Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8u8u_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 7.A N SER 3.A O no hydrogen 3.380 N/A ARG 8.A N GLY 4.A O no hydrogen 2.909 N/A LEU 9.A N GLN 5.A O no hydrogen 2.934 N/A LEU 10.A N GLN 6.A O no hydrogen 2.943 N/A ALA 11.A N GLN 7.A O no hydrogen 2.948 N/A PHE 12.A N ARG 8.A O no hydrogen 2.905 N/A PHE 13.A N LEU 9.A O no hydrogen 2.929 N/A LYS 14.A N LEU 10.A O no hydrogen 2.970 N/A CYS 15.A N ALA 11.A O no hydrogen 2.918 N/A CYS 16.A N PHE 12.A O no hydrogen 2.933 N/A CYS 16.A SG PHE 12.A O no hydrogen 3.272 N/A LEU 17.A N PHE 13.A O no hydrogen 2.930 N/A LEU 18.A N LYS 14.A O no hydrogen 2.976 N/A THR 19.A N CYS 15.A O no hydrogen 2.900 N/A THR 19.A OG1 CYS 15.A O no hydrogen 3.032 N/A THR 19.A OG1 CYS 16.A O no hydrogen 3.333 N/A LEU 22.A N ASP 20.A O no hydrogen 2.911 N/A HIS 26.A N LEU 22.A O no hydrogen 2.954 N/A HIS 27.A N PRO 23.A O no hydrogen 2.904 N/A LEU 28.A N LEU 24.A O no hydrogen 3.053 N/A LEU 29.A N ALA 25.A O no hydrogen 2.966 N/A VAL 30.A N HIS 26.A O no hydrogen 2.939 N/A VAL 31.A N HIS 27.A O no hydrogen 2.973 N/A HIS 32.A N LEU 28.A O no hydrogen 2.837 N/A HIS 32.A NE2 GLY 246.A O no hydrogen 3.077 N/A HIS 33.A N LEU 29.A O no hydrogen 3.021 N/A GLN 37.A N GLN 37.A OE1 no hydrogen 2.635 N/A ARG 39.A N GLN 35.A O no hydrogen 2.741 N/A LEU 42.A N ARG 39.A O no hydrogen 3.107 N/A THR 43.A OG1 LEU 41.A O no hydrogen 3.382 N/A TYR 47.A N THR 43.A O no hydrogen 3.511 N/A ASN 48.A N LEU 44.A O no hydrogen 2.931 N/A ALA 49.A N ASP 45.A O no hydrogen 2.887 N/A VAL 50.A N MET 46.A O no hydrogen 2.975 N/A MET 51.A N TYR 47.A O no hydrogen 2.912 N/A LEU 52.A N ASN 48.A O no hydrogen 2.885 N/A GLY 53.A N ALA 49.A O no hydrogen 2.951 N/A TRP 54.A N VAL 50.A O no hydrogen 2.938 N/A ALA 55.A N MET 51.A O no hydrogen 2.888 N/A ARG 56.A N LEU 52.A O no hydrogen 2.954 N/A GLY 58.A N ALA 55.A O no hydrogen 3.044 N/A ALA 59.A N TRP 54.A O no hydrogen 3.342 N/A LYS 61.A NZ LYS 61.A O no hydrogen 2.922 N/A VAL 64.A N PHE 60.A O no hydrogen 3.296 N/A TYR 65.A N LYS 61.A O no hydrogen 2.952 N/A VAL 66.A N GLU 62.A O no hydrogen 2.905 N/A LEU 67.A N LEU 63.A O no hydrogen 2.889 N/A PHE 68.A N VAL 64.A O no hydrogen 2.895 N/A MET 69.A N TYR 65.A O no hydrogen 2.917 N/A VAL 70.A N VAL 66.A O no hydrogen 2.908 N/A LYS 71.A N LEU 67.A O no hydrogen 2.873 N/A ASP 72.A N PHE 68.A O no hydrogen 2.901 N/A ALA 73.A N MET 69.A O no hydrogen 2.918 N/A LEU 79.A N ASP 78.A OD1 no hydrogen 2.876 N/A SER 81.A N ASP 78.A O no hydrogen 3.272 N/A SER 81.A OG ASP 78.A O no hydrogen 2.709 N/A ALA 83.A N LEU 79.A O no hydrogen 2.924 N/A ALA 84.A N LEU 80.A O no hydrogen 2.919 N/A ALA 85.A N SER 81.A O no hydrogen 2.903 N/A LEU 86.A N TYR 82.A O no hydrogen 2.932 N/A GLN 87.A N ALA 83.A O no hydrogen 2.943 N/A CYS 88.A N ALA 84.A O no hydrogen 3.263 N/A MET 89.A N ALA 85.A O no hydrogen 2.947 N/A GLY 90.A N LEU 86.A O no hydrogen 2.869 N/A ARG 91.A N GLN 87.A O no hydrogen 2.963 N/A ARG 91.A NH2 GLU 125.A OE2 no hydrogen 3.497 N/A GLN 92.A N CYS 88.A O no hydrogen 2.918 N/A ASP 93.A N GLY 90.A O no hydrogen 3.025 N/A GLN 94.A N MET 89.A O no hydrogen 3.320 N/A THR 98.A OG1 ASP 95.A OD1 no hydrogen 2.789 N/A GLU 100.A N ALA 96.A O no hydrogen 2.899 N/A ARG 101.A N GLY 97.A O no hydrogen 2.892 N/A CYS 102.A N THR 98.A O no hydrogen 2.921 N/A LEU 103.A N ILE 99.A O no hydrogen 2.918 N/A GLU 104.A N GLU 100.A O no hydrogen 2.892 N/A GLN 105.A N ARG 101.A O no hydrogen 2.894 N/A MET 106.A N CYS 102.A O no hydrogen 2.914 N/A SER 107.A N LEU 103.A O no hydrogen 2.888 N/A SER 107.A OG LEU 103.A O no hydrogen 2.897 N/A GLN 108.A N GLU 104.A O no hydrogen 2.904 N/A GLU 109.A N GLN 105.A O no hydrogen 3.356 N/A GLU 109.A N MET 106.A O no hydrogen 3.259 