Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8q63_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 6.A N ASN 2.A O no hydrogen 2.950 N/A TYR 7.A N PHE 3.A O no hydrogen 2.910 N/A ASN 8.A N PHE 4.A O no hydrogen 2.911 N/A SER 9.A N GLU 5.A O no hydrogen 2.877 N/A SER 9.A OG ILE 6.A O no hydrogen 2.735 N/A LEU 10.A N ILE 6.A O no hydrogen 2.968 N/A LEU 10.A N TYR 7.A O no hydrogen 3.269 N/A THR 12.A N GLU 15.A OE2 no hydrogen 3.160 N/A THR 12.A OG1 GLU 15.A OE2 no hydrogen 3.540 N/A LYS 16.A N THR 12.A O no hydrogen 2.913 N/A LYS 17.A N LEU 13.A O no hydrogen 2.892 N/A ALA 18.A N GLU 14.A O no hydrogen 2.957 N/A PHE 19.A N GLU 15.A O no hydrogen 2.846 N/A GLU 20.A N LYS 16.A O no hydrogen 2.902 N/A SER 21.A N LYS 17.A O no hydrogen 2.948 N/A ALA 22.A N ALA 18.A O no hydrogen 2.910 N/A LEU 23.A N PHE 19.A O no hydrogen 2.902 N/A ASN 24.A N GLU 20.A O no hydrogen 2.921 N/A ILE 25.A N SER 21.A O no hydrogen 2.989 N/A PHE 26.A N ALA 22.A O no hydrogen 2.867 N/A ASN 27.A N LEU 23.A O no hydrogen 2.847 N/A GLN 28.A N ASN 24.A O no hydrogen 3.006 N/A GLN 28.A N ILE 25.A O no hydrogen 3.350 N/A ARG 30.A NH1 GLU 389.A OE2 no hydrogen 2.635 N/A ARG 30.A NH2 GLU 389.A OE2 no hydrogen 3.359 N/A GLN 31.A N ASN 27.A O no hydrogen 2.876 N/A GLN 31.A NE2 GLN 31.A O no hydrogen 3.069 N/A LYS 32.A N GLN 28.A O no hydrogen 2.998 N/A VAL 33.A N ASP 29.A O no hydrogen 2.913 N/A LEU 34.A N ARG 30.A O no hydrogen 2.883 N/A GLU 35.A N GLN 31.A O no hydrogen 2.914 N/A GLU 35.A N LYS 32.A O no hydrogen 3.248 N/A ALA 38.A N VAL 245.A O no hydrogen 2.774 N/A GLU 44.A N GLU 40.A O no hydrogen 2.926 N/A ARG 45.A N ALA 41.A O no hydrogen 2.867 N/A TRP 46.A N ALA 42.A O no hydrogen 2.917 N/A LYS 47.A N ARG 43.A O no hydrogen 2.941 N/A HIS 48.A N GLU 44.A O no hydrogen 2.877 N/A ASP 49.A N ARG 45.A O no hydrogen 2.912 N/A PHE 50.A N TRP 46.A O no hydrogen 2.938 N/A GLU 51.A N LYS 47.A O no hydrogen 2.900 N/A GLU 52.A N HIS 48.A O no hydrogen 2.894 N/A ALA 53.A N ASP 49.A O no hydrogen 2.925 N/A LYS 54.A N PHE 50.A O no hydrogen 2.916 N/A ALA 55.A N GLU 51.A O no hydrogen 2.896 N/A ARG 56.A N GLU 52.A O no hydrogen 2.898 N/A ARG 56.A NE ASP 58.A O no hydrogen 2.930 N/A ARG 56.A NH2 ASP 58.A O no hydrogen 2.594 N/A GLY 57.A N ALA 53.A O no hydrogen 2.914 N/A SER 60.A OG GLU 62.A OE2 no hydrogen 2.851 N/A ASN 64.A N ILE 61.A O no hydrogen 3.155 N/A ASN 66.A ND2 ASP 49.A OD2 no hydrogen 2.576 N/A LYS 68.A N ASN 64.A O no hydrogen 2.830 N/A LYS 68.A NZ LYS 190.A O no hydrogen 2.609 N/A LEU 69.A N LEU 65.A O no hydrogen 2.960 N/A TRP 70.A N ASN 66.A O no hydrogen 2.894 N/A LYS 71.A N VAL 67.A O no hydrogen 2.889 N/A TRP 72.A N LYS 68.A O no hydrogen 2.916 N/A TRP 72.A NE1 LYS 190.A O no hydrogen 2.927 N/A TYR 73.A N LEU 69.A O no hydrogen 2.929 N/A ASN 74.A N TRP 70.A O no hydrogen 2.918 N/A ASN 74.A ND2 TRP 70.A O no hydrogen 3.275 N/A GLU 75.A N LYS 71.A O no hydrogen 2.896 N/A MET 76.A N TYR 73.A O no hydrogen 3.252 N/A LEU 77.A N TYR 73.A O no hydrogen 2.956 N/A VAL 80.A N MET 76.A O no hydrogen 3.372 N/A LYS 81.A N LEU 77.A O no hydrogen 3.010 N/A GLU 82.A N PRO 78.A O no hydrogen 2.886 N/A GLU 83.A N LEU 79.A O no hydrogen 2.972 N/A ILE 84.A N VAL 80.A O no hydrogen 2.939 N/A ASN 85.A N LYS 81.A O no hydrogen 2.932 N/A HIS 86.A N GLU 82.A O no hydrogen 2.928 N/A CYS 87.A N GLU 83.A O no hydrogen 2.942 N/A CYS 87.A SG ARG 108.A O no hydrogen 3.063 N/A ARG 88.A N ILE 84.A O no hydrogen 2.923 N/A ARG 88.A NH2 GLY 112.A O no hydrogen 2.645 N/A SER 89.A N ASN 85.A O no hydrogen 2.908 N/A LEU 90.A N HIS 86.A O no hydrogen 2.925 N/A LEU 91.A N CYS 87.A O no hydrogen 2.970 N/A SER 92.A OG ARG 88.A O no hydrogen 3.050 N/A GLU 93.A N LEU 90.A O no hydrogen 3.480 N/A ARG 108.A NE TYR 111.A OH no hydrogen 2.683 N/A ARG 108.A NH1 VAL 104.A O no hydrogen 2.525 N/A LEU 109.A N ASP 105.A O