Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6cnc_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 2.A N GLU 2.A OE1 no hydrogen 2.609 N/A ALA 6.A N ASN 4.A OD1 no hydrogen 3.147 N/A ASP 8.A N ASN 4.A O no hydrogen 2.684 N/A TRP 10.A N GLN 7.A O no hydrogen 2.796 N/A HIS 11.A N ASP 8.A O no hydrogen 2.939 N/A LEU 12.A N LYS 9.A O no hydrogen 3.013 N/A LEU 13.A N TRP 10.A O no hydrogen 3.322 N/A PHE 16.A N LEU 12.A O no hydrogen 2.901 N/A LEU 17.A N LEU 13.A O no hydrogen 2.610 N/A LYS 18.A N PRO 14.A O no hydrogen 2.354 N/A VAL 19.A N ALA 15.A O no hydrogen 3.108 N/A LYS 20.A N PHE 16.A O no hydrogen 3.204 N/A GLN 25.A N GLN 25.A OE1 no hydrogen 2.634 N/A GLN 25.A NE2 LEU 22.A O no hydrogen 3.672 N/A GLN 25.A NE2 THR 483.A O no hydrogen 3.587 N/A ASP 28.A N LYS 24.A O no hydrogen 2.425 N/A SER 29.A OG GLN 25.A O no hydrogen 3.489 N/A ASN 31.A N LEU 27.A O no hydrogen 2.881 N/A TYR 32.A N ASP 28.A O no hydrogen 2.834 N/A PHE 33.A N SER 29.A O no hydrogen 2.917 N/A VAL 34.A N PHE 30.A O no hydrogen 3.010 N/A ASP 35.A N ASN 31.A O no hydrogen 2.945 N/A THR 36.A N TYR 32.A O no hydrogen 2.927 N/A LEU 38.A N PHE 33.A O no hydrogen 3.425 N/A LYS 40.A N THR 36.A O no hydrogen 3.105 N/A ILE 41.A N ASP 37.A O no hydrogen 2.662 N/A LYS 43.A N LYS 39.A O no hydrogen 3.290 N/A ALA 44.A N LYS 40.A O no hydrogen 2.862 N/A ALA 44.A N ILE 41.A O no hydrogen 3.006 N/A ASN 45.A N ILE 41.A O no hydrogen 3.172 N/A ILE 48.A N LEU 58.A O no hydrogen 3.418 N/A SER 50.A OG LYS 365.A O no hydrogen 2.934 N/A SER 50.A OG ASP 369.A OD1 no hydrogen 3.338 N/A SER 50.A OG ASP 369.A OD2 no hydrogen 3.502 N/A TYR 57.A N THR 101.A OG1 no hydrogen 2.397 N/A LYS 59.A N GLU 99.A O no hydrogen 2.533 N/A TYR 60.A N GLN 46.A O no hydrogen 2.883 N/A VAL 61.A N ASP 97.A O no hydrogen 2.926 N/A ARG 64.A N TYR 95.A O no hydrogen 3.027 N/A ARG 64.A NE LYS 67.A O no hydrogen 2.502 N/A ARG 64.A NH2 LYS 67.A O no hydrogen 3.210 N/A GLY 66.A N PRO 93.A O no hydrogen 3.146 N/A LYS 67.A NZ SER 71.A O no hydrogen 2.263 N/A SER 71.A OG THR 73.A O no hydrogen 2.522 N/A LYS 74.A NZ TYR 76.A O no hydrogen 2.607 N/A CYS 83.A N PRO 79.A O no hydrogen 2.866 N/A ARG 84.A N HIS 81.A O no hydrogen 2.821 N/A LEU 85.A N GLU 82.A O no hydrogen 3.159 N/A ARG 86.A NE VAL 853.A O no hydrogen 2.895 N/A ARG 86.A NH1 GLU 82.A OE2 no hydrogen 3.450 N/A ARG 86.A NH2 VAL 853.A O no hydrogen 2.950 N/A THR 89.A OG1 ILE 151.A O no hydrogen 3.470 N/A THR 89.A OG1 ASN 399.A OD1 no hydrogen 3.157 N/A TYR 90.A N ILE 151.A O no hydrogen 3.170 N/A SER 91.A OG ALA 92.A O no hydrogen 3.261 N/A SER 91.A OG MET 117.A O no hydrogen 2.834 N/A ALA 92.A N MET 117.A O no hydrogen 3.092 N/A ILE 94.A N GLY 115.A O no hydrogen 2.591 N/A TYR 95.A N ARG 64.A O no hydrogen 2.782 N/A VAL 96.A N VAL 112.A O no hydrogen 2.766 N/A TYR 100.A N MET 108.A O no hydrogen 3.257 N/A THR 101.A OG1 TYR 57.A O no hydrogen 2.993 N/A VAL 112.A N VAL 96.A O no hydrogen 2.948 N/A GLU 113.A N GLU 113.A OE1 no hydrogen 2.629 N/A ARG 116.A N THR 395.A OG1 no hydrogen 2.411 N/A SER 123.A N MET 120.A O no hydrogen 3.197 N/A SER 123.A OG MET 120.A O no hydrogen 3.055 N/A ASN 124.A N ASN 31.A OD1 no hydrogen 2.783 N/A LYS 125.A N SER 123.A OG no hydrogen 2.913 N/A CYS 126.A N SER 123.A OG no hydrogen 3.108 N/A CYS 126.A SG TYR 90.A OH