N/A GLY 110.A N SER 107.A O no hydrogen 3.079 N/A LEU 111.A N MET 106.A O no hydrogen 3.206 N/A ALA 115.A N LYS 112.A O no hydrogen 3.132 N/A THR 118.A N GLN 114.A O no hydrogen 2.928 N/A THR 118.A N ALA 115.A O no hydrogen 3.083 N/A THR 118.A OG1 GLN 114.A O no hydrogen 2.898 N/A THR 118.A OG1 ALA 115.A O no hydrogen 3.406 N/A ALA 119.A N ALA 115.A O no hydrogen 2.551 N/A SER 123.A OG GLU 124.A OE1 no hydrogen 3.250 N/A ARG 127.A N SER 123.A O no hydrogen 2.982 N/A ALA 128.A N GLU 124.A O no hydrogen 2.910 N/A THR 129.A N GLU 125.A O no hydrogen 2.904 N/A THR 129.A OG1 GLU 125.A O no hydrogen 2.793 N/A VAL 130.A N ASP 126.A O no hydrogen 2.954 N/A LEU 131.A N ARG 127.A O no hydrogen 2.877 N/A LYS 132.A N ALA 128.A O no hydrogen 2.894 N/A ALA 133.A N THR 129.A O no hydrogen 2.929 N/A VAL 134.A N VAL 130.A O no hydrogen 2.938 N/A HIS 135.A N LEU 131.A O no hydrogen 2.876 N/A HIS 135.A NE2 PHE 141.A O no hydrogen 2.678 N/A LYS 136.A N LYS 132.A O no hydrogen 2.910 N/A VAL 137.A N ALA 133.A O no hydrogen 2.956 N/A LYS 138.A N VAL 134.A O no hydrogen 2.527 N/A SER 142.A OG LEU 143.A O no hydrogen 3.488 N/A SER 154.A N ASN 152.A OD1 no hydrogen 3.050 N/A TYR 161.A OH ASP 473.A OD2 no hydrogen 3.345 N/A SER 168.A N ARG 896.A O no hydrogen 3.351 N/A LYS 171.A NZ LEU 319.A O no hydrogen 3.329 N/A LYS 171.A NZ ALA 321.A O no hydrogen 3.059 N/A LYS 171.A NZ ALA 324.A O no hydrogen 3.538 N/A LEU 172.A N LEU 320.A O no hydrogen 3.364 N/A LYS 177.A NZ GLN 180.A OE1 no hydrogen 3.333 N/A LEU 179.A N PRO 175.A O no hydrogen 3.132 N/A GLN 180.A N LEU 176.A O no hydrogen 2.954 N/A CYS 181.A SG THR 178.A O no hydrogen 3.219 N/A LYS 185.A N CYS 181.A O no hydrogen 2.971 N/A GLN 186.A N LEU 182.A O no hydrogen 2.914 N/A LEU 187.A N PHE 183.A O no hydrogen 2.893 N/A HIS 188.A N GLU 184.A O no hydrogen 2.926 N/A MET 189.A N LYS 185.A O no hydrogen 2.954 N/A GLU 190.A N GLN 186.A O no hydrogen 2.851 N/A LEU 191.A N LEU 187.A O no hydrogen 2.954 N/A ALA 192.A N HIS 188.A O no hydrogen 3.507 N/A VAL 195.A N PHE 417.A O no hydrogen 2.884 N/A VAL 197.A N LEU 415.A O no hydrogen 2.886 N/A SER 199.A N PRO 413.A O no hydrogen 2.848 N/A GLU 201.A N SER 199.A OG no hydrogen 3.368 N/A LYS 202.A NZ GLN 498.A O no hydrogen 3.129 N/A HIS 212.A N LYS 208.A O no hydrogen 2.936 N/A ALA 213.A N GLU 209.A O no hydrogen 2.921 N/A ARG 214.A N VAL 210.A O no hydrogen 2.902 N/A LYS 215.A N LYS 211.A O no hydrogen 2.941 N/A THR 216.A N HIS 212.A O no hydrogen 2.987 N/A THR 216.A OG1 HIS 212.A O no hydrogen 3.314 N/A THR 216.A OG1 ALA 213.A O no hydrogen 2.477 N/A LEU 217.A N ALA 213.A O no hydrogen 2.900 N/A LYS 218.A N ARG 214.A O no hydrogen 2.932 N/A THR 219.A N LYS 215.A O no hydrogen 3.023 N/A THR 219.A OG1 LYS 215.A O no hydrogen 3.398 N/A LEU 220.A N THR 216.A O no hydrogen 2.932 N/A ARG 221.A N LEU 217.A O no hydrogen 2.891 N/A ASP 222.A N LYS 218.A O no hydrogen 3.003 N/A GLN 223.A N THR 219.A O no hydrogen 3.030 N/A TRP 224.A N LEU 220.A O no hydrogen 2.871 N/A TRP 224.A NE1 GLN 371.A O no hydrogen 2.896 N/A GLU 225.A N ARG 221.A O no hydrogen 2.921 N/A LYS 226.A N ASP 222.A O no hydrogen 3.060 N/A ALA 227.A N GLN 223.A O no hydrogen 2.942 N/A LEU 228.A N TRP 224.A O no hydrogen 2.867 N/A CYS 229.A N GLU 225.A O no hydrogen 2.992 N/A CYS 229.A SG GLU 225.A O no hydrogen 3.156 N/A ARG 230.A N LYS 226.A O no hydrogen 3.028 N/A ALA 231.A N ALA 227.A O no hydrogen 2.896 N/A LEU 232.A N LEU 228.A O no hydrogen 2.907 N/A ARG 233.A N CYS 229.A O no hydrogen 2.985 N/A ARG 233.A NE GLU 259.A OE1 no hydrogen 3.156 N/A ARG 233.A NE GLU 259.A OE2 no hydrogen 3.422 N/A ARG 233.A NH2 GLU 259.A OE1 no hydrogen 3.067 N/A GLU 234.A N ARG 230.A O no hydrogen 2.983 N/A THR 235.A N ALA 231.A O no hydrogen 2.906 N/A THR 235.A OG1 ALA 