Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8w1i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A OG1 VAL 3.A O no hydrogen 2.948 N/A LYS 8.A N PRO 4.A O no hydrogen 2.920 N/A ILE 9.A N ASP 5.A O no hydrogen 2.912 N/A LEU 10.A N VAL 6.A O no hydrogen 2.880 N/A ASP 11.A N GLN 7.A O no hydrogen 2.939 N/A ASP 12.A N LYS 8.A O no hydrogen 2.921 N/A ILE 13.A N ILE 9.A O no hydrogen 2.862 N/A LYS 14.A N LEU 10.A O no hydrogen 2.938 N/A ALA 15.A N ASP 11.A O no hydrogen 2.901 N/A LEU 16.A N ASP 12.A O no hydrogen 2.880 N/A ALA 17.A N ILE 13.A O no hydrogen 2.899 N/A ALA 18.A N ALA 15.A O no hydrogen 3.314 N/A LYS 23.A NZ SER 84.A O no hydrogen 2.393 N/A VAL 25.A N ILE 86.A O no hydrogen 3.118 N/A SER 31.A N GLY 107.A O no hydrogen 3.309 N/A SER 31.A OG SER 29.A O no hydrogen 3.417 N/A ARG 33.A N VAL 46.A O no hydrogen 2.887 N/A ILE 35.A N LEU 44.A O no hydrogen 2.912 N/A GLN 38.A NE2 VAL 772.A O no hydrogen 3.446 N/A SER 39.A OG ASP 41.A OD1 no hydrogen 2.933 N/A SER 39.A OG ARG 42.A O no hydrogen 3.239 N/A SER 39.A OG GLN 665.A O no hydrogen 2.609 N/A ARG 40.A NE VAL 116.A O no hydrogen 3.022 N/A ARG 40.A NH1 VAL 116.A O no hydrogen 3.319 N/A ASP 41.A N SER 39.A OG no hydrogen 3.425 N/A ARG 42.A N SER 39.A OG no hydrogen 2.946 N/A VAL 43.A N VAL 803.A O no hydrogen 2.935 N/A LEU 44.A N ILE 35.A O no hydrogen 2.943 N/A ARG 45.A N GLU 801.A O no hydrogen 2.871 N/A ARG 45.A NE GLU 801.A OE2 no hydrogen 2.391 N/A ARG 45.A NH2 GLN 807.A O no hydrogen 3.337 N/A ARG 45.A NH2 ILE 808.A O no hydrogen 3.225 N/A VAL 46.A N ARG 33.A O no hydrogen 2.938 N/A THR 48.A N SER 31.A O no hydrogen 2.799 N/A THR 48.A OG1 GLU 51.A OE2 no hydrogen 2.909 N/A TYR 50.A N ASP 47.A O no hydrogen 3.390 N/A TYR 50.A OH ASP 638.A OD1 no hydrogen 2.426 N/A GLU 52.A N THR 48.A O no hydrogen 2.920 N/A MET 53.A N TYR 49.A O no hydrogen 2.928 N/A SER 54.A N GLU 51.A O no hydrogen 3.186 N/A SER 54.A OG GLU 51.A O no hydrogen 2.555 N/A GLN 55.A NE2 GLU 52.A O no hydrogen 2.294 N/A THR 61.A OG1 GLU 64.A OE2 no hydrogen 2.567 N/A GLU 62.A N GLU 62.A OE1 no hydrogen 2.709 N/A GLU 64.A N THR 61.A O no hydrogen 3.046 N/A LYS 67.A NZ ASP 58.A O no hydrogen 2.737 N/A LYS 67.A NZ VAL 59.A O no hydrogen 2.802 N/A LYS 67.A NZ THR 71.A OG1 no hydrogen 2.970 N/A PHE 68.A N GLU 64.A O no hydrogen 2.986 N/A TYR 69.A N PRO 65.A O no hydrogen 2.864 N/A SER 70.A N GLU 66.A O no hydrogen 2.921 N/A SER 70.A OG GLU 66.A O no hydrogen 2.712 N/A THR 71.A N LYS 67.A O no hydrogen 2.874 N/A THR 71.A OG1 LYS 67.A O no hydrogen 2.685 N/A ILE 72.A N PHE 68.A O no hydrogen 2.902 N/A ILE 73.A N TYR 69.A O no hydrogen 2.946 N/A LYS 74.A N SER 70.A O no hydrogen 3.039 N/A LYS 75.A N THR 71.A O no hydrogen 2.937 N/A VAL 76.A N ILE 72.A O no hydrogen 2.974 N/A ARG 77.A N ILE 73.A O no hydrogen 2.925 N/A PHE 78.A N LYS 74.A O no hydrogen 2.877 N/A ILE 79.A N LYS 75.A O no hydrogen 2.969 N/A ARG 80.A N VAL 76.A O no hydrogen 2.891 N/A GLY 81.A N ARG 77.A O no hydrogen 2.889 N/A LYS 82.A N PHE 78.A O no hydrogen 2.940 N/A LYS 82.A NZ GLU 52.A OE1 no hydrogen 2.943 N/A LYS 82.A NZ GLU 52.A OE2 no hydrogen 2.550 N/A SER 84.A OG VAL 21.A O no hydrogen 3.078 N/A SER 84.A OG GLY 81.A