no hydrogen 2.651 N/A TYR 129.A N CYS 126.A O no hydrogen 3.397 N/A SER 134.A N ASP 132.A O no hydrogen 2.215 N/A SER 134.A OG ASP 132.A O no hydrogen 2.875 N/A LYS 135.A N SER 134.A OG no hydrogen 2.717 N/A LYS 138.A N SER 134.A O no hydrogen 2.877 N/A LEU 139.A N LYS 135.A O no hydrogen 2.893 N/A ASN 140.A N ALA 137.A O no hydrogen 2.684 N/A GLU 141.A N MET 136.A O no hydrogen 3.354 N/A GLY 147.A N ASP 145.A OD1 no hydrogen 3.334 N/A GLY 148.A N LEU 121.A O no hydrogen 3.238 N/A TYR 149.A OH ASP 145.A OD2 no hydrogen 2.293 N/A VAL 152.A N THR 155.A O no hydrogen 2.789 N/A LYS 157.A NZ SER 403.A O no hydrogen 2.219 N/A GLN 162.A NE2 GLN 441.A OE1 no hydrogen 2.215 N/A GLU 163.A N SER 439.A O no hydrogen 2.912 N/A GLN 164.A N ARG 341.A O no hydrogen 3.131 N/A ASN 168.A N VAL 185.A O no hydrogen 2.455 N/A ARG 169.A NH2 ASN 523.A OD1 no hydrogen 3.466 N/A ILE 171.A N ALA 183.A O no hydrogen 2.918 N/A GLU 173.A N VAL 181.A O no hydrogen 2.880 N/A GLN 182.A N TYR 197.A O no hydrogen 2.868 N/A ALA 183.A N ILE 171.A O no hydrogen 2.896 N/A SER 184.A N LYS 195.A O no hydrogen 3.456 N/A SER 184.A OG ARG 169.A O no hydrogen 2.920 N/A THR 186.A N LYS 193.A O no hydrogen 3.235 N/A THR 186.A OG1 THR 301.A OG1 no hydrogen 2.271 N/A THR 189.A OG1 SER 188.A O no hydrogen 2.421 N/A LYS 193.A NZ ILE 297.A O no hydrogen 2.771 N/A LYS 195.A NZ LYS 195.A O no hydrogen 3.481 N/A THR 196.A OG1 LYS 208.A O no hydrogen 2.912 N/A TYR 197.A N GLN 182.A O no hydrogen 2.934 N/A VAL 198.A N TYR 206.A O no hydrogen 2.923 N/A THR 200.A N LYS 204.A O no hydrogen 2.785 N/A LYS 204.A N LYS 201.A O no hydrogen 3.149 N/A LYS 204.A NZ TYR 206.A OH no hydrogen 3.478 N/A TYR 206.A N VAL 198.A O no hydrogen 2.750 N/A LEU 207.A N ILE 216.A O no hydrogen 3.253 N/A ILE 218.A N ILE 205.A O no hydrogen 3.220 N/A ALA 219.A N ASN 251.A OD1 no hydrogen 3.494 N/A VAL 221.A N PRO 217.A O no hydrogen 3.392 N/A LEU 222.A N ILE 218.A O no hydrogen 2.869 N/A LYS 223.A N ALA 219.A O no hydrogen 2.851 N/A LYS 223.A NZ ASP 230.A OD2 no hydrogen 3.164 N/A ALA 224.A N ILE 220.A O no hydrogen 2.927 N/A CYS 225.A N VAL 221.A O no hydrogen 2.846 N/A CYS 225.A SG VAL 221.A O no hydrogen 3.176 N/A GLY 226.A N LYS 223.A O no hydrogen 2.404 N/A LEU 231.A N SER 229.A O no hydrogen 2.571 N/A LEU 236.A N GLU 232.A O no hydrogen 2.890 N/A LEU 236.A N ILE 233.A O no hydrogen 2.764 N/A VAL 237.A N ILE 233.A O no hydrogen 2.734 N/A GLY 239.A N MET 234.A O no hydrogen 2.890 N/A ILE 247.A N ASP 246.A OD1 no hydrogen 2.559 N/A PHE 248.A N TYR 244.A O no hydrogen 3.208 N/A ALA 249.A N GLN 245.A O no hydrogen 3.194 N/A ALA 249.A N ASP 246.A O no hydrogen 2.931 N/A ASN 251.A N PHE 248.A O no hydrogen 3.284 N/A GLU 253.A N ALA 249.A O no hydrogen 2.892 N/A GLU 254.A N VAL 250.A O no hydrogen 3.366 N/A SER 255.A N ASN 251.A O no hydrogen 3.308 N/A SER 256.A N GLU 253.A O no hydrogen 2.890 N/A SER 256.A OG GLU 253.A O no hydrogen 3.140 N/A GLN 264.A N TYR 261.A O no hydrogen 3.384 N/A GLN 265.A N GLN 265.A OE1 no hydrogen 2.616 N/A LEU 267.A N THR 262.A O no hydrogen 3.099 N/A LEU 267.A N THR 262.A OG1 no hydrogen 2.624 N/A GLU 268.A N GLN 264.A O no hydrogen 2.790 N/A TYR 269.A N GLN 265.A O no hydrogen 2.368 N/A ILE 270.A N ALA 266.A O no hydrogen 2.917 N/A GLY 271.A N LEU 267.A O no hydrogen 3.471 N/A ALA 