231.A O no hydrogen 3.142 N/A LYS 236.A N LEU 232.A O no hydrogen 2.925 N/A ASN 237.A N ARG 233.A O no hydrogen 2.918 N/A ARG 238.A N GLU 234.A O no hydrogen 3.106 N/A LEU 239.A N THR 235.A O no hydrogen 3.036 N/A GLU 240.A N LYS 236.A O no hydrogen 3.368 N/A GLU 242.A N ARG 238.A O no hydrogen 3.286 N/A GLU 242.A N LEU 239.A O no hydrogen 2.988 N/A VAL 243.A N GLU 240.A O no hydrogen 3.074 N/A GLY 246.A N VAL 243.A O no hydrogen 3.047 N/A ARG 247.A NH1 GLU 245.A OE1 no hydrogen 2.646 N/A SER 249.A OG LEU 239.A O no hydrogen 3.368 N/A TYR 251.A N SER 249.A OG no hydrogen 3.189 N/A LEU 254.A N LEU 250.A O no hydrogen 2.808 N/A CYS 255.A N TYR 251.A O no hydrogen 3.356 N/A CYS 255.A SG TYR 251.A O no hydrogen 3.742 N/A LEU 256.A N PHE 253.A O no hydrogen 3.198 N/A ARG 260.A N ASP 258.A OD2 no hydrogen 3.358 N/A VAL 262.A N GLU 259.A O no hydrogen 3.253 N/A VAL 263.A N GLU 259.A O no hydrogen 3.134 N/A ARG 264.A N ARG 260.A O no hydrogen 3.184 N/A MET 265.A N GLU 261.A O no hydrogen 3.154 N/A LEU 266.A N VAL 262.A O no hydrogen 2.936 N/A LEU 267.A N VAL 263.A O no hydrogen 2.936 N/A GLN 268.A N ARG 264.A O no hydrogen 2.925 N/A VAL 269.A N MET 265.A O no hydrogen 2.921 N/A LEU 270.A N LEU 266.A O no hydrogen 2.927 N/A GLN 271.A N LEU 267.A O no hydrogen 2.905 N/A ALA 272.A N GLN 268.A O no hydrogen 2.931 N/A ALA 272.A N VAL 269.A O no hydrogen 3.236 N/A LEU 273.A N LEU 270.A O no hydrogen 3.458 N/A GLN 276.A N GLN 276.A OE1 no hydrogen 2.748 N/A LEU 283.A N SER 279.A O no hydrogen 3.359 N/A ALA 284.A N PHE 280.A O no hydrogen 2.976 N/A ARG 285.A N THR 281.A O no hydrogen 2.940 N/A GLU 286.A N THR 282.A O no hydrogen 2.935 N/A LEU 287.A N LEU 283.A O no hydrogen 2.931 N/A SER 288.A N ALA 284.A O no hydrogen 3.013 N/A SER 288.A OG ALA 284.A O no hydrogen 3.117 N/A SER 288.A OG GLN 355.A O no hydrogen 2.538 N/A ALA 289.A N ARG 285.A O no hydrogen 2.950 N/A ARG 290.A N GLU 286.A O no hydrogen 2.911 N/A ARG 290.A NH1 GLU 418.A OE2 no hydrogen 3.361 N/A THR 291.A N LEU 287.A O no hydrogen 2.967 N/A PHE 292.A N SER 288.A O no hydrogen 3.025 N/A SER 293.A N ALA 289.A O no hydrogen 2.969 N/A SER 293.A OG ALA 289.A O no hydrogen 2.871 N/A ARG 294.A N ARG 290.A O no hydrogen 2.910 N/A HIS 295.A N THR 291.A O no hydrogen 2.983 N/A VAL 296.A N PHE 292.A O no hydrogen 2.977 N/A VAL 297.A N SER 293.A O no hydrogen 2.976 N/A GLN 298.A N ARG 294.A O no hydrogen 2.894 N/A ARG 299.A N HIS 295.A O no hydrogen 2.960 N/A ARG 299.A NE GLU 347.A OE2 no hydrogen 3.274 N/A ARG 299.A NH2 GLU 347.A OE2 no hydrogen 3.060 N/A GLN 300.A NE2 VAL 296.A O no hydrogen 3.547 N/A SER 303.A N ARG 299.A O no hydrogen 2.957 N/A SER 303.A OG ARG 299.A O no hydrogen 3.068 N/A SER 303.A OG GLN 300.A O no hydrogen 3.289 N/A LEU 309.A N GLN 305.A O no hydrogen 2.923 N/A GLN 310.A N VAL 306.A O no hydrogen 2.877 N/A ASN 311.A N GLN 307.A O no hydrogen 2.967 N/A HIS 312.A N ALA 308.A O no hydrogen 2.953 N/A TYR 313.A N LEU 309.A O no hydrogen 2.880 N/A TYR 313.A OH PRO 427.A O no hydrogen 2.541 N/A ARG 314.A N GLN 310.A O no hydrogen 2.905 N/A LYS 315.A N ASN 311.A O no hydrogen 2.996 N/A LYS 315.A NZ HIS 312.A ND1 no hydrogen 3.462 N/A TYR 316.A N HIS 312.A O no hydrogen 2.857 N/A LEU 317.A N TYR 313.A O no hydrogen 2.943 N/A CYS 318.A N LYS 315.A O no hydrogen 3.435 N/A CYS 318.A SG LYS 315.A O no hydrogen 3.490 N/A LEU 319.A N TYR 316.A O no hydrogen 3.259 N/A SER 322.A OG HIS 173.A O no hydrogen 3.502 N/A SER 322.A OG LEU 174.A O no hydrogen 3.438 N/A CYS 330.A SG LEU 331.A O no hydrogen 3.602 N/A LEU 331.A N GLN 334.A OE1 no hydrogen 3.460 N/A ARG 333.A NE ASP 473.A OD1 no hydrogen 3.032 N/A TYR 335.A N LEU 331.A O no hydrogen 3.029 N/A TRP 336.A N PRO 332.A O no hydrogen 2.903 N/A GLU 337.A N ARG 333.A O no hydrogen 2.941 