O no hydrogen 3.494 N/A PHE 85.A N GLY 83.A O no hydrogen 2.794 N/A ILE 86.A N LYS 23.A O no hydrogen 2.524 N/A HIS 88.A N VAL 25.A O no hydrogen 2.971 N/A HIS 88.A NE2 LYS 820.A O no hydrogen 2.956 N/A THR 92.A OG1 ARG 93.A O no hydrogen 2.979 N/A THR 92.A OG1 VAL 100.A O no hydrogen 2.361 N/A ARG 93.A N VAL 100.A O no hydrogen 2.888 N/A HIS 95.A N MET 98.A O no hydrogen 2.921 N/A MET 98.A N HIS 95.A O no hydrogen 2.916 N/A VAL 100.A N ARG 93.A O no hydrogen 2.866 N/A GLY 107.A N GLU 104.A O no hydrogen 3.176 N/A LYS 111.A NZ PRO 103.A O no hydrogen 3.013 N/A LYS 111.A NZ VAL 108.A O no hydrogen 3.418 N/A VAL 113.A N PHE 110.A O no hydrogen 3.458 N/A LEU 117.A N LEU 114.A O no hydrogen 2.936 N/A THR 118.A OG1 HIS 121.A ND1 no hydrogen 2.850 N/A GLU 120.A N GLU 120.A OE1 no hydrogen 2.647 N/A ARG 122.A N THR 118.A O no hydrogen 3.117 N/A ALA 123.A N ALA 119.A O no hydrogen 2.902 N/A MET 124.A N GLU 120.A O no hydrogen 2.897 N/A ILE 125.A N HIS 121.A O no hydrogen 2.914 N/A GLN 126.A N ARG 122.A O no hydrogen 2.905 N/A ASN 127.A N ALA 123.A O no hydrogen 2.919 N/A ALA 128.A N MET 124.A O no hydrogen 2.884 N/A LEU 129.A N ILE 125.A O no hydrogen 2.878 N/A ASP 130.A N GLN 126.A O no hydrogen 2.932 N/A GLY 131.A N ALA 128.A O no hydrogen 2.916 N/A SER 132.A N LEU 129.A O no hydrogen 3.327 N/A SER 132.A OG LEU 129.A O no hydrogen 2.991 N/A GLU 135.A N VAL 146.A O no hydrogen 2.881 N/A VAL 139.A N ARG 142.A O no hydrogen 3.044 N/A ARG 142.A N ASN 138.A OD1 no hydrogen 2.387 N/A VAL 144.A N GLY 137.A O no hydrogen 2.894 N/A ASP 145.A N ALA 818.A O no hydrogen 2.892 N/A VAL 146.A N GLU 135.A O no hydrogen 2.927 N/A PHE 147.A N PHE 816.A O no hydrogen 2.920 N/A GLY 149.A N ARG 814.A O no hydrogen 2.841 N/A ALA 150.A N LEU 106.A O no hydrogen 3.256 N/A CYS 151.A SG SER 152.A O no hydrogen 3.373 N/A GLU 153.A N GLU 153.A OE1 no hydrogen 3.003 N/A TYR 156.A N SER 152.A O no hydrogen 2.781 N/A TYR 156.A OH ARG 815.A O no hydrogen 2.507 N/A ARG 157.A N GLU 153.A O no hydrogen 2.904 N/A TYR 159.A N VAL 155.A O no hydrogen 2.936 N/A ASN 160.A N TYR 156.A O no hydrogen 2.891 N/A ARG 161.A N ARG 157.A O no hydrogen 2.928 N/A LEU 162.A N ILE 158.A O no hydrogen 2.901 N/A GLN 163.A N TYR 159.A O no hydrogen 2.953 N/A GLN 163.A NE2 TYR 819.A OH no hydrogen 3.063 N/A GLY 164.A N ASN 160.A O no hydrogen 2.909 N/A TYR 165.A N ARG 161.A O no hydrogen 2.892 N/A TYR 165.A OH LEU 209.A O no hydrogen 2.777 N/A ILE 166.A N LEU 162.A O no hydrogen 2.902 N/A GLU 167.A N GLN 163.A O no hydrogen 2.942 N/A ALA 168.A N GLY 164.A O no hydrogen 2.920 N/A VAL 169.A N TYR 165.A O no hydrogen 2.875 N/A GLN 170.A N ILE 166.A O no hydrogen 2.876 N/A LEU 171.A N ALA 168.A O no hydrogen 3.223 N/A GLN 172.A N ALA 168.A O no hydrogen 3.271 N/A SER 177.A N GLU 173.A O no hydrogen 2.887 N/A SER 177.A OG GLU 173.A O no hydrogen 2.789 N/A ILE 178.A N LEU 174.A O no hydrogen 2.868 N/A GLY 179.A N ARG 175.A O no hydrogen 2.920 N/A TRP 180.A N ASN 176.A O no hydrogen 2.898 N/A TRP 180.A NE1 PRO 406.A O no hydrogen 2.951 N/A LEU 181.A N SER 177.A O no hydrogen 3.006 N/A GLU 182.A N ILE 178.A O no hydrogen 2.900 N/A ARG 183.A N GLY 179.A O no hydrogen 2.908 N/A LEU 184.A