272.A N GLU 268.A O no hydrogen 2.834 N/A LYS 273.A N ILE 270.A O no hydrogen 3.029 N/A LYS 273.A NZ GLU 214.A O no hydrogen 2.729 N/A LYS 275.A NZ THR 276.A O no hydrogen 3.103 N/A LEU 285.A N LEU 282.A O no hydrogen 2.764 N/A GLN 286.A NE2 THR 283.A O no hydrogen 3.476 N/A GLU 287.A N GLU 287.A OE1 no hydrogen 2.483 N/A ALA 291.A N GLY 288.A O no hydrogen 3.153 N/A THR 294.A N GLU 290.A O no hydrogen 2.950 N/A THR 295.A N ALA 291.A O no hydrogen 2.896 N/A THR 295.A OG1 ALA 291.A O no hydrogen 2.809 N/A THR 295.A OG1 ILE 292.A O no hydrogen 2.414 N/A VAL 296.A N ILE 292.A O no hydrogen 2.343 N/A THR 301.A OG1 THR 186.A OG1 no hydrogen 2.271 N/A ALA 304.A N GLU 303.A OE1 no hydrogen 2.496 N/A ARG 308.A NE ILE 506.A O no hydrogen 3.231 N/A LYS 310.A NZ THR 295.A O no hydrogen 3.057 N/A ALA 311.A N PHE 307.A O no hydrogen 3.059 N/A LEU 312.A N ARG 308.A O no hydrogen 2.903 N/A TYR 313.A N GLU 309.A O no hydrogen 2.903 N/A ILE 314.A N LYS 310.A O no hydrogen 2.910 N/A ALA 315.A N ALA 311.A O no hydrogen 2.884 N/A MET 316.A N LEU 312.A O no hydrogen 2.877 N/A MET 317.A N TYR 313.A O no hydrogen 2.913 N/A THR 318.A N ILE 314.A O no hydrogen 2.885 N/A THR 318.A OG1 ILE 314.A O no hydrogen 2.908 N/A ARG 319.A N ALA 315.A O no hydrogen 2.917 N/A ARG 320.A NE GLN 561.A OE1 no hydrogen 3.167 N/A VAL 322.A N THR 318.A O no hydrogen 3.368 N/A MET 323.A N ARG 319.A O no hydrogen 2.904 N/A ALA 324.A N ARG 320.A O no hydrogen 2.939 N/A MET 325.A N VAL 321.A O no hydrogen 2.870 N/A TYR 326.A N VAL 322.A O no hydrogen 2.894 N/A TYR 326.A N MET 323.A O no hydrogen 3.042 N/A ASN 327.A N MET 323.A O no hydrogen 3.159 N/A ASN 339.A N TYR 336.A O no hydrogen 2.994 N/A LYS 340.A N VAL 337.A O no hydrogen 2.641 N/A ARG 341.A N GLN 164.A O no hydrogen 3.277 N/A ARG 341.A NH1 SER 166.A OG no hydrogen 2.334 N/A GLU 343.A N GLN 162.A O no hydrogen 3.485 N/A GLN 347.A N GLN 347.A OE1 no hydrogen 2.853 N/A LEU 348.A N LEU 344.A O no hydrogen 3.390 N/A ILE 349.A N ALA 345.A O no hydrogen 2.923 N/A SER 350.A N GLY 346.A O no hydrogen 3.046 N/A SER 350.A OG GLN 347.A O no hydrogen 2.515 N/A LEU 351.A N GLN 347.A O no hydrogen 2.946 N/A LEU 352.A N ILE 349.A O no hydrogen 2.574 N/A PHE 353.A N ILE 349.A O no hydrogen 2.828 N/A GLU 354.A N SER 350.A O no hydrogen 2.915 N/A LEU 356.A N LEU 352.A O no hydrogen 3.011 N/A PHE 357.A N PHE 353.A O no hydrogen 2.812 N/A LYS 358.A N GLU 354.A O no hydrogen 2.881 N/A LYS 358.A NZ ASN 362.A OD1 no hydrogen 2.824 N/A LYS 359.A N ASP 355.A O no hydrogen 2.862 N/A PHE 360.A N LEU 356.A O no hydrogen 2.858 N/A ASN 361.A N PHE 357.A O no hydrogen 2.922 N/A ASN 361.A ND2 TYR 60.A OH no hydrogen 2.743 N/A ASN 362.A N LYS 358.A O no hydrogen 2.893 N/A ASP 363.A N LYS 359.A O no hydrogen 2.869 N/A PHE 364.A N PHE 360.A O no hydrogen 2.934 N/A LYS 365.A N ASN 361.A O no hydrogen 2.807 N/A SER 367.A N ASP 363.A O no hydrogen 2.942 N/A ILE 368.A N PHE 364.A O no hydrogen 2.884 N/A ASP 369.A N LEU 366.A O no hydrogen 2.831 N/A LEU 372.A N ASP 369.A O no hydrogen 2.295 N/A LYS 373.A N ASP 369.A O no hydrogen 2.878 N/A ARG 377.A NE TYR 381.A OH no hydrogen 2.750 N/A ALA 383.A N TYR 381.A O no hydrogen 2.693 N/A LEU 385.A N ASP 382.A OD1 no hydrogen 3.412 N/A ILE 387.A N LEU 384.A O no hydrogen 2.566 N/A HIS 390.A N ILE 387.A O no hydrogen 