N/A ALA 338.A N GLN 334.A O no hydrogen 2.886 N/A LEU 339.A N TYR 335.A O no hydrogen 3.319 N/A GLN 355.A N PRO 351.A O no hydrogen 2.878 N/A GLN 355.A NE2 TRP 350.A O no hydrogen 2.653 N/A MET 356.A N LEU 352.A O no hydrogen 2.646 N/A GLU 357.A N PRO 353.A O no hydrogen 3.264 N/A GLY 359.A N GLN 355.A O no hydrogen 3.432 N/A LEU 361.A N GLU 357.A O no hydrogen 2.978 N/A LEU 362.A N LEU 358.A O no hydrogen 3.202 N/A ALA 363.A N GLY 359.A O no hydrogen 2.614 N/A GLU 364.A N LYS 360.A O no hydrogen 2.780 N/A MET 365.A N LEU 361.A O no hydrogen 3.217 N/A ALA 369.A N MET 365.A O no hydrogen 2.957 N/A THR 370.A N LEU 366.A O no hydrogen 3.283 N/A THR 370.A OG1 LEU 366.A O no hydrogen 3.014 N/A MET 372.A N VAL 379.A O no hydrogen 2.934 N/A CYS 374.A SG ARG 377.A O no hydrogen 3.203 N/A SER 375.A OG CYS 374.A O no hydrogen 2.711 N/A VAL 379.A N MET 372.A O no hydrogen 2.769 N/A TYR 383.A N LYS 398.A O no hydrogen 2.845 N/A HIS 384.A NE2 GLU 364.A OE2 no hydrogen 2.777 N/A VAL 385.A N ILE 396.A O no hydrogen 2.726 N/A SER 387.A N ILE 394.A O no hydrogen 3.201 N/A ARG 389.A N GLN 392.A O no hydrogen 2.724 N/A ARG 389.A NH1 GLY 277.A O no hydrogen 3.432 N/A ILE 394.A N SER 387.A O no hydrogen 3.135 N/A ILE 396.A N VAL 385.A O no hydrogen 2.802 N/A LEU 397.A N GLU 278.A O no hydrogen 3.477 N/A LYS 398.A N TYR 383.A O no hydrogen 2.885 N/A ALA 402.A N HIS 400.A ND1 no hydrogen 3.175 N/A VAL 404.A N HIS 400.A O no hydrogen 3.273 N/A GLN 405.A N PRO 401.A O no hydrogen 2.908 N/A LEU 406.A N ALA 402.A O no hydrogen 2.922 N/A LEU 407.A N TYR 403.A O no hydrogen 2.936 N/A GLU 408.A N VAL 404.A O no hydrogen 2.895 N/A LYS 409.A N GLN 405.A O no hydrogen 2.926 N/A ALA 410.A N LEU 406.A O no hydrogen 3.326 N/A GLU 412.A N GLU 412.A OE1 no hydrogen 2.808 N/A LEU 415.A N VAL 197.A O no hydrogen 2.724 N/A PHE 417.A N VAL 195.A O no hydrogen 2.862 N/A MET 424.A N TRP 571.A O no hydrogen 3.329 N/A LEU 425.A N GLN 186.A OE1 no hydrogen 2.659 N/A CYS 426.A SG PRO 427.A O no hydrogen 3.638 N/A LEU 429.A N ALA 438.A O no hydrogen 3.118 N/A TRP 431.A N THR 476.A OG1 no hydrogen 2.985 N/A THR 432.A OG1 SER 436.A OG no hydrogen 2.803 N/A SER 433.A OG SER 436.A OG no hydrogen 2.869 N/A HIS 435.A N SER 433.A OG no hydrogen 3.069 N/A SER 436.A N SER 433.A OG no hydrogen 3.014 N/A SER 436.A OG THR 432.A OG1 no hydrogen 2.803 N/A SER 436.A OG SER 433.A OG no hydrogen 2.869 N/A SER 442.A OG PRO 443.A O no hydrogen 3.436 N/A LYS 445.A NZ THR 449.A OG1 no hydrogen 2.929 N/A ARG 448.A N MET 576.A O no hydrogen 2.990 N/A ARG 448.A NH2 PRO 584.A O no hydrogen 2.599 N/A GLN 455.A NE2 GLN 856.A O no hydrogen 3.459 N/A GLN 457.A NE2 GLU 461.A OE2 no hydrogen 2.930 N/A GLU 458.A N THR 454.A O no hydrogen 3.264 N/A LEU 459.A N GLN 455.A O no hydrogen 3.250 N/A LEU 460.A N HIS 456.A O no hydrogen 2.966 N/A GLU 461.A N GLN 457.A O no hydrogen 2.901 N/A GLU 461.A N GLU 458.A O no hydrogen 3.330 N/A THR 462.A N GLU 458.A O no hydrogen 3.215 N/A THR 462.A OG1 GLU 458.A O no hydrogen 3.157 N/A CYS 463.A SG LEU 460.A O no hydrogen 3.557 N/A CYS 463.A SG PRO 464.A O no hydrogen 3.340 N/A ALA 467.A N PRO 464.A O no hydrogen 3.269 N/A LEU 472.A N LEU 468.A O no hydrogen 2.974 N/A ASP 473.A N HIS 469.A O no hydrogen 2.869 N/A ALA 474.A N GLY 470.A O no hydrogen 2.940 N/A LEU 475.A N ALA 471.A O no hydrogen 2.952 N/A THR 476.A N LEU 472.A O no hydrogen 2.928 N/A THR 476.A OG1 LEU 472.A O no hydrogen 2.839 N/A GLN 477.A N ASP 473.A O no hydrogen 2.883 N/A GLN 477.A NE2 ALA 891.A O no hydrogen 3.126 N/A LEU 478.A N ALA 474.A O no hydrogen 2.942 N/A GLY 479.A N LEU 475.A O no hydrogen 2.934 N/A ASN 480.A N THR 476.A O no hydrogen 3.309 N/A TRP 483.A N PHE 570.A O no hydrogen 3.174 N/A ARG 484.A N GLU 602.A O no hydrogen 3.033 N/A ARG 484.A