N TRP 180.A O no hydrogen 2.948 N/A GLY 185.A N LEU 181.A O no hydrogen 2.866 N/A HIS 186.A N GLU 182.A O no hydrogen 2.872 N/A ARG 187.A N ARG 183.A O no hydrogen 2.966 N/A LYS 188.A N LEU 184.A O no hydrogen 2.876 N/A LYS 188.A NZ GLU 478.A O no hydrogen 3.349 N/A LYS 188.A NZ ASP 479.A O no hydrogen 2.413 N/A LYS 188.A NZ HIS 481.A O no hydrogen 3.343 N/A ILE 190.A N GLY 185.A O no hydrogen 3.052 N/A THR 191.A N THR 836.A O no hydrogen 2.928 N/A LEU 197.A N GLN 194.A O no hydrogen 3.136 N/A THR 198.A N GLU 195.A O no hydrogen 2.968 N/A THR 198.A OG1 GLN 194.A O no hydrogen 3.173 N/A THR 198.A OG1 GLU 195.A O no hydrogen 2.680 N/A ARG 202.A N ASP 199.A O no hydrogen 3.080 N/A THR 205.A OG1 ARG 201.A O no hydrogen 2.600 N/A ILE 206.A N ARG 824.A O no hydrogen 3.253 N/A TRP 207.A N GLN 170.A OE1 no hydrogen 2.904 N/A ALA 210.A N THR 829.A OG1 no hydrogen 3.030 N/A GLN 218.A N ASN 216.A OD1 no hydrogen 3.057 N/A GLN 218.A NE2 GLN 218.A O no hydrogen 3.543 N/A GLN 218.A NE2 ASP 222.A OD1 no hydrogen 2.778 N/A VAL 219.A N ASN 216.A O no hydrogen 3.059 N/A TRP 221.A N PRO 217.A O no hydrogen 3.115 N/A TRP 221.A NE1 VAL 483.A O no hydrogen 2.863 N/A ASP 222.A N GLN 218.A O no hydrogen 2.773 N/A SER 226.A OG VAL 223.A O no hydrogen 2.989 N/A SER 226.A OG ASN 230.A OD1 no hydrogen 3.512 N/A ASN 230.A N SER 226.A O no hydrogen 2.797 N/A ASN 230.A ND2 SER 226.A OG no hydrogen 3.429 N/A LEU 231.A N SER 227.A O no hydrogen 2.913 N/A ILE 232.A N ILE 228.A O no hydrogen 2.923 N/A MET 233.A N ALA 229.A O no hydrogen 2.954 N/A ASN 234.A N ASN 230.A O no hydrogen 2.848 N/A ILE 235.A N LEU 231.A O no hydrogen 2.964 N/A ALA 236.A N ILE 232.A O no hydrogen 2.897 N/A THR 237.A N MET 233.A O no hydrogen 2.920 N/A THR 237.A OG1 MET 233.A O no hydrogen 3.008 N/A CYS 238.A N ASN 234.A O no hydrogen 2.901 N/A CYS 238.A SG ASN 234.A OD1 no hydrogen 3.520 N/A THR 241.A N HIS 530.A O no hydrogen 3.407 N/A GLU 243.A N GLU 527.A O no hydrogen 2.925 N/A ILE 245.A N SER 525.A O no hydrogen 2.905 N/A ARG 250.A N ASN 248.A OD1 no hydrogen 3.006 N/A ILE 251.A N ASN 248.A O no hydrogen 3.187 N/A SER 252.A OG THR 270.A OG1 no hydrogen 2.516 N/A SER 253.A N PRO 249.A O no hydrogen 2.933 N/A SER 253.A OG PRO 249.A O no hydrogen 2.727 N/A ILE 254.A N ARG 250.A O no hydrogen 2.917 N/A THR 255.A N ILE 251.A O no hydrogen 2.931 N/A THR 255.A OG1 ILE 251.A O no hydrogen 2.387 N/A LEU 256.A N SER 252.A O no hydrogen 3.378 N/A THR 257.A OG1 SER 252.A O no hydrogen 3.464 N/A THR 257.A OG1 SER 253.A O no hydrogen 2.292 N/A THR 262.A OG1 THR 263.A O no hydrogen 3.543 N/A THR 263.A OG1 GLY 264.A O no hydrogen 3.354 N/A ILE 268.A N GLY 264.A O no hydrogen 3.014 N/A LEU 269.A N PRO 265.A O no hydrogen 2.974 N/A THR 270.A N PHE 266.A O no hydrogen 2.884 N/A THR 270.A OG1 SER 252.A OG no hydrogen 2.516 N/A GLY 271.A N ILE 268.A O no hydrogen 3.372 N/A SER 272.A N LEU 269.A O no hydrogen 3.214 N/A SER 272.A OG LEU 269.A O no hydrogen 2.723 N/A THR 275.A N GLN 278.A OE1 no hydrogen 3.189 N/A THR 275.A OG1 GLN 278.A OE1 no hydrogen 2.175 N/A GLN 278.A NE2 GLN 277.A OE1 no hydrogen 3.150 N/A LEU 279.A N THR 275.A O no hydrogen 3.391 N/A ASN 280.A N ALA 276.A O no hydrogen 