no hydrogen 3.370 N/A TYR 111.A N ASN 107.A O no hydrogen 2.942 N/A THR 116.A N TYR 114.A O no hydrogen 2.489 N/A LYS 122.A N ILE 118.A O no hydrogen 3.458 N/A MET 123.A N ASP 119.A O no hydrogen 2.963 N/A CYS 124.A N PRO 120.A O no hydrogen 2.923 N/A CYS 124.A SG PRO 120.A O no hydrogen 3.170 N/A VAL 125.A N GLY 121.A O no hydrogen 2.918 N/A ILE 126.A N LYS 122.A O no hydrogen 2.855 N/A THR 127.A N MET 123.A O no hydrogen 2.936 N/A THR 127.A OG1 MET 123.A O no hydrogen 2.875 N/A ILE 128.A N CYS 124.A O no hydrogen 2.946 N/A LEU 129.A N VAL 125.A O no hydrogen 2.815 N/A GLU 130.A N ILE 126.A O no hydrogen 2.959 N/A ASN 135.A N LEU 132.A O no hydrogen 3.114 N/A SER 136.A OG SER 136.A O no hydrogen 2.556 N/A THR 137.A OG1 GLU 139.A OE1 no hydrogen 2.753 N/A MET 141.A N LEU 226.A O no hydrogen 3.436 N/A THR 143.A N GLY 224.A O no hydrogen 3.094 N/A THR 143.A OG1 GLY 224.A O no hydrogen 2.416 N/A THR 143.A OG1 GLN 708.A OE1 no hydrogen 3.544 N/A ALA 146.A N ARG 142.A O no hydrogen 3.001 N/A VAL 147.A N THR 143.A O no hydrogen 2.981 N/A SER 149.A N ARG 145.A O no hydrogen 2.513 N/A VAL 150.A N ALA 146.A O no hydrogen 3.406 N/A GLY 151.A N VAL 147.A O no hydrogen 3.105 N/A LYS 152.A N ILE 148.A O no hydrogen 2.519 N/A ALA 153.A N SER 149.A O no hydrogen 2.716 N/A ILE 154.A N VAL 150.A O no hydrogen 2.887 N/A GLU 155.A N GLY 151.A O no hydrogen 2.797 N/A MET 156.A N LYS 152.A O no hydrogen 3.052 N/A GLU 157.A N ALA 153.A O no hydrogen 2.894 N/A PHE 158.A N ILE 154.A O no hydrogen 2.687 N/A ARG 159.A N GLU 155.A O no hydrogen 3.044 N/A SER 160.A N MET 156.A O no hydrogen 2.909 N/A SER 160.A N GLU 157.A O no hydrogen 3.104 N/A SER 160.A OG GLU 157.A O no hydrogen 2.327 N/A GLN 162.A N PHE 158.A O no hydrogen 3.309 N/A VAL 163.A N ARG 159.A O no hydrogen 2.936 N/A LYS 165.A N GLN 162.A O no hydrogen 3.072 N/A TRP 169.A N GLU 155.A OE1 no hydrogen 3.296 N/A GLN 171.A N ASP 714.A OD1 no hydrogen 3.103 N/A ARG 174.A N PRO 170.A O no hydrogen 2.948 N/A ARG 174.A NH1 GLU 155.A OE1 no hydrogen 3.000 N/A ALA 175.A N GLN 171.A O no hydrogen 2.897 N/A ARG 176.A N SER 172.A O no hydrogen 2.902 N/A ARG 176.A NE GLU 704.A O no hydrogen 3.373 N/A ARG 176.A NH2 GLU 704.A O no hydrogen 3.429 N/A ILE 177.A N ILE 173.A O no hydrogen 2.954 N/A GLY 178.A N ARG 174.A O no hydrogen 2.951 N/A SER 179.A N ALA 175.A O no hydrogen 2.887 N/A VAL 180.A N ARG 176.A O no hydrogen 2.986 N/A LEU 181.A N ILE 177.A O no hydrogen 3.019 N/A ILE 182.A N GLY 178.A O no hydrogen 2.915 N/A SER 183.A N SER 179.A O no hydrogen 2.919 N/A MET 184.A N VAL 180.A O no hydrogen 2.976 N/A LEU 185.A N LEU 181.A O no hydrogen 2.951 N/A ILE 186.A N ILE 182.A O no hydrogen 2.865 N/A GLN 187.A N SER 183.A O no hydrogen 2.999 N/A VAL 188.A N LEU 185.A O no hydrogen 3.225 N/A VAL 191.A N ALA 208.A O no hydrogen 3.194 N/A VAL 193.A N GLY 206.A O no hydrogen 3.377 N/A GLY 195.A N VAL 204.A O no hydrogen 3.013 N/A ASP 197.A N ALA 202.A O no hydrogen 3.186 N/A VAL 199.A N ASP 197.A OD1 no hydrogen 3.003 N/A THR 200.A N ASP 197.A O no hydrogen 2.887 N/A THR 200.A OG1 ASP 197.A O no hydrogen 3.539 N/A LYS 201.A N ASP 197.A O no hydrogen 2.360 N/A LYS 201.A NZ PRO 198.A O no hydrogen 3.040 N/A LYS 201.A NZ VAL 199.A O no hydrogen 3.389 N/A ALA 202.A N THR 200.A OG1 no hydrogen 3.221 N/A VAL 204.A N GLY 195.A O no hydrogen 2.382 N/A GLY 206.A N VAL 193.A O no hydrogen 3.431 N/A ALA 208.A N VAL 191.A O no hydrogen 3.130 N/A ALA 210.A N ALA 189.A O no hydrogen 2.368 N/A TYR 215.A OH LEU 707.A O no hydrogen 3.382 N/A HIS 218.A N SER 221.A O no hydrogen 3.309 N/A LEU 223.A N GLN 216.A O no hydrogen 2.929 N/A LEU 226.A N MET 141.A O no hydrogen 3.064 N/A HIS 229.A N ALA 210.A O no hydrogen 2.957 N/A THR 231.A OG1 HIS 229.A ND1 no hydrogen 3.106 N/A ILE 233.A N HIS 229.A O no hydrogen 2.924 N/A ARG 234.A N LYS 230.A O no hydrogen 