NE GLU 602.A OE2 no hydrogen 2.875 N/A ARG 484.A NH2 GLU 602.A OE2 no hydrogen 3.497 N/A ASN 486.A N LEU 600.A O no hydrogen 2.804 N/A ARG 488.A NH2 ALA 651.A O no hydrogen 3.537 N/A ASP 491.A N GLY 487.A O no hydrogen 2.911 N/A LEU 492.A N ARG 488.A O no hydrogen 2.996 N/A VAL 493.A N VAL 489.A O no hydrogen 2.886 N/A LEU 494.A N LEU 490.A O no hydrogen 2.911 N/A GLN 495.A N ASP 491.A O no hydrogen 2.916 N/A LEU 496.A N LEU 492.A O no hydrogen 3.003 N/A PHE 497.A N VAL 493.A O no hydrogen 2.850 N/A GLN 498.A N LEU 494.A O no hydrogen 2.948 N/A VAL 507.A N CYS 502.A O no hydrogen 3.213 N/A GLU 513.A N PRO 510.A O no hydrogen 3.108 N/A ALA 514.A N PRO 511.A O no hydrogen 3.369 N/A ALA 526.A N PRO 523.A O no hydrogen 3.476 N/A LYS 531.A N ALA 527.A O no hydrogen 3.315 N/A ALA 532.A N PRO 528.A O no hydrogen 2.905 N/A GLU 533.A N ALA 529.A O no hydrogen 2.923 N/A LEU 534.A N ARG 530.A O no hydrogen 2.962 N/A GLU 537.A N GLU 533.A O no hydrogen 2.941 N/A LEU 538.A N LEU 534.A O no hydrogen 2.943 N/A ALA 539.A N ARG 535.A O no hydrogen 2.930 N/A HIS 540.A N ARG 536.A O no hydrogen 2.908 N/A CYS 541.A N GLU 537.A O no hydrogen 2.934 N/A CYS 541.A SG GLU 537.A O no hydrogen 3.246 N/A GLN 542.A N LEU 538.A O no hydrogen 2.962 N/A LYS 543.A N ALA 539.A O no hydrogen 2.915 N/A VAL 544.A N HIS 540.A O no hydrogen 2.948 N/A ALA 545.A N CYS 541.A O no hydrogen 2.970 N/A ARG 546.A N GLN 542.A O no hydrogen 2.943 N/A GLU 547.A N LYS 543.A O no hydrogen 2.936 N/A MET 548.A N VAL 544.A O no hydrogen 2.887 N/A HIS 549.A N ALA 545.A O no hydrogen 3.020 N/A ARG 552.A NH2 PHE 497.A O no hydrogen 3.051 N/A ALA 553.A N HIS 549.A O no hydrogen 3.003 N/A GLU 554.A N SER 550.A O no hydrogen 2.931 N/A ALA 555.A N LEU 551.A O no hydrogen 2.940 N/A LEU 556.A N ARG 552.A O no hydrogen 2.955 N/A ARG 558.A N GLU 554.A O no hydrogen 3.001 N/A LEU 559.A N ALA 555.A O no hydrogen 2.889 N/A SER 560.A N LEU 556.A O no hydrogen 2.989 N/A SER 560.A OG LEU 556.A O no hydrogen 2.849 N/A HIS 564.A N SER 560.A O no hydrogen 2.958 N/A LEU 565.A N LEU 561.A O no hydrogen 2.858 N/A ARG 566.A NH1 ASP 491.A OD1 no hydrogen 3.409 N/A ARG 566.A NH2 ASP 491.A OD1 no hydrogen 3.018 N/A PHE 570.A N TRP 483.A O no hydrogen 3.497 N/A TRP 571.A N MET 424.A O no hydrogen 3.083 N/A ASN 575.A N TYR 583.A O no hydrogen 2.916 N/A MET 576.A N LEU 446.A O no hydrogen 3.060 N/A ASP 577.A N ARG 581.A O no hydrogen 3.117 N/A ARG 579.A NH2 ASP 577.A OD2 no hydrogen 2.582 N/A GLY 580.A N ASP 577.A OD1 no hydrogen 2.933 N/A TYR 583.A N ASN 575.A O no hydrogen 3.259 N/A CYS 585.A N PRO 573.A O no hydrogen 3.228 N/A ARG 598.A N SER 594.A O no hydrogen 3.149 N/A ALA 599.A N ASP 595.A O no hydrogen 2.935 N/A LEU 600.A N VAL 596.A O no hydrogen 3.333 N/A GLU 602.A N ARG 484.A O no hydrogen 3.121 N/A PHE 603.A N HIS 692.A O no hydrogen 2.841 N/A ALA 604.A N ALA 482.A O no hydrogen 3.271 N/A GLN 605.A NE2 LYS 171.A O no hydrogen 3.080 N/A ARG 607.A N SER 691.A O no hydrogen 3.432 N/A LEU 609.A N TYR 689.A O no hydrogen 3.036 N/A GLY 610.A N ALA 687.A O no hydrogen 3.413 N/A LEU 617.A N GLY 613.A O no hydrogen 2.962 N/A LYS 618.A N LEU 614.A O no hydrogen 2.955 N/A ILE 619.A N ASP 615.A O no hydrogen 2.941 N/A HIS 620.A N TRP 616.A O no hydrogen 2.900 N/A LEU 621.A N LEU 617.A O no hydrogen 2.948 N/A VAL 622.A N LYS 618.A O no hydrogen 2.964 N/A ASN 623.A N ILE 619.A O no hydrogen 2.916 N/A LEU 624.A N HIS 620.A O no hydrogen 2.905 N/A THR 625.A N LEU 621.A O no hydrogen 2.972 N/A THR 625.A OG1 VAL 622.A O no hydrogen 2.707 N/A GLY 626.A N VAL 622.A O no hydrogen 3.228 N/A LYS 629.A NZ GLU 665.A OE2 no hydrogen 3.468 N/A ARG 636.A N PRO 632.A O no hydrogen 3.299 N/A ARG 636.A NE GLU 631.A O no hydrogen 3.305 N/A ARG 636.A NH1 ASN 623.A OD1 no hydrogen 