2.950 N/A ASP 281.A N GLN 277.A O no hydrogen 2.861 N/A VAL 282.A N GLN 278.A O no hydrogen 2.863 N/A ARG 283.A N LEU 279.A O no hydrogen 2.939 N/A LYS 284.A N ASN 280.A O no hydrogen 2.885 N/A LYS 284.A NZ ASP 281.A OD1 no hydrogen 2.691 N/A ILE 285.A N ASP 281.A O no hydrogen 2.864 N/A TYR 286.A N VAL 282.A O no hydrogen 2.956 N/A TYR 286.A OH ARG 524.A O no hydrogen 3.316 N/A LEU 287.A N ARG 283.A O no hydrogen 2.889 N/A ALA 288.A N LYS 284.A O no hydrogen 2.898 N/A LEU 289.A N ILE 285.A O no hydrogen 2.903 N/A MET 290.A N TYR 286.A O no hydrogen 2.928 N/A PHE 291.A N ALA 288.A O no hydrogen 3.219 N/A ILE 296.A N VAL 509.A O no hydrogen 3.271 N/A LEU 297.A N ASN 331.A O no hydrogen 3.477 N/A LYS 300.A N VAL 513.A O no hydrogen 3.135 N/A GLY 304.A N ASP 302.A OD2 no hydrogen 2.820 N/A GLU 305.A N ASP 302.A O no hydrogen 3.002 N/A ARG 312.A N ASP 308.A O no hydrogen 2.992 N/A MET 313.A N PRO 309.A O no hydrogen 2.971 N/A VAL 314.A N ALA 310.A O no hydrogen 2.987 N/A ALA 315.A N VAL 311.A O no hydrogen 2.853 N/A GLY 316.A N ARG 312.A O no hydrogen 2.925 N/A VAL 317.A N MET 313.A O no hydrogen 3.009 N/A VAL 318.A N VAL 314.A O no hydrogen 2.946 N/A GLY 319.A N ALA 315.A O no hydrogen 2.899 N/A HIS 320.A N GLY 316.A O no hydrogen 3.003 N/A HIS 320.A ND1 GLY 316.A O no hydrogen 2.244 N/A HIS 320.A NE2 ASP 341.A OD1 no hydrogen 3.344 N/A LEU 321.A N VAL 318.A O no hydrogen 2.803 N/A LEU 322.A N VAL 318.A O no hydrogen 3.004 N/A ARG 328.A NH1 THR 396.A O no hydrogen 3.433 N/A THR 330.A OG1 ALA 325.A O no hydrogen 3.309 N/A THR 330.A OG1 LEU 332.A O no hydrogen 3.386 N/A GLN 334.A N GLN 334.A OE1 no hydrogen 2.604 N/A ALA 337.A N THR 333.A O no hydrogen 3.405 N/A ARG 338.A N GLN 334.A O no hydrogen 2.951 N/A GLN 339.A N ASN 335.A O no hydrogen 2.951 N/A LEU 340.A N MET 336.A O no hydrogen 2.949 N/A ASP 341.A N ALA 337.A O no hydrogen 2.904 N/A ILE 342.A N ARG 338.A O no hydrogen 2.974 N/A ALA 343.A N GLN 339.A O no hydrogen 2.957 N/A LEU 344.A N LEU 340.A O no hydrogen 2.913 N/A ASN 345.A N ASP 341.A O no hydrogen 2.910 N/A ASP 346.A N ILE 342.A O no hydrogen 2.956 N/A TYR 347.A N ALA 343.A O no hydrogen 2.904 N/A LEU 348.A N LEU 344.A O no hydrogen 2.903 N/A LEU 349.A N ASP 346.A O no hydrogen 3.283 N/A VAL 356.A N ASN 353.A O no hydrogen 3.239 N/A ASN 359.A N GLN 370.A O no hydrogen 2.896 N/A ASN 359.A ND2 GLN 370.A OE1 no hydrogen 3.579 N/A GLY 361.A N ASP 368.A O no hydrogen 2.710 N/A THR 363.A N ASP 368.A OD2 no hydrogen 3.170 N/A THR 363.A OG1 ASP 368.A OD2 no hydrogen 2.362 N/A GLN 370.A N ASN 359.A O no hydrogen 2.871 N/A ILE 371.A N TYR 376.A O no hydrogen 3.362 N/A ARG 373.A NH2 GLN 357.A OE1 no hydrogen 2.333 N/A GLN 375.A N GLY 372.A O no hydrogen 3.012 N/A GLN 375.A NE2 GLN 357.A O no hydrogen 3.675 N/A TYR 376.A N ILE 371.A O no hydrogen 2.842 N/A TYR 376.A OH GLU 441.A OE1 no hydrogen 2.347 N/A CYS 378.A N PHE 369.A O no hydrogen 3.420 N/A CYS 378.A SG TYR 376.A O no hydrogen 3.876 N/A ASN 379.A N ASP 377.A OD1 no hydrogen 3.308 N/A PHE 381.A N CYS 378.A O no hydrogen 3.481 N/A ARG 382.A NE GLU 365.A OE2 no hydrogen 3.538 N/A ARG 382.A NH2 LEU 367.A O no hydrogen 2.449 N/A ALA 386.A N ASP 384.A OD1 no