2.822 N/A SER 391.A N ASN 388.A O no hydrogen 3.159 N/A SER 391.A OG ASN 388.A O no hydrogen 2.806 N/A ASN 393.A ND2 HIS 390.A O no hydrogen 3.133 N/A THR 395.A OG1 ARG 116.A O no hydrogen 3.234 N/A GLY 397.A N ASN 392.A O no hydrogen 3.163 N/A LEU 398.A N THR 395.A O no hydrogen 2.681 N/A ASN 399.A N THR 395.A O no hydrogen 2.740 N/A ASN 399.A ND2 THR 395.A O no hydrogen 2.952 N/A ARG 400.A N SER 396.A O no hydrogen 2.916 N/A ALA 401.A N GLY 397.A O no hydrogen 3.323 N/A ILE 402.A N LEU 398.A O no hydrogen 2.915 N/A SER 403.A N ASN 399.A O no hydrogen 2.877 N/A SER 403.A OG ASN 399.A O no hydrogen 3.158 N/A SER 403.A OG ARG 400.A O no hydrogen 2.976 N/A THR 404.A N ARG 400.A O no hydrogen 2.929 N/A THR 404.A OG1 ARG 400.A O no hydrogen 3.290 N/A GLY 405.A N ALA 401.A O no hydrogen 2.662 N/A TRP 407.A N ARG 416.A O no hydrogen 3.100 N/A LYS 413.A N LYS 410.A O no hydrogen 2.938 N/A VAL 419.A N GLY 405.A O no hydrogen 3.495 N/A THR 420.A OG1 ILE 402.A O no hydrogen 3.550 N/A ARG 425.A NH2 ASP 145.A OD1 no hydrogen 3.247 N/A ARG 425.A NH2 ASP 145.A OD2 no hydrogen 3.288 N/A SER 427.A OG LYS 672.A O no hydrogen 3.429 N/A TYR 428.A OH ILE 709.A O no hydrogen 3.020 N/A SER 430.A N SER 427.A OG no hydrogen 3.292 N/A SER 430.A OG SER 424.A O no hydrogen 2.602 N/A GLY 433.A N SER 430.A O no hydrogen 2.566 N/A MET 434.A N SER 430.A O no hydrogen 3.038 N/A ILE 438.A N LYS 477.A O no hydrogen 2.862 N/A SER 439.A N VAL 161.A O no hydrogen 2.937 N/A SER 440.A N LEU 475.A O no hydrogen 2.918 N/A ARG 452.A NH1 LYS 447.A O no hydrogen 2.921 N/A GLN 455.A N GLN 455.A OE1 no hydrogen 2.448 N/A GLN 458.A N GLN 455.A O no hydrogen 3.227 N/A LEU 462.A N GLN 458.A O no hydrogen 3.409 N/A CYS 463.A N ASN 478.A O no hydrogen 2.843 N/A CYS 463.A SG ASP 466.A OD1 no hydrogen 3.036 N/A THR 467.A OG1 ASP 466.A O no hydrogen 2.706 N/A GLU 471.A N GLU 469.A O no hydrogen 2.769 N/A LYS 477.A N ILE 438.A O no hydrogen 2.913 N/A ASN 478.A ND2 ASP 466.A OD1 no hydrogen 3.403 N/A LEU 479.A N THR 436.A O no hydrogen 3.390 N/A THR 486.A N ARG 572.A O no hydrogen 2.515 N/A THR 486.A OG1 ARG 572.A O no hydrogen 3.178 N/A THR 487.A OG1 ASP 488.A O no hydrogen 3.420 N/A LYS 495.A N GLU 491.A O no hydrogen 3.162 N/A LYS 495.A NZ TYR 499.A OH no hydrogen 2.840 N/A LYS 496.A N GLU 492.A O no hydrogen 2.925 N/A LEU 497.A N PRO 493.A O no hydrogen 2.905 N/A CYS 498.A N ILE 494.A O no hydrogen 2.906 N/A TYR 499.A N LYS 495.A O no hydrogen 3.047 N/A VAL 500.A N LYS 496.A O no hydrogen 2.902 N/A LEU 501.A N LEU 497.A O no hydrogen 2.921 N/A GLY 502.A N TYR 499.A O no hydrogen 2.920 N/A VAL 503.A N CYS 498.A O no hydrogen 3.490 N/A ILE 509.A N ASP 505.A O no hydrogen 3.256 N/A SER 511.A OG ASP 510.A OD1 no hydrogen 3.369 N/A SER 511.A OG ASP 510.A OD2 no hydrogen 3.295 N/A SER 513.A OG SER 511.A O no hydrogen 3.376 N/A ASN 517.A ND2 ILE 530.A O no hydrogen 2.496 N/A TYR 521.A N VAL 564.A O no hydrogen 2.911 N/A LEU 522.A N THR 525.A O no hydrogen 2.601 N/A ASN 523.A N ILE 566.A O no hydrogen 2.770 N/A ILE 527.A N VAL 520.A O no hydrogen 3.161 N/A SER 529.A OG GLU 504.A OE2 no hydrogen 3.413 N/A SER 529.A OG GLY 528.A O no hydrogen 2.600 N/A SER 529.A OG SER 529.A O no hydrogen 2.568 N/A PHE 536.A N PHE 532.A O no hydrogen 3.353 N/A VAL 537.A N PRO 533.A O no hydrogen 3.011 