2.744 N/A ARG 636.A NH2 GLU 631.A O no hydrogen 3.373 N/A LEU 637.A N LEU 633.A O no hydrogen 2.951 N/A ALA 638.A N ARG 634.A O no hydrogen 2.918 N/A PHE 639.A N LYS 635.A O no hydrogen 2.903 N/A ALA 640.A N ARG 636.A O no hydrogen 2.944 N/A GLU 642.A N PHE 639.A O no hydrogen 3.259 N/A ASP 646.A N ASP 645.A OD1 no hydrogen 2.719 N/A ILE 647.A N VAL 643.A O no hydrogen 3.235 N/A LEU 648.A N MET 644.A O no hydrogen 2.941 N/A ASP 649.A N ASP 645.A O no hydrogen 2.918 N/A SER 650.A N ASP 646.A O no hydrogen 2.902 N/A SER 650.A OG ASP 646.A O no hydrogen 3.260 N/A ALA 651.A N ILE 647.A O no hydrogen 2.918 N/A ASP 652.A N LEU 648.A O no hydrogen 2.935 N/A GLN 653.A N ASP 649.A O no hydrogen 3.270 N/A ARG 658.A NE ASP 649.A OD2 no hydrogen 2.598 N/A ARG 658.A NH2 ASP 649.A OD2 no hydrogen 2.997 N/A LYS 659.A NZ GLY 657.A O no hydrogen 3.547 N/A ALA 664.A N TRP 661.A O no hydrogen 3.318 N/A TRP 668.A NE1 LEU 505.A O no hydrogen 3.169 N/A THR 670.A N GLU 666.A O no hydrogen 3.101 N/A THR 670.A OG1 GLU 666.A O no hydrogen 2.364 N/A LEU 671.A N PRO 667.A O no hydrogen 2.930 N/A ALA 672.A N TRP 668.A O no hydrogen 2.937 N/A CYS 673.A N GLN 669.A O no hydrogen 2.925 N/A CYS 673.A SG LEU 617.A O no hydrogen 3.874 N/A CYS 674.A N THR 670.A O no hydrogen 2.887 N/A CYS 674.A SG THR 670.A O no hydrogen 3.154 N/A MET 675.A N LEU 671.A O no hydrogen 2.976 N/A VAL 677.A N CYS 673.A O no hydrogen 2.968 N/A ALA 678.A N CYS 674.A O no hydrogen 2.920 N/A ASN 679.A N MET 675.A O no hydrogen 2.951 N/A ALA 680.A N GLU 676.A O no hydrogen 2.901 N/A VAL 681.A N VAL 677.A O no hydrogen 2.953 N/A ARG 682.A NH1 ASP 652.A OD1 no hydrogen 3.150 N/A ARG 682.A NH2 ASP 652.A OD1 no hydrogen 2.990 N/A ARG 682.A NH2 ASP 652.A OD2 no hydrogen 3.038 N/A ALA 683.A N ALA 680.A O no hydrogen 3.407 N/A ALA 688.A N ASP 685.A O no hydrogen 3.231 N/A TYR 689.A N PRO 686.A O no hydrogen 3.394 N/A SER 691.A N ARG 607.A O no hydrogen 3.113 N/A SER 691.A OG GLU 676.A OE2 no hydrogen 2.234 N/A HIS 692.A ND1 PHE 603.A O no hydrogen 2.999 N/A VAL 695.A N THR 910.A O no hydrogen 2.715 N/A GLN 697.A N TYR 908.A O no hydrogen 2.768 N/A GLN 697.A NE2 ASN 919.A OD1 no hydrogen 3.449 N/A CYS 701.A SG TYR 732.A OH no hydrogen 3.803 N/A GLN 705.A N CYS 701.A O no hydrogen 3.076 N/A GLN 705.A NE2 VAL 720.A O no hydrogen 2.969 N/A GLN 705.A NE2 PHE 983.A O no hydrogen 3.627 N/A HIS 706.A N ASN 702.A O no hydrogen 2.932 N/A HIS 706.A N GLY 703.A O no hydrogen 3.182 N/A TYR 707.A N GLY 703.A O no hydrogen 2.926 N/A ALA 708.A N LEU 704.A O no hydrogen 2.911 N/A LEU 710.A N HIS 706.A O no hydrogen 2.948 N/A GLY 711.A N TYR 707.A O no hydrogen 3.162 N/A ARG 712.A NE ALA 709.A O no hydrogen 3.106 N/A ASP 713.A N ALA 708.A O no hydrogen 3.386 N/A ALA 717.A N ASP 713.A O no hydrogen 3.334 N/A SER 719.A OG GLY 716.A O no hydrogen 2.843 N/A ASN 721.A N ALA 718.A O no hydrogen 3.441 N/A ASN 721.A ND2 GLN 729.A O no hydrogen 3.077 N/A LEU 722.A N ALA 717.A O no hydrogen 2.937 N/A SER 725.A OG PRO 724.A O no hydrogen 2.757 N/A GLN 729.A N ASN 721.A OD1 no hydrogen 3.046 N/A TYR 732.A N ASP 730.A OD1 no hydrogen 3.103 N/A VAL 735.A N VAL 731.A O no hydrogen 2.950 N/A ALA 736.A N TYR 732.A O no hydrogen 2.911 N/A ALA 737.A N SER 733.A O no hydrogen 2.894 N/A GLN 738.A N GLY 734.A O no hydrogen 2.949 N/A VAL 739.A N VAL 735.A O no hydrogen 2.949 N/A GLU 740.A N ALA 736.A O no hydrogen 2.885 N/A VAL 741.A N ALA 737.A O no hydrogen 2.923 N/A PHE 742.A N GLN 738.A O no hydrogen 2.981 N/A ARG 743.A N VAL 739.A O no hydrogen 2.911 N/A ARG 743.A NH1 ALA 754.A O no hydrogen 2.344 N/A ARG 744.A N GLU 740.A O no hydrogen 2.858 N/A ARG 744.A NH1 ARG 744.A O no hydrogen 3.515 N/A GLN 745.A N VAL 741.A O no hydrogen 2.972 N/A ASP 746.A N PHE 742.A O no hydrogen 2.947 