hydrogen 3.277 N/A GLY 388.A N ASP 384.A O no hydrogen 2.729 N/A THR 389.A OG1 VAL 380.A O no hydrogen 3.237 N/A THR 389.A OG1 ARG 382.A O no hydrogen 2.128 N/A ASN 392.A N PHE 323.A O no hydrogen 2.796 N/A ASN 392.A ND2 LEU 321.A O no hydrogen 2.543 N/A THR 396.A OG1 TRP 394.A O no hydrogen 3.125 N/A HIS 409.A NE2 GLN 218.A OE1 no hydrogen 2.847 N/A ALA 410.A N TYR 407.A O no hydrogen 2.817 N/A TYR 413.A OH GLU 403.A OE2 no hydrogen 2.350 N/A ILE 414.A N ASN 477.A OD1 no hydrogen 3.108 N/A ARG 415.A N ASP 398.A O no hydrogen 3.149 N/A ARG 415.A NH2 ILE 419.A O no hydrogen 2.909 N/A ILE 419.A N TYR 416.A O no hydrogen 3.176 N/A ARG 422.A N ASP 420.A OD2 no hydrogen 3.292 N/A ARG 422.A NE ASP 420.A OD1 no hydrogen 3.321 N/A ARG 422.A NE ASP 420.A OD2 no hydrogen 2.727 N/A ARG 422.A NH1 ASP 420.A OD1 no hydrogen 2.754 N/A THR 429.A N ASN 426.A O no hydrogen 3.071 N/A THR 429.A OG1 ASN 426.A O no hydrogen 3.525 N/A TYR 430.A N ASN 426.A O no hydrogen 2.740 N/A THR 435.A OG1 TYR 436.A O no hydrogen 3.412 N/A THR 435.A OG1 ASN 440.A OD1 no hydrogen 2.382 N/A CYS 438.A SG TYR 391.A O no hydrogen 3.261 N/A ASN 440.A N TYR 436.A O no hydrogen 3.503 N/A GLU 441.A N HIS 437.A O no hydrogen 2.949 N/A MET 442.A N CYS 438.A O no hydrogen 2.876 N/A LEU 443.A N TYR 439.A O no hydrogen 2.947 N/A ARG 444.A N ASN 440.A O no hydrogen 2.898 N/A MET 445.A N GLU 441.A O no hydrogen 2.904 N/A LEU 446.A N MET 442.A O no hydrogen 2.914 N/A VAL 447.A N LEU 443.A O no hydrogen 2.920 N/A ALA 448.A N ARG 444.A O no hydrogen 2.880 N/A ALA 449.A N MET 445.A O no hydrogen 2.700 N/A GLY 450.A N VAL 447.A O no hydrogen 2.781 N/A LYS 451.A N LEU 446.A O no hydrogen 3.141 N/A LYS 451.A NZ ALA 449.A O no hydrogen 2.786 N/A SER 453.A OG THR 255.A O no hydrogen 2.596 N/A ALA 456.A N ASP 452.A O no hydrogen 2.963 N/A TYR 457.A N SER 453.A O no hydrogen 2.921 N/A PHE 458.A N GLU 454.A O no hydrogen 2.905 N/A ARG 459.A N ALA 455.A O no hydrogen 2.924 N/A SER 460.A N ALA 456.A O no hydrogen 2.913 N/A SER 460.A OG ALA 456.A O no hydrogen 3.031 N/A SER 460.A OG TYR 457.A O no hydrogen 2.292 N/A MET 461.A N TYR 457.A O no hydrogen 3.005 N/A HIS 465.A N MET 461.A O no hydrogen 3.033 N/A MET 466.A N LEU 462.A O no hydrogen 2.977 N/A VAL 467.A N PRO 463.A O no hydrogen 2.870 N/A ARG 468.A N PHE 464.A O no hydrogen 3.035 N/A ARG 468.A NH2 ARG 524.A O no hydrogen 2.325 N/A PHE 469.A N HIS 465.A O no hydrogen 2.992 N/A ALA 470.A N MET 466.A O no hydrogen 2.768 N/A ARG 471.A N VAL 467.A O no hydrogen 3.003 N/A ILE 472.A N ARG 468.A O no hydrogen 2.955 N/A ASN 473.A N PHE 469.A O no hydrogen 2.872 N/A ASN 473.A ND2 PHE 469.A O no hydrogen 3.089 N/A GLN 474.A N ALA 470.A O no hydrogen 2.972 N/A ILE 475.A N ARG 471.A O no hydrogen 2.930 N/A ILE 476.A N ILE 472.A O no hydrogen 2.930 N/A ASN 477.A N ASN 473.A O no hydrogen 2.886 N/A ASN 477.A ND2 ILE 414.A O no hydrogen 2.573 N/A HIS 481.A NE2 ALA 410.A O no hydrogen 2.392 N/A SER 485.A N SER 482.A O no hydrogen 3.265 N/A SER 485.A OG SER 482.A O no hydrogen 3.092 N/A MET 490.A N ASP 489.A OD1 no hydrogen 2.618 N/A PHE 491.A N PRO 487.A O no hydrogen 2.773 N/A ASN 492.A N ASP 488.A O no hydrogen 2.893 N/A ALA 493.A N ASP 489.A