.A O no hydrogen 2.348 N/A LYS 450.A N GLU 459.A O no hydrogen 2.960 N/A LYS 451.A NZ ASP 456.A O no hydrogen 3.481 N/A ASP 456.A N ASP 452.A O no hydrogen 3.269 N/A GLU 459.A N LYS 450.A O no hydrogen 2.928 N/A LEU 461.A N LEU 448.A O no hydrogen 2.468 N/A THR 464.A OG1 THR 464.A O no hydrogen 2.418 N/A THR 465.A N PRO 463.A O no hydrogen 2.753 N/A LYS 466.A N PRO 463.A O no hydrogen 3.488 N/A ARG 474.A N PRO 470.A O no hydrogen 2.889 N/A LEU 475.A N ARG 471.A O no hydrogen 2.993 N/A PHE 476.A N PHE 472.A O no hydrogen 2.910 N/A GLN 477.A N GLN 473.A O no hydrogen 2.958 N/A GLN 477.A NE2 ARG 474.A O no hydrogen 3.665 N/A CYS 478.A N ARG 474.A O no hydrogen 3.039 N/A LEU 479.A N LEU 475.A O no hydrogen 3.023 N/A LEU 480.A N PHE 476.A O no hydrogen 2.998 N/A HIS 481.A N GLN 477.A O no hydrogen 2.927 N/A ARG 482.A N CYS 478.A O no hydrogen 3.009 N/A ALA 483.A N LEU 479.A O no hydrogen 2.910 N/A LEU 484.A N HIS 481.A O no hydrogen 3.213 N/A HIS 485.A N HIS 481.A O no hydrogen 3.016 N/A GLU 488.A N HIS 485.A O no hydrogen 3.218 N/A ASN 499.A N GLN 495.A O no hydrogen 2.919 N/A MET 500.A N HIS 496.A O no hydrogen 2.868 N/A MET 500.A N ILE 497.A O no hydrogen 3.073 N/A LEU 501.A N ILE 497.A O no hydrogen 2.937 N/A THR 508.A OG1 ALA 505.A O no hydrogen 2.292 N/A THR 509.A N ALA 505.A O no hydrogen 3.009 N/A THR 509.A OG1 GLU 506.A O no hydrogen 2.768 N/A LYS 510.A N GLU 506.A O no hydrogen 2.851 N/A SER 511.A N VAL 507.A O no hydrogen 2.957 N/A SER 511.A OG VAL 507.A O no hydrogen 2.753 N/A SER 511.A OG THR 508.A O no hydrogen 2.759 N/A GLN 512.A NE2 THR 508.A O no hydrogen 3.549 N/A LEU 515.A N SER 511.A O no hydrogen 2.932 N/A SER 516.A N GLN 512.A O no hydrogen 3.301 N/A SER 516.A OG GLN 512.A O no hydrogen 3.100 N/A LYS 517.A N ILE 513.A O no hydrogen 2.938 N/A ILE 518.A N PRO 514.A O no hydrogen 2.855 N/A LYS 519.A N LEU 515.A O no hydrogen 3.027 N/A THR 520.A N SER 516.A O no hydrogen 2.922 N/A THR 520.A OG1 SER 516.A O no hydrogen 2.563 N/A THR 520.A OG1 LYS 517.A O no hydrogen 2.973 N/A LEU 521.A N LYS 517.A O no hydrogen 2.921 N/A PHE 522.A N ILE 518.A O no hydrogen 3.014 N/A