N/A ALA 747.A N ARG 743.A O no hydrogen 2.923 N/A ARG 749.A N ASP 746.A O no hydrogen 3.376 N/A PHE 760.A N LEU 757.A O no hydrogen 3.288 N/A THR 769.A OG1 GLN 785.A OE1 no hydrogen 3.407 N/A VAL 770.A N VAL 766.A O no hydrogen 2.940 N/A MET 771.A N LYS 767.A O no hydrogen 2.928 N/A THR 772.A N GLN 768.A O no hydrogen 3.187 N/A THR 772.A N THR 769.A O no hydrogen 3.256 N/A THR 772.A OG1 GLN 768.A O no hydrogen 2.547 N/A THR 772.A OG1 THR 769.A O no hydrogen 2.912 N/A ARG 783.A N ARG 779.A O no hydrogen 2.938 N/A ARG 783.A NH1 GLU 787.A OE2 no hydrogen 2.724 N/A LEU 784.A N TYR 780.A O no hydrogen 2.994 N/A GLN 785.A N GLY 781.A O no hydrogen 2.918 N/A ILE 786.A N GLY 782.A O no hydrogen 2.952 N/A GLU 787.A N ARG 783.A O no hydrogen 2.883 N/A LYS 788.A N LEU 784.A O no hydrogen 2.998 N/A ARG 789.A N GLN 785.A O no hydrogen 3.381 N/A LEU 790.A N ILE 786.A O no hydrogen 2.925 N/A ARG 791.A N GLU 787.A O no hydrogen 2.885 N/A GLU 792.A N LYS 788.A O no hydrogen 2.975 N/A LEU 793.A N ARG 789.A O no hydrogen 3.130 N/A ALA 804.A N PHE 800.A O no hydrogen 3.350 N/A SER 805.A N VAL 801.A O no hydrogen 2.881 N/A SER 805.A OG VAL 801.A O no hydrogen 2.341 N/A HIS 806.A N TRP 802.A O no hydrogen 3.003 N/A TYR 807.A N GLU 803.A O no hydrogen 2.935 N/A TYR 807.A OH ASP 746.A OD2 no hydrogen 3.004 N/A LEU 808.A N ALA 804.A O no hydrogen 2.912 N/A VAL 809.A N SER 805.A O no hydrogen 2.967 N/A ARG 810.A N HIS 806.A O no hydrogen 2.971 N/A GLN 811.A N TYR 807.A O no hydrogen 2.936 N/A VAL 812.A N LEU 808.A O no hydrogen 2.908 N/A PHE 813.A N VAL 809.A O no hydrogen 2.995 N/A LYS 814.A N ARG 810.A O no hydrogen 2.940 N/A SER 815.A N GLN 811.A O no hydrogen 2.875 N/A SER 815.A OG GLN 811.A O no hydrogen 2.751 N/A LEU 816.A N VAL 812.A O no hydrogen 2.934 N/A PHE 820.A N LEU 816.A O no hydrogen 2.949 N/A SER 821.A OG GLN 817.A O no hydrogen 2.809 N/A ALA 825.A N SER 821.A O no hydrogen 2.962 N/A ILE 826.A N GLY 822.A O no hydrogen 2.925 N/A GLN 827.A N THR 823.A O no hydrogen 2.923 N/A GLN 827.A NE2 VAL 773.A O no hydrogen 3.676 N/A HIS 828.A N ARG 824.A O no hydrogen 2.917 N/A TRP 829.A N ALA 825.A O no hydrogen 2.956 N/A TRP 829.A NE1 THR 962.A O no hydrogen 3.097 N/A LEU 830.A N ILE 826.A O no hydrogen 2.925 N/A THR 831.A N GLN 827.A O no hydrogen 2.945 N/A THR 831.A OG1 GLN 827.A O no hydrogen 3.144 N/A GLU 832.A N HIS 828.A O no hydrogen 2.913 N/A SER 833.A N TRP 829.A O no hydrogen 2.984 N/A SER 833.A OG TRP 829.A O no hydrogen 2.907 N/A ALA 834.A N LEU 830.A O no hydrogen 2.930 N/A ARG 835.A N THR 831.A O no hydrogen 2.915 N/A LEU 836.A N GLU 832.A O no hydrogen 2.979 N/A ILE 837.A N SER 833.A O no hydrogen 2.978 N/A SER 838.A N ALA 834.A O no hydrogen 2.902 N/A SER 838.A OG ALA 834.A O no hydrogen 2.596 N/A HIS 839.A N ARG 835.A O no hydrogen 2.923 N/A MET 840.A N LEU 836.A O no hydrogen 2.980 N/A GLY 841.A N SER 838.A O no hydrogen 3.129 N/A SER 842.A N ILE 837.A O no hydrogen 3.203 N/A VAL 844.A N GLN 870.A OE1 no hydrogen 3.513 N/A TRP 846.A N VAL 854.A O no hydrogen 3.361 N/A THR 848.A N VAL 852.A O no hydrogen 3.045 N/A THR 848.A OG1 VAL 852.A O no hydrogen 2.996 N/A GLY 851.A N THR 848.A O no hydrogen 3.051 N/A VAL 852.A N THR 848.A OG1 no hydrogen 2.728 N/A VAL 854.A N TRP 846.A O no hydrogen 3.090 N/A GLN 856.A NE2 GLN 870.A OE1 no hydrogen 2.346 N/A LEU 860.A N LYS 864.A O no hydrogen 2.893 N/A GLN 870.A N ASN 866.A O no hydrogen 3.414 N/A GLN 870.A NE2 TYR 858.A O no hydrogen 3.181 N/A LYS 871.A N THR 867.A O no hydrogen 2.954 N/A ASN 872.A N ARG 868.A O no hydrogen 2.913 N/A GLY 873.A N LYS 869.A O no hydrogen 2.884 N/A GLY 873.A N GLN 870.A O no hydrogen 3.234 N/A PHE 874.A N GLN 870.A O no hydrogen 3.023 N/A ASN 877.A N GLY 873.A O no hydrogen 3.229 N/A ASN 877.A ND2 GLN 856.A OE1 