2.909 N/A ARG 234.A NH1 ARG 234.A O no hydrogen 3.282 N/A GLN 235.A N THR 231.A O no hydrogen 2.926 N/A LEU 236.A N LEU 232.A O no hydrogen 2.899 N/A ASN 237.A N ILE 233.A O no hydrogen 2.934 N/A ARG 240.A N LEU 236.A O no hydrogen 3.513 N/A SER 244.A OG GLN 246.A O no hydrogen 3.487 N/A MET 252.A N TYR 392.A O no hydrogen 3.079 N/A LEU 253.A N GLN 31.A OE1 no hydrogen 3.064 N/A LYS 257.A N GLY 266.A O no hydrogen 3.149 N/A TRP 259.A N ASN 304.A OD1 no hydrogen 2.862 N/A GLY 266.A N LYS 257.A O no hydrogen 2.967 N/A TYR 269.A N GLU 35.A OE1 no hydrogen 3.024 N/A THR 270.A OG1 GLU 35.A OE1 no hydrogen 2.829 N/A THR 273.A OG1 LEU 275.A O no hydrogen 2.540 N/A LEU 274.A N TRP 262.A O no hydrogen 3.047 N/A ARG 276.A NE ASN 396.A OD1 no hydrogen 2.612 N/A SER 280.A OG ASP 279.A O no hydrogen 2.623 N/A SER 280.A OG GLN 283.A OE1 no hydrogen 3.325 N/A ALA 285.A N PRO 281.A O no hydrogen 2.891 N/A TYR 286.A N GLU 282.A O no hydrogen 2.930 N/A LEU 287.A N GLN 283.A O no hydrogen 2.888 N/A LYS 288.A N VAL 284.A O no hydrogen 2.872 N/A ALA 289.A N ALA 285.A O no hydrogen 2.920 N/A ALA 290.A N TYR 286.A O no hydrogen 2.880 N/A SER 291.A N LEU 287.A O no hydrogen 2.870 N/A ASP 292.A N LYS 288.A O no hydrogen 2.921 N/A ASN 293.A N ALA 289.A O no hydrogen 2.916 N/A GLY 294.A N ALA 290.A O no hydrogen 2.872 N/A ARG 298.A NH2 PRO 686.A O no hydrogen 3.360 N/A TYR 300.A N ILE 296.A O no hydrogen 2.972 N/A ASP 301.A N ASP 297.A O no hydrogen 2.942 N/A GLY 302.A N ARG 298.A O no hydrogen 2.906 N/A LEU 303.A N VAL 299.A O no hydrogen 2.973 N/A ASN 304.A N TYR 300.A O no hydrogen 2.904 N/A VAL 305.A N ASP 301.A O no hydrogen 2.992 N/A LEU 306.A N GLY 302.A O no hydrogen 2.929 N/A GLY 307.A N LEU 303.A O no hydrogen 2.896 N/A GLY 307.A N ASN 304.A O no hydrogen 3.153 N/A ARG 308.A N ASN 304.A O no hydrogen 2.972 N/A TRP 311.A N LEU 391.A O no hydrogen 3.300 N/A TRP 311.A NE1 THR 309.A OG1 no hydrogen 2.654 N/A THR 312.A N ILE 423.A O no hydrogen 3.062 N/A THR 312.A OG1 GLU 389.A O no hydrogen 3.262 N/A ASN 314.A N LEU 421.A O no hydrogen 3.051 N/A PHE 318.A N ASN 314.A O no hydrogen 2.901 N/A ASP 319.A N ARG 315.A O no hydrogen 2.879 N/A VAL 320.A N LYS 316.A O no hydrogen 2.983 N/A VAL 321.A N VAL 317.A O no hydrogen 2.909 N/A SER 322.A N PHE 318.A O no hydrogen 2.851 N/A SER 322.A OG PHE 318.A O no hydrogen 3.168 N/A SER 322.A OG ASP 319.A O no hydrogen 2.548 N/A GLN 323.A N ASP 319.A O no hydrogen 2.921 N/A VAL 324.A N VAL 320.A O no hydrogen 3.019 N/A TRP 325.A N VAL 321.A O no hydrogen 2.783 N/A ASN 326.A N SER 322.A O no hydrogen 2.882 N/A LYS 327.A N GLN 323.A O no hydrogen 2.961 N/A GLY 328.A N VAL 324.A O no hydrogen 2.925 N/A PHE 331.A N ILE 334.A O no hydrogen 3.408 N/A ALA 337.A N GLY 328.A O no hydrogen 2.589 N/A ARG 353.A N PRO 349.A O no hydrogen 2.868 N/A ALA 354.A N SER 350.A O no hydrogen 2.913 N/A TRP 355.A N ILE 351.A O no hydrogen 2.899 N/A LYS 356.A N LEU 352.A O no hydrogen 2.881 N/A LEU 357.A N ARG 353.A O no hydrogen 2.892 N/A GLN 358.A N ALA 354.A O no hydrogen 2.939 N/A VAL 359.A N TRP 355.A O no hydrogen 2.872 N/A LYS 360.A N LYS 356.A O no hydrogen 2.916 N/A LYS 360.A NZ LYS 360.A O no hydrogen 3.312 N/A THR 361.A N LEU 357.A O no hydrogen 2.919 N/A THR 361.A OG1 LEU 357.A O no hydrogen 2.817 N/A ILE 362.A N GLN 358.A O no hydrogen 2.895 N/A ALA 363.A N VAL 359.A O no hydrogen 2.898 N/A ASN 364.A N LYS 360.A O no hydrogen 2.911 N/A LYS 365.A N THR 361.A O no hydrogen 2.914 N/A PHE 366.A N ILE 362.A O no hydrogen 2.889 N/A SER 367.A N ALA 363.A O no hydrogen 2.918 N/A SER 367.A OG ALA 363.A O no hydrogen 3.499 N/A SER 367.A OG ASN 364.A O no hydrogen 2.670 N/A SER 368.A N ASN 364.A O no hydrogen 2.918 N/A ASP 369.A N LYS 365.A O no hydrogen 2.917 N/A ARG 370.A N PHE 366.A O no hydrogen 2.916 N/A SER 371.A N SER 367.A O no hydrogen 2.927 N/A SER 371.A