O no hydrogen 2.890 N/A LEU 494.A N PHE 491.A O no hydrogen 3.372 N/A ASP 497.A N ALA 493.A O no hydrogen 2.973 N/A LEU 498.A N LEU 494.A O no hydrogen 2.930 N/A ILE 499.A N LEU 495.A O no hydrogen 2.955 N/A ALA 500.A N PRO 496.A O no hydrogen 2.899 N/A LEU 511.A N ILE 296.A O no hydrogen 2.646 N/A VAL 513.A N ASP 298.A O no hydrogen 2.925 N/A SER 514.A OG ASP 281.A OD2 no hydrogen 3.449 N/A SER 517.A OG SER 514.A O no hydrogen 2.495 N/A LEU 518.A N TRP 515.A O no hydrogen 3.446 N/A ALA 521.A N SER 517.A O no hydrogen 2.903 N/A PHE 522.A N LEU 518.A O no hydrogen 2.911 N/A ASN 523.A ND2 TYR 457.A OH no hydrogen 2.983 N/A ARG 524.A NH2 ASN 523.A O no hydrogen 3.178 N/A SER 525.A N ILE 245.A O no hydrogen 2.881 N/A GLU 527.A N GLU 243.A O no hydrogen 2.887 N/A THR 529.A N GLU 527.A O no hydrogen 3.066 N/A ARG 531.A NE ASP 479.A OD1 no hydrogen 3.355 N/A ARG 531.A NH1 ASP 479.A OD1 no hydrogen 2.472 N/A ASN 532.A ND2 ALA 236.A O no hydrogen 3.332 N/A GLU 536.A N GLU 536.A OE1 no hydrogen 2.799 N/A ALA 538.A N LEU 535.A O no hydrogen 3.340 N/A ILE 541.A N VAL 537.A O no hydrogen 3.228 N/A GLU 542.A N ALA 538.A O no hydrogen 2.972 N/A SER 543.A N PRO 539.A O no hydrogen 3.036 N/A SER 543.A OG GLN 212.A O no hydrogen 2.758 N/A VAL 544.A N LEU 540.A O no hydrogen 3.058 N/A TYR 545.A N ILE 541.A O no hydrogen 2.924 N/A ALA 546.A N GLU 542.A O no hydrogen 2.868 N/A SER 547.A N SER 543.A O no hydrogen 3.098 N/A SER 547.A OG SER 543.A O no hydrogen 2.653 N/A GLU 548.A N VAL 544.A O no hydrogen 3.050 N/A LEU 549.A N TYR 545.A O no hydrogen 3.033 N/A SER 550.A N ALA 546.A O no hydrogen 2.905 N/A SER 550.A OG ALA 546.A O no hydrogen 3.506 N/A VAL 551.A N SER 547.A O no hydrogen 2.893 N/A MET 552.A N GLU 548.A O no hydrogen 2.937 N/A LYS 553.A N LEU 549.A O no hydrogen 2.885 N/A VAL 554.A N SER 550.A O no hydrogen 2.950 N/A ASP 555.A N VAL 551.A O no hydrogen 2.967 N/A MET 556.A N MET 552.A O no hydrogen 2.942 N/A ARG 557.A N LYS 553.A O no hydrogen 2.900 N/A HIS 558.A N VAL 554.A O no hydrogen 2.996 N/A LEU 559.A N ASP 555.A O no hydrogen 2.884 N/A SER 560.A N MET 556.A O no hydrogen 2.973 N/A SER 560.A OG ARG 557.A O no hydrogen 3.078 N/A LEU 561.A N HIS 558.A O no hydrogen 3.226 N/A PHE 566.A N MET 562.A O no hydrogen 3.316 N/A GLN 572.A NE2 GLU 62.A O no hydrogen 2.891 N/A ALA 573.A N LEU 570.A O no hydrogen 3.377 N/A ARG 574.A N HIS 577.A ND1 no hydrogen 3.012 N/A HIS 577.A N ARG 574.A O no hydrogen 2.556 N/A HIS 577.A ND1 ARG 574.A O no hydrogen 2.974 N/A TRP 579.A N PRO 575.A O no hydrogen 2.971 N/A LYS 580.A N SER 576.A O no hydrogen 2.918 N/A ALA 581.A N HIS 577.A O no hydrogen 2.935 N/A VAL 582.A N PHE 578.A O no hydrogen 2.894 N/A LEU 583.A N TRP 579.A O no hydrogen 3.001 N/A ASN 584.A N LYS 580.A O no hydrogen 2.906 N/A ASN 584.A N ALA 581.A O no hydrogen 3.071 N/A ASP 585.A N ALA 581.A O no hydrogen 3.212 N/A ASP 585.A N VAL 582.A O no hydrogen 3.142 N/A SER 586.A OG VAL 582.A O no hydrogen 2.978 N/A GLU 588.A N GLU 588.A OE1 no hydrogen 2.610 N/A LYS 591.A NZ LEU 583.A O no hydrogen 3.469 N/A ALA 592.A N GLU 588.A O no hydrogen 2.925 N/A VAL 593.A N ALA 589.A O no hydrogen 2.919 N/A MET 594.A N VAL 590.A O no hydrogen 