no hydrogen 3.132 N/A PHE 878.A N PHE 874.A O no hydrogen 3.052 N/A PHE 878.A N PRO 875.A O no hydrogen 3.329 N/A SER 881.A OG PHE 878.A O no hydrogen 2.448 N/A LEU 882.A N PHE 878.A O no hydrogen 3.202 N/A ASP 883.A N ILE 879.A O no hydrogen 2.718 N/A SER 884.A N HIS 880.A O no hydrogen 3.040 N/A SER 884.A OG GLY 580.A O no hydrogen 3.172 N/A SER 885.A N SER 881.A O no hydrogen 3.253 N/A SER 885.A OG SER 881.A O no hydrogen 2.851 N/A HIS 886.A N LEU 882.A O no hydrogen 3.303 N/A HIS 886.A NE2 CYS 922.A O no hydrogen 2.748 N/A MET 887.A N ASP 883.A O no hydrogen 3.289 N/A MET 888.A N SER 884.A O no hydrogen 2.827 N/A LEU 889.A N SER 885.A O no hydrogen 2.873 N/A THR 890.A N HIS 886.A O no hydrogen 2.945 N/A THR 890.A OG1 HIS 886.A O no hydrogen 2.572 N/A ALA 891.A N MET 887.A O no hydrogen 2.972 N/A HIS 893.A N LEU 889.A O no hydrogen 3.027 N/A HIS 893.A NE2 ASP 159.A OD2 no hydrogen 2.467 N/A CYS 894.A N THR 890.A O no hydrogen 2.902 N/A CYS 894.A SG THR 890.A O no hydrogen 3.283 N/A TYR 895.A N ALA 891.A O no hydrogen 2.978 N/A GLY 898.A N TYR 895.A O no hydrogen 3.190 N/A VAL 902.A N TRP 909.A O no hydrogen 3.362 N/A CYS 907.A N VAL 904.A O no hydrogen 2.670 N/A CYS 907.A SG GLN 697.A O no hydrogen 3.515 N/A TYR 908.A N GLN 697.A O no hydrogen 2.654 N/A TRP 909.A N VAL 902.A O no hydrogen 2.934 N/A THR 910.A N VAL 695.A O no hydrogen 3.180 N/A THR 910.A OG1 THR 900.A O no hydrogen 3.080 N/A MET 918.A N ASP 914.A O no hydrogen 2.985 N/A ASN 919.A N VAL 915.A O no hydrogen 2.915 N/A GLN 920.A N SER 916.A O no hydrogen 2.989 N/A VAL 921.A N VAL 917.A O no hydrogen 2.978 N/A CYS 922.A N MET 918.A O no hydrogen 2.917 N/A ARG 923.A N ASN 919.A O no hydrogen 3.002 N/A ARG 923.A NE SER 980.A O no hydrogen 2.848 N/A ARG 923.A NH1 ASN 919.A O no hydrogen 3.533 N/A ARG 923.A NH2 SER 980.A O no hydrogen 3.142 N/A GLU 924.A N GLN 920.A O no hydrogen 2.974 N/A GLN 925.A N VAL 921.A O no hydrogen 2.941 N/A PHE 926.A N CYS 922.A O no hydrogen 2.953 N/A VAL 927.A N ARG 923.A O no hydrogen 3.016 N/A ARG 928.A N GLU 924.A O no hydrogen 2.940 N/A ARG 928.A NH1 ASP 159.A OD2 no hydrogen 2.871 N/A LEU 929.A N GLN 925.A O no hydrogen 2.867 N/A HIS 930.A N PHE 926.A O no hydrogen 3.008 N/A SER 931.A N VAL 927.A O no hydrogen 3.075 N/A SER 931.A OG VAL 927.A O no hydrogen 2.540 N/A LEU 938.A N ILE 934.A O no hydrogen 2.936 N/A SER 939.A N LEU 935.A O no hydrogen 2.901 N/A SER 939.A OG LEU 935.A O no hydrogen 2.873 N/A ARG 940.A N GLN 936.A O no hydrogen 2.912 N/A ARG 940.A NE ASP 937.A OD1 no hydrogen 3.368 N/A ARG 940.A NH2 ASP 937.A OD1 no hydrogen 2.493 N/A PHE 941.A N ASP 937.A O no hydrogen 2.912 N/A LEU 942.A N LEU 938.A O no hydrogen 2.937 N/A VAL 943.A N SER 939.A O no hydrogen 2.900 N/A LYS 944.A N ARG 940.A O no hydrogen 2.926 N/A ARG 945.A N PHE 941.A O no hydrogen 2.861 N/A PHE 946.A N LEU 942.A O no hydrogen 2.914 N/A CYS 947.A SG ALA 956.A O no hydrogen 3.216 N/A SER 948.A OG LYS 944.A O no hydrogen 2.951 N/A SER 948.A OG SER 948.A O no hydrogen 2.468 N/A GLU 955.A N GLU 955.A OE1 no hydrogen 2.739 N/A ALA 956.A N LYS 952.A O no hydrogen 3.243 N/A SER 957.A N ILE 953.A O no hydrogen 2.920 N/A LYS 960.A N ALA 956.A O no hydrogen 2.945 N/A GLU 961.A N SER 957.A O no hydrogen 2.935 N/A THR 962.A N GLN 958.A O no hydrogen 2.920 N/A THR 962.A OG1 GLN 958.A O no hydrogen 2.912 N/A LEU 963.A N LEU 959.A O no hydrogen 2.898 N/A ALA 965.A N THR 962.A O no hydrogen 3.287 N/A GLY 970.A N GLY 711.A O no hydrogen 3.140 N/A GLU 975.A N ASP 973.A OD1 no hydrogen 3.298 N/A VAL 977.A N LEU 974.A O no hydrogen 3.399 N/A ARG 979.A N GLN 976.A O no hydrogen 3.398 N/A SER 980.A N VAL 977.A O no hydrogen 3.025 N/A SER 980.A OG VAL 977.A O no hydrogen 2.529 N/A TYR 982.A OH ASP 726.A O no hydrogen 3.102 N/A