OG SER 367.A O no hydrogen 3.493 N/A SER 371.A OG SER 368.A O no hydrogen 2.865 N/A ASN 372.A N SER 368.A O no hydrogen 2.951 N/A ARG 373.A N ASP 369.A O no hydrogen 2.884 N/A CYS 374.A N ARG 370.A O no hydrogen 2.898 N/A ASP 375.A N SER 371.A O no hydrogen 2.963 N/A THR 376.A N ASN 372.A O no hydrogen 2.924 N/A THR 376.A OG1 ASN 372.A O no hydrogen 2.799 N/A ASN 377.A N ARG 373.A O no hydrogen 2.822 N/A TYR 378.A N CYS 374.A O no hydrogen 2.994 N/A LYS 379.A N ASP 375.A O no hydrogen 2.874 N/A LYS 379.A NZ HIS 409.A O no hydrogen 2.880 N/A LEU 380.A N THR 376.A O no hydrogen 2.889 N/A GLU 381.A N ASN 377.A O no hydrogen 2.925 N/A ILE 382.A N TYR 378.A O no hydrogen 2.970 N/A ALA 383.A N LYS 379.A O no hydrogen 2.919 N/A ARG 384.A N LEU 380.A O no hydrogen 2.830 N/A ALA 385.A N GLU 381.A O no hydrogen 2.920 N/A PHE 386.A N ILE 382.A O no hydrogen 2.950 N/A PHE 386.A N ALA 383.A O no hydrogen 3.119 N/A LYS 390.A NZ TYR 392.A OH no hydrogen 3.266 N/A LEU 391.A N TRP 311.A O no hydrogen 3.005 N/A ASN 396.A N TYR 404.A O no hydrogen 2.402 N/A ASN 396.A ND2 THR 273.A O no hydrogen 2.503 N/A LEU 397.A N LEU 274.A O no hydrogen 3.347 N/A ASP 398.A N ARG 402.A O no hydrogen 3.153 N/A ARG 400.A N ASP 398.A OD2 no hydrogen 2.922 N/A ARG 400.A NE ASP 398.A OD2 no hydrogen 3.271 N/A TYR 404.A N ASN 396.A O no hydrogen 2.420 N/A LEU 406.A N PRO 394.A O no hydrogen 2.939 N/A SER 407.A OG LEU 249.A O no hydrogen 3.459 N/A GLY 414.A N ASN 411.A O no hydrogen 3.131 N/A SER 418.A OG ASN 415.A O no hydrogen 2.403 N/A SER 418.A OG ASN 415.A OD1 no hydrogen 3.035 N/A ARG 419.A N ASN 415.A O no hydrogen 2.927 N/A ARG 419.A NE HIS 412.A O no hydrogen 2.979 N/A GLY 420.A N ASP 416.A O no hydrogen 2.878 N/A LEU 421.A N MET 417.A O no hydrogen 2.917 N/A LEU 422.A N ARG 419.A O no hydrogen 3.178 N/A ILE 423.A N THR 312.A O no hydrogen 3.127 N/A PHE 424.A N HIS 512.A O no hydrogen 3.121 N/A TRP 425.A N PRO 310.A O no hydrogen 2.990 N/A LYS 429.A NZ GLU 507.A O no hydrogen 3.293 N/A LYS 429.A NZ GLU 507.A OE1 no hydrogen 3.330 N/A GLY 434.A N LEU 430.A O no hydrogen 2.944 N/A LEU 435.A N GLY 431.A O no hydrogen 2.917 N/A LYS 436.A N PRO 432.A O no hydrogen 2.966 N/A TRP 437.A N SER 433.A O no hydrogen 2.898 N/A TRP 437.A NE1 ASP 772.A OD1 no hydrogen 2.497 N/A LEU 438.A N GLY 434.A O no hydrogen 2.870 N/A LYS 439.A N LEU 435.A O no hydrogen 3.018 N/A LYS 439.A NZ GLU 461.A OE2 no hydrogen 2.568 N/A ILE 440.A N LYS 436.A O no hydrogen 2.933 N/A HIS 441.A N TRP 437.A O no hydrogen 2.835 N/A LEU 442.A N LEU 438.A O no hydrogen 2.991 N/A SER 443.A N LYS 439.A O no hydrogen 2.948 N/A SER 443.A OG LYS 439.A O no hydrogen 3.396 N/A SER 443.A OG ILE 440.A O no hydrogen 2.407 N/A ASN 444.A N ILE 440.A O no hydrogen 2.908 N/A LEU 445.A N HIS 441.A O no hydrogen 2.876 N/A PHE 446.A N LEU 442.A O no hydrogen 2.965 N/A GLY 447.A N ASN 444.A O no hydrogen 3.153 N/A LYS 450.A NZ GLY 447.A O no hydrogen 3.194 N/A ARG 456.A N PRO 452.A O no hydrogen 2.930 N/A VAL 457.A N LEU 453.A O no hydrogen 2.979 N/A ALA 458.A N LYS 454.A O no hydrogen 2.892 N/A PHE 459.A N ASP 455.A O no hydrogen 2.905 N/A THR 460.A N ARG 456.A O no hydrogen 2.989 N/A THR 460.A OG1 LYS 439.A O no hydrogen 2.773 N/A THR 460.A OG1 ARG 456.A O no hydrogen 3.379 N/A GLU 461.A N VAL 457.A O no hydrogen 2.917 N/A SER 462.A N ALA 458.A O no hydrogen 2.850 N/A HIS 463.A N PHE 459.A O no hydrogen 3.054 N/A ILE 467.A N HIS 463.A O no hydrogen 3.023 N/A LYS 468.A N LEU 464.A O no hydrogen 2.911 N/A ASP 469.A N GLN 465.A O no hydrogen 2.905 N/A SER 470.A N ASP 466.A O no hydrogen 2.919 N/A SER 470.A OG ASP 466.A O no hydrogen 3.447 N/A ALA 471.A N ILE 467.A O no hydrogen 2.959 N/A GLU 472.A N LYS 468.A O no hydrogen 2.883 N/A ASN 473.A N ASP 469.A O no hydrogen 2.917 N/A THR 476.A OG1 LEU 475.A O no hydrogen 2.395 N/A ASP 478.A N ASP 