N/A THR 538.A N THR 534.A O no hydrogen 2.918 N/A THR 538.A OG1 THR 534.A O no hydrogen 3.458 N/A GLN 539.A N LYS 535.A O no hydrogen 2.915 N/A PHE 540.A N PHE 536.A O no hydrogen 2.903 N/A ARG 541.A N VAL 537.A O no hydrogen 2.812 N/A ARG 541.A NH2 ILE 555.A O no hydrogen 2.786 N/A HIS 542.A N THR 538.A O no hydrogen 2.926 N/A LEU 543.A N GLN 539.A O no hydrogen 3.096 N/A LEU 543.A N PHE 540.A O no hydrogen 2.635 N/A ARG 544.A N PHE 540.A O no hydrogen 2.937 N/A ARG 545.A N ARG 541.A O no hydrogen 3.173 N/A ARG 545.A NH2 GLY 609.A O no hydrogen 2.595 N/A THR 546.A N LEU 543.A O no hydrogen 2.878 N/A THR 546.A OG1 HIS 542.A O no hydrogen 3.246 N/A SER 557.A N ASP 621.A OD2 no hydrogen 2.289 N/A ASN 558.A N ALA 563.A O no hydrogen 3.292 N/A VAL 564.A N GLY 519.A O no hydrogen 2.829 N/A ILE 566.A N TYR 521.A O no hydrogen 2.492 N/A THR 568.A N ASN 523.A OD1 no hydrogen 2.651 N/A THR 568.A OG1 GLU 490.A O no hydrogen 3.145 N/A GLY 571.A N THR 486.A O no hydrogen 2.318 N/A ARG 572.A N THR 486.A O no hydrogen 3.360 N/A ARG 572.A NE ASP 615.A OD1 no hydrogen 3.341 N/A ARG 572.A NE ASP 615.A OD2 no hydrogen 2.986 N/A CYS 574.A SG THR 486.A OG1 no hydrogen 2.789 N/A CYS 574.A SG ARG 572.A O no hydrogen 4.014 N/A ILE 578.A N LEU 638.A O no hydrogen 2.863 N/A VAL 580.A N THR 636.A O no hydrogen 2.492 N/A ARG 586.A N ILE 579.A O no hydrogen 2.849 N/A ILE 590.A N LYS 588.A O no hydrogen 2.532 N/A LYS 594.A N ILE 590.A O no hydrogen 2.930 N/A LEU 595.A N LEU 592.A O no hydrogen 2.809 N/A LEU 596.A N LEU 592.A O no hydrogen 2.997 N/A GLY 598.A N LEU 595.A O no hydrogen 2.790 N/A GLU 599.A N ASP 597.A OD1 no hydrogen 3.224 N/A LEU 608.A N ASP 604.A O no hydrogen 2.968 N/A GLY 609.A N LEU 606.A O no hydrogen 3.053 N/A LEU 610.A N PHE 605.A O no hydrogen 3.156 N/A GLU 612.A N LEU 577.A O no hydrogen 3.389 N/A LEU 614.A N ARG 575.A O no hydrogen 2.893 N/A GLU 619.A N ASP 615.A O no hydrogen 2.697 N/A ASN 620.A N VAL 616.A O no hydrogen 3.069 N/A ASP 621.A N ASN 617.A O no hydrogen 2.990 N/A SER 622.A N GLU 619.A O no hydrogen 2.815 N/A SER 622.A OG GLU 619.A O no hydrogen 2.614 N/A ALA 625.A N HIS 637.A O no hydrogen 2.668 N/A ASP 630.A N TYR 627.A O no hydrogen 2.715 N/A MET 635.A N VAL 632.A O no hydrogen 2.654 N/A THR 636.A N TYR 623.A O no hydrogen 3.185 N/A HIS 637.A N TYR 623.A O no hydrogen 2.884 N/A LEU 638.A N ILE 578.A O no hydrogen 2.676 N/A GLU 639.A N ALA 625.A O no hydrogen 3.442 N/A ILE 645.A N PRO 642.A O no hydrogen 3.131 N/A LEU 646.A N PHE 643.A O no hydrogen 3.367 N/A GLY 651.A N GLY 647.A O no hydrogen 3.285 N/A GLY 651.A N ALA 648.A O no hydrogen 3.088 N/A LEU 652.A N VAL 649.A O no hydrogen 3.010 N/A ILE 653.A N ALA 650.A O no hydrogen 3.066 N/A TYR 655.A OH SER 928.A OG no hydrogen 3.321 N/A TYR 655.A OH SER 947.A O no hydrogen 3.142 N/A HIS 658.A N TYR 655.A O no hydrogen 3.034 N/A ASN 659.A N PRO 656.A O no hydrogen 3.422 N/A ASN 664.A ND2 PRO 656.A O no hydrogen 3.603 N/A ASN 664.A ND2 GLN 660.A O no hydrogen 3.231 N/A THR 665.A N SER 661.A O no hydrogen 2.935 N/A THR 665.A OG1 ALA 465.A O no hydrogen 3.285 N/A TYR 666.A N PRO 662.A O no hydrogen 2.907 N/A GLN 667.A N ARG 663.A O no hydrogen 2.913 N/A CYS 668.A N ASN 664.A O no hydrogen 2.656 N/A CYS 668.A SG ALA 465.A O no hydrogen 3.675 N/A CYS 668.A SG ASN 664.A O no