2.979 N/A ASN 595.A N LYS 591.A O no hydrogen 2.886 N/A LEU 596.A N ALA 592.A O no hydrogen 2.982 N/A SER 597.A N MET 594.A O no hydrogen 2.897 N/A SER 597.A OG ARG 225.A O no hydrogen 2.597 N/A HIS 598.A N MET 594.A O no hydrogen 2.744 N/A SER 599.A N ASN 595.A O no hydrogen 3.420 N/A SER 599.A OG ASN 595.A O no hydrogen 2.690 N/A SER 599.A OG ASN 595.A OD1 no hydrogen 2.326 N/A HIS 600.A N SER 597.A O no hydrogen 2.917 N/A MET 608.A N ASN 604.A O no hydrogen 3.451 N/A MET 609.A N ILE 605.A O no hydrogen 2.875 N/A ARG 610.A N ARG 606.A O no hydrogen 2.727 N/A TRP 611.A N ASP 607.A O no hydrogen 2.923 N/A VAL 612.A N MET 608.A O no hydrogen 2.916 N/A VAL 612.A N MET 609.A O no hydrogen 2.941 N/A MET 613.A N MET 609.A O no hydrogen 3.339 N/A SER 616.A OG ASP 222.A OD2 no hydrogen 2.539 N/A GLN 618.A N SER 550.A OG no hydrogen 2.947 N/A GLN 618.A NE2 PRO 214.A O no hydrogen 2.839 N/A GLN 618.A NE2 PRO 619.A O no hydrogen 2.996 N/A SER 620.A OG GLN 618.A O no hydrogen 3.123 N/A ALA 624.A N SER 620.A O no hydrogen 3.250 N/A LEU 625.A N LEU 621.A O no hydrogen 2.923 N/A GLU 626.A N LYS 622.A O no hydrogen 2.852 N/A GLU 627.A N LEU 623.A O no hydrogen 2.876 N/A GLU 628.A N ALA 624.A O no hydrogen 3.021 N/A ALA 629.A N LEU 625.A O no hydrogen 2.839 N/A TRP 630.A N GLU 626.A O no hydrogen 2.859 N/A ALA 631.A N GLU 627.A O no hydrogen 2.946 N/A ALA 632.A N GLU 628.A O no hydrogen 2.884 N/A ALA 633.A N TRP 630.A O no hydrogen 2.982 N/A GLU 637.A N ASP 635.A OD1 no hydrogen 2.815 N/A LEU 639.A N PHE 636.A O no hydrogen 2.899 N/A THR 642.A N ARG 721.A O no hydrogen 3.333 N/A GLN 644.A N THR 642.A OG1 no hydrogen 3.165 N/A HIS 648.A N MET 790.A O no hydrogen 2.746 N/A HIS 648.A ND1 ASP 712.A O no hydrogen 2.413 N/A ASP 650.A N THR 789.A O no hydrogen 3.138 N/A LEU 657.A N PRO 778.A O no hydrogen 2.659 N/A ARG 662.A N ASP 659.A OD1 no hydrogen 3.034 N/A PHE 663.A N ASP 659.A O no hydrogen 3.287 N/A ARG 664.A N ILE 660.A O no hydrogen 2.879 N/A ARG 664.A NE VAL 772.A O no hydrogen 2.823 N/A ARG 664.A NH1 VAL 772.A O no hydrogen 2.619 N/A GLN 665.A N GLU 661.A O no hydrogen 2.918 N/A GLU 666.A N ARG 662.A O no hydrogen 3.377 N/A TYR 670.A N LEU 768.A O no hydrogen 2.926 N/A ASN 672.A ND2 THR 791.A O no hydrogen 3.329 N/A LEU 674.A N VAL 793.A O no hydrogen 2.734 N/A ARG 682.A N GLU 679.A O no hydrogen 3.343 N/A ARG 682.A NE ASP 712.A OD1 no hydrogen 3.099 N/A VAL 683.A N ILE 680.A O no hydrogen 3.176 N/A VAL 684.A N TRP 713.A O no hydrogen 3.433 N/A TYR 686.A N ARG 715.A O no hydrogen 3.456 N/A THR 687.A OG1 GLU 689.A OE1 no hydrogen 2.530 N/A GLU 689.A N GLU 689.A OE1 no hydrogen 2.685 N/A ALA 691.A N THR 687.A O no hydrogen 3.452 N/A ARG 692.A N TYR 688.A O no hydrogen 2.880 N/A LEU 693.A N GLU 689.A O no hydrogen 2.963 N/A GLN 694.A N ILE 690.A O no hydrogen 2.872 N/A GLN 694.A NE2 TYR 686.A OH no hydrogen 3.286 N/A ALA 695.A N ALA 691.A O no hydrogen 2.912 N/A ASN 696.A N ARG 692.A O no hydrogen 2.874 N/A MET 697.A N LEU 693.A O no hydrogen 2.940 N/A GLY 698.A N ALA 695.A O no hydrogen 3.106 N/A GLN 699.A N GLN 694.A O no hydrogen 3.385 N/A ALA 703.A N GLN 699.A O no hydrogen 3.458 N/A LEU 704.A N PHE 700.A O no hydrogen 