469.A OD2 no hydrogen 2.852 N/A TRP 481.A N SER 470.A OG no hydrogen 3.297 N/A THR 482.A OG1 ARG 479.A O no hydrogen 2.760 N/A THR 483.A N TRP 480.A O no hydrogen 3.028 N/A THR 483.A OG1 TRP 480.A O no hydrogen 2.316 N/A ALA 484.A N TRP 481.A O no hydrogen 2.960 N/A TRP 488.A N ASP 416.A OD2 no hydrogen 2.593 N/A GLN 489.A NE2 ASP 416.A OD1 no hydrogen 2.205 N/A ALA 490.A N LYS 486.A O no hydrogen 2.911 N/A LEU 491.A N PRO 487.A O no hydrogen 2.862 N/A ALA 492.A N TRP 488.A O no hydrogen 2.944 N/A THR 493.A N GLN 489.A O no hydrogen 2.981 N/A CYS 494.A N ALA 490.A O no hydrogen 2.828 N/A CYS 494.A SG LEU 491.A O no hydrogen 3.070 N/A PHE 495.A N LEU 491.A O no hydrogen 2.892 N/A GLU 496.A N ALA 492.A O no hydrogen 3.028 N/A LEU 497.A N THR 493.A O no hydrogen 2.920 N/A ASN 498.A N CYS 494.A O no hydrogen 2.736 N/A GLU 499.A N PHE 495.A O no hydrogen 2.982 N/A VAL 500.A N GLU 496.A O no hydrogen 2.918 N/A MET 501.A N LEU 497.A O no hydrogen 2.861 N/A LYS 502.A N ASN 498.A O no hydrogen 2.943 N/A MET 503.A N VAL 500.A O no hydrogen 2.768 N/A PHE 509.A N PRO 506.A O no hydrogen 3.187 N/A HIS 512.A ND1 HIS 426.A O no hydrogen 2.827 N/A GLN 513.A NE2 GLN 489.A O no hydrogen 3.618 N/A VAL 515.A N THR 766.A O no hydrogen 2.905 N/A GLN 517.A N TYR 764.A O no hydrogen 2.819 N/A ASP 518.A N SER 915.A OXT no hydrogen 2.970 N/A CYS 521.A SG TYR 552.A OH no hydrogen 3.872 N/A GLN 525.A N CYS 521.A O no hydrogen 2.899 N/A GLN 525.A NE2 VAL 540.A O no hydrogen 3.622 N/A GLN 525.A NE2 PHE 913.A O no hydrogen 3.501 N/A HIS 526.A N ASN 522.A O no hydrogen 2.915 N/A HIS 526.A N GLY 523.A O no hydrogen 3.143 N/A HIS 526.A ND1 HIS 786.A NE2 no hydrogen 2.925 N/A TYR 527.A N GLY 523.A O no hydrogen 2.920 N/A ALA 528.A N LEU 524.A O no hydrogen 2.895 N/A LEU 530.A N HIS 526.A O no hydrogen 2.880 N/A GLY 531.A N TYR 527.A O no hydrogen 2.903 N/A GLU 535.A N ASP 533.A OD1 no hydrogen 3.161 N/A GLY 536.A N ASP 533.A OD2 no hydrogen 3.128 N/A ALA 537.A N ASP 533.A O no hydrogen 3.201 N/A THR 538.A N VAL 534.A O no hydrogen 2.912 N/A GLN 539.A N GLU 535.A O no hydrogen 2.910 N/A GLN 539.A N GLY 536.A O no hydrogen 2.988 N/A VAL 540.A N ALA 537.A O no hydrogen 3.299 N/A LEU 542.A N ALA 537.A O no hydrogen 2.824 N/A SER 545.A OG LYS 547.A O no hydrogen 2.828 N/A GLN 549.A N ASN 541.A OD1 no hydrogen 2.357 N/A ALA 553.A N ASP 550.A OD2 no hydrogen 2.625 N/A HIS 554.A N ASP 550.A O no hydrogen 2.901 N/A VAL 555.A N VAL 551.A O no hydrogen 2.923 N/A ALA 556.A N TYR 552.A O no hydrogen 2.870 N/A ARG 557.A N ALA 553.A O no hydrogen 2.892 N/A ARG 557.A NE ALA 553.A O no hydrogen 3.021 N/A ARG 557.A NH1 GLN 549.A OE1 no hydrogen 3.037 N/A ARG 557.A NH2 GLN 549.A OE1 no hydrogen 2.636 N/A LEU 558.A N HIS 554.A O no hydrogen 2.978 N/A VAL 559.A N VAL 555.A O no hydrogen 2.909 N/A GLN 560.A N ALA 556.A O no hydrogen 2.866 N/A GLN 560.A NE2 ILE 581.A O no hydrogen 3.543 N/A LYS 561.A N ARG 557.A O no hydrogen 2.936 N/A ARG 562.A N LEU 558.A O no hydrogen 2.928 N/A LEU 563.A N VAL 559.A O no hydrogen 2.876 N/A GLU 564.A N GLN 560.A O no hydrogen 2.856 N/A ILE 565.A N LYS 561.A O no hydrogen 2.957 N/A ALA 566.A N ARG 562.A O no hydrogen 2.928 N/A ALA 567.A N LEU 563.A O no hydrogen 2.834 N/A GLU 568.A N GLU 564.A O no hydrogen 2.904 N/A LYS 569.A N ILE 565.A O no hydrogen 2.916 N/A LYS 569.A NZ ASP 571.A OD1 no hydrogen 3.247 N/A LYS 569.A NZ ASP 571.A OD2 no hydrogen 2.514 N/A GLY 570.A N ALA 566.A O no hydrogen 2.901 N/A ASP 571.A N ALA 566.A O no hydrogen 3.155 N/A ALA 574.A N ASN 573.A OD1 no hydrogen 2.631 N/A LYS 575.A N ASP 571.A O no hydrogen 2.909 N/A LYS 575.A NZ ALA 567.A O no hydrogen 3.017 N/A ILE 576.A N GLU 572.A O no hydrogen 2.928 N/A LEU 577.A N ASN 573.A O no hydrogen 2.880 N/A LYS 578.A N LYS 575.A O no hydrogen 3.398 N/A LYS 580.A N LEU 577.A O no hydrogen 3.497 N/A ARG 583.A