hydrogen 3.346 N/A ALA 669.A N THR 665.A O no hydrogen 2.909 N/A MET 670.A N TYR 666.A O no hydrogen 2.903 N/A GLY 671.A N GLN 667.A O no hydrogen 2.813 N/A GLN 673.A N MET 670.A O no hydrogen 2.379 N/A ALA 674.A N GLY 671.A O no hydrogen 2.951 N/A ILE 675.A N LYS 991.A O no hydrogen 3.157 N/A GLN 682.A N ALA 679.A O no hydrogen 2.890 N/A THR 688.A N ASP 687.A OD1 no hydrogen 2.489 N/A LEU 690.A N ARG 753.A O no hydrogen 2.917 N/A TYR 691.A OH ASP 998.A OD2 no hydrogen 3.316 N/A THR 694.A N ARG 749.A O no hydrogen 3.056 N/A THR 694.A OG1 ARG 749.A O no hydrogen 2.742 N/A LYS 702.A NZ TYR 940.A OH no hydrogen 3.002 N/A THR 703.A OG1 ILE 653.A O no hydrogen 3.254 N/A THR 703.A OG1 GLY 941.A O no hydrogen 3.176 N/A ILE 706.A N THR 703.A O no hydrogen 2.518 N/A ASP 710.A N GLU 707.A O no hydrogen 3.350 N/A TYR 711.A OH ALA 716.A O no hydrogen 2.656 N/A TYR 711.A OH TYR 988.A OH no hydrogen 2.671 N/A LYS 713.A N ASP 710.A O no hydrogen 3.013 N/A LEU 714.A N TYR 711.A O no hydrogen 3.231 N/A ALA 716.A N TYR 711.A OH no hydrogen 3.005 N/A GLN 718.A N TYR 989.A O no hydrogen 2.845 N/A GLN 718.A NE2 TYR 695.A O no hydrogen 2.585 N/A ASN 719.A N GLN 697.A OE1 no hydrogen 2.537 N/A ASN 719.A ND2 GLN 698.A O no hydrogen 3.367 N/A ALA 720.A N ILE 987.A O no hydrogen 2.827 N/A ALA 723.A N ILE 907.A O no hydrogen 3.338 N/A VAL 724.A N PHE 983.A O no hydrogen 3.221 N/A SER 728.A OG TYR 727.A O no hydrogen 2.517 N/A TYR 730.A N SER 728.A OG no hydrogen 2.529 N/A ASN 739.A ND2 GLN 893.A OE1 no hydrogen 3.273 N/A LYS 740.A N VAL 891.A O no hydrogen 2.713 N/A SER 742.A OG LYS 740.A O no hydrogen 2.899 N/A ILE 743.A N ASN 739.A O no hydrogen 2.906 N/A ARG 745.A N SER 742.A O no hydrogen 2.593 N/A ARG 745.A NE SER 741.A O no hydrogen 2.745 N/A GLY 746.A N ILE 743.A O no hydrogen 3.181 N/A CYS 750.A N ARG 869.A O no hydrogen 2.968 N/A CYS 750.A SG GLY 748.A O no hydrogen 3.487 N/A GLU 751.A N LEU 692.A O no hydrogen 2.943 N/A THR 752.A N GLN 867.A O no hydrogen 2.927 N/A ARG 753.A N LEU 690.A O no hydrogen 2.869 N/A ARG 753.A NH1 ASP 847.A OD2 no hydrogen 2.756 N/A ARG 754.A N LEU 865.A O no hydrogen 2.899 N/A THR 756.A N VAL 863.A O no hydrogen 3.213 N/A THR 758.A N ILE 861.A O no hydrogen 2.946 N/A LYS 761.A N ASP 769.A OD2 no hydrogen 2.695 N/A TYR 763.A N THR 767.A O no hydrogen 2.831 N/A ASN 765.A ND2 ASN 815.A O no hydrogen 3.262 N/A ASN 765.A ND2 SER 816.A O no hydrogen 3.459 N/A HIS 766.A N TYR 763.A O no hydrogen 2.772 N/A THR 767.A N TYR 763.A O no hydrogen 3.433 N/A THR 767.A OG1 ASN 765.A O no hydrogen 2.844 N/A ILE 770.A N SER 811.A O no hydrogen 2.886 N/A MET 774.A N HIS 786.A NE2 no hydrogen 3.020 N/A HIS 786.A N ILE 783.A O no hydrogen 2.904 N/A SER 788.A OG SER 788.A O no hydrogen 2.390 N/A SER 788.A OG GLU 796.A OE2 no hydrogen 3.539 N/A GLY 793.A N GLY 790.A O no hydrogen 3.435 N/A GLU 796.A N GLU 796.A OE1 no hydrogen 2.306 N/A GLY 798.A N ILE 846.A O no hydrogen 2.291 N/A VAL 801.A N SER 844.A O no hydrogen 2.897 N/A SER 803.A OG GLN 802.A O no hydrogen 2.655 N/A GLN 805.A N GLN 802.A O no hydrogen 3.322 N/A SER 811.A N ILE 770.A O no hydrogen 2.740 N/A VAL 812.A N ARG 832.A O no hydrogen 2.922 N/A THR 814.A N GLN 830.A O no hydrogen 3.261 N/A SER 816.A OG PRO 813.A O no hydrogen 3.234 N/A ASP 818.A N ASN 815.A O no hydrogen 3.050 