3.317 N/A ARG 705.A N ARG 701.A O no hydrogen 2.905 N/A ARG 706.A N ALA 702.A O no hydrogen 2.891 N/A ILE 707.A N ALA 703.A O no hydrogen 2.888 N/A MET 708.A N LEU 704.A O no hydrogen 2.901 N/A ASP 709.A N ARG 705.A O no hydrogen 2.878 N/A ASP 710.A N ARG 706.A O no hydrogen 2.892 N/A ASP 711.A N MET 708.A O no hydrogen 3.161 N/A TRP 713.A N ARG 682.A O no hydrogen 2.653 N/A ARG 715.A NE ASP 643.A O no hydrogen 3.232 N/A ARG 715.A NH2 GLN 685.A OE1 no hydrogen 3.332 N/A GLY 717.A N TYR 686.A O no hydrogen 2.888 N/A ARG 721.A N THR 642.A O no hydrogen 2.878 N/A ARG 721.A NE ALA 760.A O no hydrogen 2.616 N/A ARG 721.A NH1 PHE 716.A O no hydrogen 2.855 N/A ARG 721.A NH2 PHE 716.A O no hydrogen 2.716 N/A THR 722.A N THR 761.A O no hydrogen 3.213 N/A ARG 724.A NH1 GLY 57.A O no hydrogen 3.533 N/A LYS 726.A NZ VAL 725.A O no hydrogen 2.659 N/A LEU 737.A N PRO 733.A O no hydrogen 3.318 N/A LEU 737.A N ASP 734.A O no hydrogen 3.193 N/A GLN 738.A N ASP 734.A O no hydrogen 2.887 N/A SER 743.A N LYS 758.A O no hydrogen 2.863 N/A ASP 745.A N THR 756.A O no hydrogen 2.941 N/A ASN 747.A N TYR 754.A O no hydrogen 2.855 N/A ARG 749.A N LEU 752.A O no hydrogen 2.917 N/A GLY 751.A N GLU 748.A OE2 no hydrogen 2.617 N/A LEU 752.A N ARG 749.A O no hydrogen 2.928 N/A TYR 754.A N ASN 747.A O no hydrogen 2.908 N/A THR 756.A N ASP 745.A O no hydrogen 2.913 N/A LYS 758.A N SER 743.A O no hydrogen 2.875 N/A TYR 759.A N TYR 688.A OH no hydrogen 3.004 N/A ALA 760.A N PRO 741.A O no hydrogen 2.768 N/A THR 763.A N THR 722.A O no hydrogen 2.915 N/A THR 764.A OG1 ARG 724.A O no hydrogen 2.566 N/A THR 764.A OG1 ILE 765.A O no hydrogen 3.183 N/A ILE 765.A N ARG 724.A O no hydrogen 2.513 N/A TYR 767.A N LYS 726.A O no hydrogen 2.951 N/A LEU 768.A N TYR 670.A O no hydrogen 2.885 N/A VAL 772.A N GLN 38.A OE1 no hydrogen 2.972 N/A SER 780.A N THR 777.A O no hydrogen 3.165 N/A VAL 782.A N ASP 779.A O no hydrogen 3.158 N/A THR 789.A N ASP 650.A O no hydrogen 2.889 N/A LYS 792.A N TYR 646.A O no hydrogen 2.926 N/A LYS 792.A NZ TYR 670.A OH no hydrogen 3.140 N/A PHE 794.A N GLN 644.A O no hydrogen 3.210 N/A LYS 797.A NZ ASP 635.A OD2 no hydrogen 3.110 N/A GLU 801.A N ARG 45.A O no hydrogen 2.992 N/A VAL 803.A N VAL 43.A O no hydrogen 2.908 N/A ILE 808.A N VAL 805.A O no hydrogen 3.298 N/A LEU 812.A N LEU 809.A O no hydrogen 3.243 N/A ASN 813.A N VAL 811.A O no hydrogen 2.686 N/A ARG 814.A N GLY 149.A O no hydrogen 2.921 N/A PHE 816.A N PHE 147.A O no hydrogen 2.922 N/A VAL 817.A N TYR 159.A OH no hydrogen 2.854 N/A ALA 818.A N ASP 145.A O no hydrogen 2.849 N/A MET 823.A N LYS 820.A O no hydrogen 3.070 N/A ARG 824.A NE THR 205.A OG1 no hydrogen 3.341 N/A ILE 828.A N VAL 208.A O no hydrogen 3.304 N/A THR 829.A N ASP 827.A OD2 no hydrogen 3.144 N/A THR 829.A OG1 ASP 827.A OD1 no hydrogen 3.080 N/A SER 831.A N ILE 828.A O no hydrogen 2.951 N/A SER 831.A OG ILE 828.A O no hydrogen 2.257 N/A LEU 832.A N THR 829.A O no hydrogen 3.381 N/A LYS 833.A N GLN 830.A O no hydrogen 2.953 N/A THR 836.A N THR 191.A O no hydrogen 2.911 N/A LYS 837.A NZ ASN 532.A O no hydrogen 3.260 N/A LYS 837.A NZ GLU 536.A OE2 no hydrogen 3.303 N/A LEU 838.A N ARG 189.A O no hydrogen 3.404 N/A