NH2 ASP 550.A OD1 no hydrogen 3.482 N/A VAL 586.A N THR 582.A O no hydrogen 3.051 N/A LYS 587.A N ARG 583.A O no hydrogen 2.786 N/A GLN 588.A N LYS 584.A O no hydrogen 2.927 N/A THR 589.A N VAL 585.A O no hydrogen 2.992 N/A THR 589.A OG1 VAL 585.A O no hydrogen 3.391 N/A VAL 590.A N VAL 586.A O no hydrogen 2.928 N/A MET 591.A N LYS 587.A O no hydrogen 2.853 N/A THR 592.A N GLN 588.A O no hydrogen 2.932 N/A THR 592.A OG1 GLN 588.A O no hydrogen 2.688 N/A THR 592.A OG1 THR 589.A O no hydrogen 2.825 N/A THR 592.A OG1 GLN 605.A OE1 no hydrogen 3.542 N/A ASN 593.A N THR 589.A O no hydrogen 2.911 N/A ASN 593.A N VAL 590.A O no hydrogen 3.183 N/A TYR 595.A N THR 592.A O no hydrogen 2.896 N/A GLY 596.A N ASN 593.A O no hydrogen 3.113 N/A TYR 599.A OH LYS 625.A O no hydrogen 3.268 N/A TYR 599.A OH THR 628.A OG1 no hydrogen 2.964 N/A ALA 602.A N THR 598.A O no hydrogen 2.940 N/A THR 603.A N TYR 599.A O no hydrogen 2.930 N/A THR 603.A OG1 SER 624.A OG no hydrogen 2.463 N/A PHE 604.A N VAL 600.A O no hydrogen 2.906 N/A GLN 605.A N GLY 601.A O no hydrogen 2.911 N/A ILE 606.A N ALA 602.A O no hydrogen 2.939 N/A ALA 607.A N THR 603.A O no hydrogen 2.913 N/A LYS 608.A N PHE 604.A O no hydrogen 2.854 N/A GLN 609.A N GLN 605.A O no hydrogen 2.923 N/A LEU 610.A N ALA 607.A O no hydrogen 3.231 N/A SER 611.A N ALA 607.A O no hydrogen 2.941 N/A SER 611.A OG ALA 607.A O no hydrogen 2.921 N/A PHE 614.A N LEU 610.A O no hydrogen 2.922 N/A PHE 614.A N SER 611.A O no hydrogen 2.840 N/A SER 620.A N LYS 618.A O no hydrogen 2.725 N/A SER 624.A N SER 620.A O no hydrogen 3.235 N/A SER 624.A OG THR 603.A O no hydrogen 3.164 N/A SER 624.A OG THR 603.A OG1 no hydrogen 2.463 N/A SER 624.A OG LEU 621.A O no hydrogen 2.786 N/A LYS 625.A N LEU 621.A O no hydrogen 2.931 N/A LYS 625.A NZ ASP 622.A O no hydrogen 2.574 N/A TYR 626.A OH ASP 571.A OD2 no hydrogen 3.108 N/A LEU 627.A N PHE 623.A O no hydrogen 2.942 N/A THR 628.A N SER 624.A O no hydrogen 2.890 N/A THR 628.A OG1 TYR 599.A OH no hydrogen 2.964 N/A THR 628.A OG1 SER 624.A O no hydrogen 3.351 N/A THR 628.A OG1 LYS 625.A O no hydrogen 2.379 N/A LYS 629.A N LYS 625.A O no hydrogen 2.992 N/A HIS 630.A N LEU 627.A O no hydrogen 3.246 N/A VAL 631.A N LEU 627.A O no hydrogen 2.925 N/A PHE 632.A N THR 628.A O no hydrogen 2.962 N/A SER 633.A OG HIS 630.A O no hydrogen 2.393 N/A ALA 634.A N HIS 630.A O no hydrogen 2.943 N/A ILE 635.A N VAL 631.A O no hydrogen 2.921 N/A ARG 636.A N PHE 632.A O no hydrogen 2.915 N/A GLU 637.A N SER 633.A O no hydrogen 2.920 N/A LEU 638.A N ALA 634.A O no hydrogen 2.972 N/A PHE 639.A N ILE 635.A O no hydrogen 2.949 N/A LEU 644.A N HIS 640.A O no hydrogen 2.931 N/A ILE 645.A N SER 641.A O no hydrogen 2.949 N/A GLN 646.A N ALA 642.A O no hydrogen 2.966 N/A GLN 646.A NE2 HIS 643.A ND1 no hydrogen 3.088 N/A ASP 647.A N HIS 643.A O no hydrogen 2.906 N/A TRP 648.A N LEU 644.A O no hydrogen 2.944 N/A TRP 648.A NE1 PRO 894.A O no hydrogen 2.787 N/A LEU 649.A N ILE 645.A O no hydrogen 2.969 N/A GLY 650.A N GLN 646.A O no hydrogen 2.909 N/A GLU 651.A N ASP 647.A O no hydrogen 2.928 N/A SER 652.A N TRP 648.A O no hydrogen 2.948 N/A ALA 653.A N LEU 649.A O no hydrogen 2.905 N/A LYS 654.A N GLY 650.A O no hydrogen 2.953 N/A ARG 655.A N GLU 651.A O no hydrogen 2.981 N/A ARG 655.A NH1 ARG 892.A O no hydrogen 2.703 N/A ILE 656.A N SER 652.A O no hydrogen 2.913 N/A ILE 656.A N ALA 653.A O no hydrogen 3.251 N/A SER 657.A N ALA 653.A O no hydrogen 2.882 N/A SER 657.A OG LYS 654.A O no hydrogen 2.865 N/A LYS 658.A N LYS 654.A O no hydrogen 2.985 N/A SER 659.A N ILE 656.A O no hydrogen 3.269 N/A GLU 666.A N ASP 663.A O no hydrogen 3.188 N/A SER 679.A OG ILE 656.A O no hydrogen 3.271 N/A SER 680.A OG GLU 282.A OE1 no hydrogen 3.023 N/A THR 684.A OG1 GLU 797.A OE1 no hydrogen 2.812 N/A THR 684.A OG1 GLU 797.A OE2 no hydrogen 2.586 N/A THR 