N/A ASN 823.A N ASN 821.A OD1 no hydrogen 2.826 N/A VAL 827.A N ASN 826.A OD1 no hydrogen 2.653 N/A ARG 832.A N VAL 812.A O no hydrogen 2.881 N/A GLU 833.A N GLU 833.A OE1 no hydrogen 2.571 N/A ALA 834.A N LYS 810.A O no hydrogen 3.090 N/A SER 844.A N VAL 801.A O no hydrogen 2.943 N/A HIS 845.A N ARG 866.A O no hydrogen 2.791 N/A GLN 848.A N ASP 847.A OD1 no hydrogen 2.285 N/A MET 850.A N LYS 862.A O no hydrogen 2.810 N/A SER 852.A N LEU 860.A O no hydrogen 2.879 N/A SER 852.A OG MET 851.A O no hydrogen 2.696 N/A SER 854.A OG ASN 856.A OD1 no hydrogen 2.358 N/A ASP 857.A N SER 854.A O no hydrogen 3.247 N/A LEU 860.A N SER 852.A O no hydrogen 2.854 N/A ILE 861.A N THR 758.A O no hydrogen 3.160 N/A LYS 862.A N MET 850.A O no hydrogen 2.990 N/A LYS 862.A NZ LEU 85.A O no hydrogen 2.744 N/A LYS 862.A NZ ASP 87.A OD1 no hydrogen 3.049 N/A LEU 864.A N GLN 848.A O no hydrogen 3.364 N/A LEU 865.A N ARG 754.A O no hydrogen 2.898 N/A ARG 866.A N HIS 845.A O no hydrogen 2.804 N/A GLN 867.A N THR 752.A O no hydrogen 3.377 N/A ARG 869.A NH1 ASP 998.A OD2 no hydrogen 3.049 N/A PHE 877.A N GLY 885.A O no hydrogen 3.003 N/A SER 878.A OG GLN 883.A O no hydrogen 3.059 N/A SER 879.A OG SER 879.A O no hydrogen 2.191 N/A ARG 880.A NH1 VAL 701.A O no hydrogen 3.521 N/A ARG 880.A NH2 LEU 652.A O no hydrogen 3.353 N/A ARG 880.A NH2 VAL 701.A O no hydrogen 2.963 N/A HIS 881.A NE2 ASN 659.A OD1 no hydrogen 2.630 N/A CYS 887.A SG GLU 872.A O no hydrogen 3.606 N/A GLY 888.A N LEU 736.A O no hydrogen 2.355 N/A GLN 893.A NE2 SER 742.A OG no hydrogen 3.155 N/A MET 896.A N TYR 727.A OH no hydrogen 3.195 N/A PHE 898.A N TYR 970.A O no hydrogen 3.373 N/A GLY 902.A N ASN 899.A O no hydrogen 3.083 N/A ASP 906.A N THR 721.A O no hydrogen 2.275 N/A ILE 908.A N VAL 737.A O no hydrogen 3.083 N/A MET 909.A N ALA 723.A O no hydrogen 2.850 N/A HIS 912.A N ASN 910.A OD1 no hydrogen 2.958 N/A PHE 914.A N PRO 911.A O no hydrogen 2.935 N/A ARG 917.A N GLY 913.A O no hydrogen 3.247 N/A MET 918.A N PHE 914.A O no hydrogen 2.525 N/A THR 919.A OG1 ASN 659.A OD1 no hydrogen 2.304 N/A GLY 921.A N ASN 659.A OD1 no hydrogen 3.254 N/A LYS 922.A NZ SER 879.A OG no hydrogen 2.232 N/A LYS 922.A NZ TYR 989.A OH no hydrogen 3.498 N/A ILE 924.A N VAL 920.A O no hydrogen 3.025 N/A GLU 925.A N GLY 921.A O no hydrogen 2.904 N/A LEU 926.A N LYS 922.A O no hydrogen 2.903 N/A SER 928.A N ILE 924.A O no hydrogen 2.934 N/A SER 928.A OG TYR 655.A OH no hydrogen 3.321 N/A SER 928.A OG ILE 924.A O no hydrogen 3.435 N/A GLY 929.A N GLU 925.A O no hydrogen 2.889 N/A LYS 930.A N LEU 926.A O no hydrogen 2.923 N/A LYS 930.A NZ GLY 965.A O no hydrogen 3.079 N/A LYS 930.A NZ PHE 984.A O no hydrogen 3.178 N/A ALA 931.A N ILE 927.A O no hydrogen 2.801 N/A GLY 932.A N SER 928.A O no hydrogen 2.776 N/A VAL 933.A N GLY 929.A O no hydrogen 3.077 N/A LEU 934.A N ALA 931.A O no hydrogen 3.103 N/A ASN 935.A N ALA 931.A O no hydrogen 3.363 N/A GLY 936.A N GLY 932.A O no hydrogen 2.652 N/A THR 937.A OG1 GLU 939.A OE1 no hydrogen 3.475 N/A GLY 941.A N LYS 702.A O no hydrogen 3.105 N/A THR 942.A N GLY 945.A O no hydrogen 3.400 N/A PHE 944.A N HIS 657.A ND1 no hydrogen 2.873 N/A GLY 945.A N THR 942.A O no hydrogen 2.786 N/A SER 947.A N TYR 940.A O no hydrogen 3.000 N/A SER 947.A OG GLU 939.A OE2 no hydrogen 2.633 N/A