685.A N LEU 689.A O no hydrogen 3.179 N/A THR 685.A OG1 LEU 689.A O no hydrogen 3.148 N/A GLY 688.A N THR 685.A OG1 no hydrogen 3.085 N/A LEU 689.A N THR 685.A OG1 no hydrogen 2.522 N/A ILE 691.A N TRP 683.A O no hydrogen 3.038 N/A GLN 693.A N VAL 681.A O no hydrogen 3.456 N/A GLN 693.A NE2 GLN 726.A O no hydrogen 3.112 N/A ARG 696.A NE GLU 282.A OE2 no hydrogen 2.895 N/A ARG 696.A NH1 ASN 719.A O no hydrogen 2.727 N/A ARG 696.A NH2 GLU 282.A OE2 no hydrogen 2.538 N/A GLU 697.A N PRO 720.A O no hydrogen 2.807 N/A LYS 701.A N ILE 712.A O no hydrogen 2.876 N/A VAL 703.A N VAL 710.A O no hydrogen 2.922 N/A THR 705.A N GLN 708.A O no hydrogen 2.947 N/A THR 705.A OG1 SER 179.A OG no hydrogen 3.334 N/A THR 705.A OG1 GLN 708.A O no hydrogen 2.121 N/A LEU 707.A N SER 179.A OG no hydrogen 3.120 N/A GLN 708.A N THR 705.A OG1 no hydrogen 3.408 N/A THR 709.A OG1 GLN 702.A OE1 no hydrogen 2.899 N/A SER 713.A OG GLU 698.A OE2 no hydrogen 3.071 N/A GLN 726.A N ASN 722.A O no hydrogen 2.949 N/A GLN 726.A NE2 TYR 695.A O no hydrogen 3.631 N/A LYS 727.A N ALA 723.A O no hydrogen 2.914 N/A ALA 728.A N ARG 724.A O no hydrogen 2.949 N/A GLY 729.A N GLN 726.A O no hydrogen 3.168 N/A LEU 730.A N GLN 726.A O no hydrogen 2.973 N/A ASN 733.A N GLY 729.A O no hydrogen 3.115 N/A ASN 733.A ND2 GLY 729.A O no hydrogen 2.312 N/A PHE 734.A N LEU 730.A O no hydrogen 2.945 N/A ILE 735.A N PRO 731.A O no hydrogen 2.966 N/A HIS 736.A N PRO 732.A O no hydrogen 2.861 N/A HIS 736.A ND1 PRO 732.A O no hydrogen 2.544 N/A SER 737.A N ASN 733.A O no hydrogen 2.916 N/A SER 737.A OG PHE 734.A O no hydrogen 2.555 N/A LEU 738.A N PHE 734.A O no hydrogen 2.939 N/A ASP 739.A N ILE 735.A O no hydrogen 2.870 N/A ALA 740.A N HIS 736.A O no hydrogen 2.892 N/A SER 741.A N SER 737.A O no hydrogen 2.908 N/A SER 741.A OG SER 737.A O no hydrogen 3.325 N/A SER 741.A OG LEU 738.A O no hydrogen 2.390 N/A HIS 742.A N LEU 738.A O no hydrogen 2.916 N/A MET 743.A N ASP 739.A O no hydrogen 2.861 N/A LEU 744.A N ALA 740.A O no hydrogen 2.876 N/A LEU 745.A N SER 741.A O no hydrogen 2.918 N/A SER 746.A N HIS 742.A O no hydrogen 2.933 N/A ALA 747.A N MET 743.A O no hydrogen 2.909 N/A ALA 748.A N LEU 744.A O no hydrogen 2.886 N/A GLU 749.A N LEU 745.A O no hydrogen 2.957 N/A CYS 750.A N SER 746.A O no hydrogen 2.914 N/A CYS 750.A SG SER 746.A O no hydrogen 3.402 N/A GLY 751.A N ALA 747.A O no hydrogen 2.890 N/A LYS 752.A N ALA 748.A O no hydrogen 2.914 N/A GLN 753.A N GLU 749.A O no hydrogen 2.927 N/A GLY 754.A N CYS 750.A O no hydrogen 2.893 N/A LEU 755.A N CYS 750.A O no hydrogen 3.148 N/A ALA 758.A N TRP 765.A O no hydrogen 3.330 N/A VAL 760.A N SER 763.A O no hydrogen 2.895 N/A SER 763.A OG ASP 762.A OD1 no hydrogen 2.942 N/A TYR 764.A N GLN 517.A O no hydrogen 2.791 N/A TRP 765.A N ALA 758.A O no hydrogen 2.698 N/A THR 766.A N VAL 515.A O no hydrogen 3.290 N/A THR 766.A OG1 ASP 756.A O no hydrogen 3.386 N/A THR 766.A OG1 TRP 765.A O no hydrogen 2.506 N/A SER 769.A OG ASP 770.A OD1 no hydrogen 2.769 N/A THR 773.A OG1 ASP 770.A O no hydrogen 2.743 N/A MET 774.A N ASP 770.A O no hydrogen 2.951 N/A ASN 775.A N ILE 771.A O no hydrogen 2.872 N/A ASN 775.A ND2 GLN 517.A OE1 no hydrogen 2.879 N/A VAL 776.A N ASP 772.A O no hydrogen 2.986 N/A VAL 777.A N THR 773.A O no hydrogen 2.931 N/A LEU 778.A N MET 774.A O no hydrogen 2.829 N/A ARG 779.A N ASN 775.A O no hydrogen 2.984 N/A ARG 779.A NE SER 910.A O no hydrogen 2.851 N/A ARG 779.A NH1 ASN 775.A O no hydrogen 3.258 N/A ARG 779.A NH1 ASN 775.A OD1 no hydrogen 2.914 N/A ARG 779.A NH2 SER 910.A O no hydrogen 2.739 N/A GLU 780.A N VAL 776.A O no hydrogen 2.967 N/A GLN 781.A N VAL 777.A O no hydrogen 2.887 N/A PHE 782.A N LEU 778.A O no hydrogen 2.963 N/A ILE 783.A N ARG 779.A O no hydrogen 2.997 N/A LYS 784.A N GLU 780.A O no hydrogen 2.927 N/A LYS 784.A NZ GLN 781.A OE1 no hydrogen 2.853 N/A LEU 785.A N GLN 781.A O no hydrogen 2.897 N/A HIS 786.A N PHE 782.A O no hydrogen 2.994 N/A ARG 793.A N ASP 789.A O no hydrogen 2.951 N/A ARG 793.A NH1 GLU 797.A OE1 no hydrogen 3.365 N/A ARG 793.A NH2 THR 684.A O no hydrogen 3.518 N/A LEU 794.A N LEU 790.A O no hydrogen 2.829 N/A LYS 795.A N VAL 791.A O no hydrogen 2.932 N/A LYS 795.A NZ LEU 893.A O no hydrogen 3.040 N/A LYS 795.A NZ PRO 894.A O no hydrogen 3.515 N/A GLU 796.A N LEU 792.A O no hydrogen 2.950 N/A GLU 797.A N ARG 793.A O no hydrogen 2.907 N/A PHE 798.A N LEU 794.A O no hydrogen 2.879 N/A ASP 799.A N LYS 795.A O no hydrogen 2.948 N/A GLN 800.A N GLU 796.A O no hydrogen 2.896 N/A ARG 801.A N GLU 797.A O no hydrogen 2.883 N/A TYR 802.A N PHE 798.A O no hydrogen 2.890 N/A VAL 806.A N ILE 660.A O no hydrogen 3.197 N/A GLY 809.A N VAL 887.A O no hydrogen 3.224 N/A LYS 812.A NZ SER 814.A OG no hydrogen 3.321 N/A THR 815.A N LYS 812.A O no hydrogen 3.356 N/A THR 815.A OG1 LYS 812.A O no hydrogen 3.168 N/A ALA 818.A N THR 815.A O no hydrogen 2.977 N/A ILE 822.A N ALA 818.A O no hydrogen 2.689 N/A ARG 823.A N GLN 819.A O no hydrogen 2.885 N/A ILE 824.A N LYS 820.A O no hydrogen 2.925 N/A ARG 825.A N ILE 821.A O no hydrogen 2.892 N/A LYS 826.A N ILE 822.A O no hydrogen 2.871 N/A ASP 827.A N ARG 823.A O no hydrogen 3.104 N/A LEU 828.A N ILE 824.A O no hydrogen 3.074 N/A SER 829.A N ARG 825.A O no hydrogen 2.544 N/A SER 829.A OG ARG 825.A O no hydrogen 2.602 N/A SER 829.A OG ARG 834.A O no hydrogen 3.328 N/A ARG 830.A N LYS 826.A O no hydrogen 2.794 N/A LYS 831.A N ASP 827.A O no hydrogen 3.030 N/A LYS 831.A NZ ASP 827.A O no hydrogen 2.998 N/A LEU 832.A N LEU 828.A O no hydrogen 2.594 N/A GLY 833.A N SER 829.A O no hydrogen 2.511 N/A LEU 838.A N ASN 673.A OD1 no hydrogen 2.921 N/A GLU 841.A N THR 837.A O no hydrogen 2.952 N/A ILE 842.A N LEU 838.A O no hydrogen 2.868 N/A TYR 843.A N ALA 839.A O no hydrogen 2.902 N/A PHE 844.A N ASP 840.A O no hydrogen 2.922 N/A GLU 845.A N GLU 841.A O no hydrogen 2.921 N/A LYS 846.A N ILE 842.A O no hydrogen 2.863 N/A LYS 847.A N TYR 843.A O no hydrogen 2.914 N/A ARG 848.A N PHE 844.A O no hydrogen 3.064 N/A GLN 849.A N GLU 845.A O no hydrogen 3.340 N/A GLU 850.A N LYS 846.A O no hydrogen 2.751 N/A LEU 851.A N LYS 847.A O no hydrogen 3.215 N/A ASN 853.A N GLN 849.A O no hydrogen 2.863 N/A ASN 853.A N GLU 850.A O no hydrogen 3.134 N/A ARG 860.A N LEU 856.A O no hydrogen 3.142 N/A ARG 860.A NH1 PRO 855.A O no hydrogen 3.123 N/A ASN 861.A N ILE 857.A O no hydrogen 2.968 N/A VAL 862.A N GLU 858.A O no hydrogen 3.161 N/A GLY 863.A N ASP 859.A O no hydrogen 2.906 N/A GLU 864.A N ARG 860.A O no hydrogen 2.616 N/A LYS 865.A N ASN 861.A O no hydrogen 2.884 N/A MET 866.A N GLY 863.A O no hydrogen 3.231 N/A THR 868.A N SER 871.A OG no hydrogen 3.396 N/A SER 871.A OG THR 868.A O no hydrogen 2.590 N/A LEU 872.A N THR 869.A O no hydrogen 3.225 N/A GLU 874.A N SER 871.A O no hydrogen 3.281 N/A LEU 882.A N ASP 878.A O no hydrogen 3.085 N/A GLU 883.A N LEU 879.A O no hydrogen 2.914 N/A MET 885.A N LEU 811.A O no hydrogen 2.428 N/A VAL 887.A N GLY 809.A O no hydrogen 2.821 N/A LEU 889.A N LYS 807.A O no hydrogen 3.339 N/A LEU 891.A N TYR 805.A O no hydrogen 3.205 N/A ARG 892.A NH2 ILE 876.A O no hydrogen 3.238 N/A GLU 895.A N GLU 895.A OE1 no hydrogen 2.716 N/A LYS 899.A NZ LEU 530.A O no hydrogen 2.907 N/A GLY 900.A N GLY 531.A O no hydrogen 2.895 N/A THR 905.A OG1 ASP 903.A OD1 no hydrogen 2.735 N/A LEU 907.A N ASP 903.A O no hydrogen 3.023 N/A ARG 908.A N VAL 904.A O no hydrogen 2.961 N/A SER 910.A N LEU 907.A O no hydrogen 3.020 N/A SER 910.A OG ASN 541.A O no hydrogen 3.358 N/A SER 910.A OG VAL 543.A O no hydrogen 3.273 N/A TYR 912.A OH ASP 546.A O no hydrogen 2.770 N/A PHE 913.A N SER 910.A O no hydrogen 3.332 N/A SER 915.A OG ASP 449.A OD1 no hydrogen 2.988 N/A