SER 947.A OG TYR 940.A O no hydrogen 2.836 N/A MET 952.A N LEU 949.A O no hydrogen 3.043 N/A SER 953.A OG GLU 950.A O no hydrogen 3.379 N/A ILE 955.A N MET 952.A O no hydrogen 2.515 N/A LEU 956.A N SER 953.A O no hydrogen 2.534 N/A VAL 957.A N SER 953.A O no hydrogen 2.849 N/A GLN 959.A N LEU 956.A O no hydrogen 2.465 N/A GLN 959.A NE2 LEU 934.A O no hydrogen 3.675 N/A GLY 960.A N VAL 957.A O no hydrogen 2.929 N/A PHE 961.A N LEU 956.A O no hydrogen 3.506 N/A ASN 962.A ND2 LYS 966.A O no hydrogen 3.471 N/A SER 964.A N ASN 962.A OD1 no hydrogen 3.020 N/A ASP 967.A N ILE 982.A O no hydrogen 2.549 N/A TYR 970.A N PHE 898.A O no hydrogen 3.174 N/A THR 974.A N SER 971.A O no hydrogen 3.101 N/A GLY 975.A N SER 971.A O no hydrogen 2.528 N/A LEU 978.A N LEU 969.A O no hydrogen 3.084 N/A ILE 982.A N ASP 967.A O no hydrogen 3.373 N/A ILE 987.A N ALA 720.A O no hydrogen 3.149 N/A TYR 988.A OH GLN 697.A O no hydrogen 3.308 N/A TYR 988.A OH TYR 711.A OH no hydrogen 2.671 N/A TYR 989.A N GLN 718.A O no hydrogen 2.998 N/A GLN 990.A N SER 878.A O no hydrogen 3.114 N/A LEU 992.A N LYS 876.A O no hydrogen 3.128 N/A LYS 993.A N GLN 673.A O no hydrogen 3.171 N/A VAL 996.A N ASP 875.A OD1 no hydrogen 3.351 N/A MET 1000.A N VAL 996.A O no hydrogen 2.907 N/A ARG 1003.A NH1 GLY 1023.A O no hydrogen 2.365 N/A ARG 1003.A NH2 PRO 1007.A O no hydrogen 2.625 N/A ARG 1008.A NH2 SER 1052.A O no hydrogen 3.070 N/A SER 1020.A OG ARG 1019.A O no hydrogen 2.235 N/A ARG 1021.A N SER 1020.A OG no hydrogen 2.560 N/A ARG 1032.A N GLY 1028.A O no hydrogen 2.838 N/A CYS 1034.A N GLU 1031.A O no hydrogen 2.656 N/A ILE 1036.A N ARG 1032.A O no hydrogen 3.449 N/A ALA 1037.A N ASP 1033.A O no hydrogen 2.948 N/A TYR 1038.A N CYS 1034.A O no hydrogen 3.263 N/A GLY 1039.A N ILE 1036.A O no hydrogen 2.579 N/A ALA 1040.A N VAL 1035.A O no hydrogen 3.249 N/A LEU 1045.A N SER 1041.A O no hydrogen 2.871 N/A GLU 1046.A N GLN 1042.A O no hydrogen 2.905 N/A ARG 1047.A N LEU 1044.A O no hydrogen 2.754 N/A LEU 1048.A N LEU 1044.A O no hydrogen 2.915 N/A SER 1051.A OG GLU 1046.A O no hydrogen 2.735 N/A SER 1052.A OG ARG 1047.A O no hydrogen 3.242 N/A VAL 1057.A N MET 1084.A O no hydrogen 2.902 N/A VAL 1059.A N ILE 1082.A O no hydrogen 3.412 N/A CYS 1060.A N LEU 1065.A O no hydrogen 3.258 N/A CYS 1060.A SG LYS 1062.A O no hydrogen 3.117 N/A ASP 1061.A N ASN 1080.A O no hydrogen 3.399 N/A CYS 1063.A SG LYS 1062.A O no hydrogen 2.990 N/A GLY 1067.A N ASP 1058.A O no hydrogen 2.665 N/A SER 1069.A OG TYR 1068.A O no hydrogen 2.543 N/A CYS 1075.A SG CYS 1075.A O no hydrogen 3.006 N/A ILE 1082.A N VAL 1059.A O no hydrogen 2.934 N/A MET 1084.A N VAL 1057.A O no hydrogen 3.253 N/A THR 1085.A OG1 PHE 1055.A O no hydrogen 3.002 N/A ILE 1086.A N PHE 1055.A O no hydrogen 2.916 N/A ALA 1089.A N ASP 1053.A OD2 no hydrogen 2.773 N/A ALA 1090.A N PRO 1087.A O no hydrogen 2.741 N/A LYS 1091.A N PRO 1087.A O no hydrogen 3.244 N/A LEU 1092.A N TYR 1088.A O no hydrogen 2.933 N/A LEU 1093.A N ALA 1089.A O no hydrogen 2.926 N/A PHE 1094.A N ALA 1090.A O no hydrogen 2.914 N/A GLN 1095.A N LYS 1091.A O no hydrogen 2.922 N/A GLU 1096.A N LEU 1092.A O no hydrogen 3.008 N/A LEU 1097.A N LEU 1093.A O no hydrogen 2.883 N/A LEU 1098.A N PHE 1094.A O no hydrogen 2.890 N/A SER 1099.A N GLN 1095.A O no hydrogen 2.541 N/A