Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6acd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE THR 3.A OG1 no hydrogen 2.706 N/A THR 3.A OG1 ARG 1.A O no hydrogen 2.877 N/A THR 4.A N CYS 2.A O no hydrogen 3.016 N/A VAL 8.A N ASP 6.A O no hydrogen 2.794 N/A GLN 15.A NE2 TYR 13.A O no hydrogen 2.786 N/A HIS 16.A N VAL 49.A O no hydrogen 2.944 N/A HIS 16.A NE2 HIS 53.A NE2 no hydrogen 3.168 N/A SER 18.A N SER 47.A O no hydrogen 2.946 N/A SER 18.A OG PRO 44.A O no hydrogen 3.227 N/A SER 18.A OG SER 47.A O no hydrogen 3.483 N/A SER 18.A OG SER 47.A OG no hydrogen 3.037 N/A SER 19.A OG SER 194.A OG no hydrogen 2.994 N/A ARG 21.A N SER 18.A O no hydrogen 3.261 N/A ARG 21.A NE PRO 193.A O no hydrogen 2.757 N/A ARG 21.A NH2 PRO 193.A O no hydrogen 2.708 N/A ARG 31.A NH1 ASP 27.A OD2 no hydrogen 3.176 N/A ARG 31.A NH2 ASP 27.A OD2 no hydrogen 3.314 N/A SER 32.A OG ASP 246.A O no hydrogen 2.830 N/A SER 32.A OG GLU 247.A O no hydrogen 3.023 N/A ASP 33.A N ASP 246.A O no hydrogen 2.839 N/A TYR 36.A N LEU 243.A O no hydrogen 2.940 N/A THR 38.A N PHE 241.A O no hydrogen 2.957 N/A ASP 40.A N THR 239.A O no hydrogen 2.949 N/A LEU 41.A N ASP 40.A OD1 no hydrogen 2.758 N/A PHE 42.A N LYS 237.A O no hydrogen 2.965 N/A SER 47.A N SER 18.A OG no hydrogen 2.423 N/A SER 47.A OG SER 18.A OG no hydrogen 3.037 N/A VAL 49.A N HIS 16.A O no hydrogen 2.877 N/A THR 50.A N VAL 233.A O no hydrogen 2.981 N/A GLY 51.A N THR 14.A O no hydrogen 2.914 N/A PHE 52.A N TYR 231.A O no hydrogen 2.973 N/A THR 54.A OG1 THR 58.A O no hydrogen 3.177 N/A THR 58.A N ILE 55.A O no hydrogen 2.942 N/A ASN 61.A ND2 ALA 216.A O no hydrogen 3.357 N/A ILE 64.A N PHE 214.A O no hydrogen 3.022 N/A PHE 66.A N THR 212.A O no hydrogen 2.475 N/A ILE 70.A N PHE 170.A O no hydrogen 2.928 N/A TYR 71.A N GLY 234.A O no hydrogen 2.896 N/A PHE 72.A N PHE 168.A O no hydrogen 2.894 N/A ALA 73.A N PHE 232.A O no hydrogen 2.922 N/A ALA 74.A N ARG 166.A O no hydrogen 2.858 N/A THR 75.A N ALA 230.A O no hydrogen 2.891 N/A THR 75.A OG1 ALA 230.A O no hydrogen 3.103 N/A GLU 76.A N HIS 164.A O no hydrogen 2.908 N/A LYS 77.A NZ ALA 228.A O no hydrogen 2.388 N/A SER 78.A OG LYS 77.A O no hydrogen 2.632 N/A SER 78.A OG SER 156.A O no hydrogen 2.242 N/A ASN 79.A ND2 ASP 154.A O no hydrogen 3.610 N/A ARG 82.A NH2 ASP 154.A O no hydrogen 2.382 N/A TRP 84.A N ILE 99.A O no hydrogen 2.884 N/A VAL 85.A N ARG 215.A O no hydrogen 2.900 N/A PHE 86.A N VAL 97.A O no hydrogen 2.951 N/A GLY 87.A N ASN 213.A O no hydrogen 2.901 N/A THR 89.A OG1 ASN 91.A OD1 no hydrogen 2.339 N/A ASN 91.A N SER 94.A OG no hydrogen 2.862 N/A SER 94.A N ASN 91.A O no hydrogen 3.102 N/A SER 94.A OG ASN 91.A O no hydrogen 2.321 N/A SER 94.A OG ASN 91.A OD1 no hydrogen 3.545 N/A SER 96.A N CYS 111.A O no hydrogen 2.898 N/A VAL 97.A N PHE 86.A O no hydrogen 2.933 N/A ILE 98.A N ARG 109.A O no hydrogen 2.880 N/A ILE 99.A N TRP 84.A O no hydrogen 2.936 N/A ILE 100.A N VAL 107.A O no hydrogen 2.896 N/A ASN 102.A N ASN 105.A O no hydrogen 3.170 N/A SER 103.A OG ASN 102.A O no hydrogen 2.560 N/A THR 104.A N ASN 102.A OD1 no hydrogen 3.390 N/A THR 104.A OG1 ASN 102.A O no hydrogen 3.543 N/A THR 104.A OG1 ASN 102.A OD1 no hydrogen 2.476 N/A ASN 105.A N ASN 102.A OD1 no hydrogen 2.870 N/A ASN 105.A ND2 SER 148.A O no hydrogen 2.391 N/A VAL 106.A N ASN 105.A OD1 no hydrogen 2.551 N/A VAL 107.A N ILE 100.A O no hydrogen 2.894 N/A ILE 108.A N TYR 146.A O no hydrogen 2.928 N/A ARG 109.A N ILE 98.A O no hydrogen 2.974 N/A ARG 109.A NH2 GLU 145.A OE2 no hydrogen 2.721 N/A ALA 110.A N PHE 144.A O no hydrogen 2.884 N/A CYS 111.A N SER 96.A O no hydrogen 2.916 N/A CYS 111.A SG ASN 112.A O no hydrogen 3.292 N/A CYS 111.A SG PHE 140.A O no hydrogen 3.250 N/A CYS 116.A SG ASP 137.A OD2 no hydrogen 3.451 N/A PHE 121.A N LEU 218.A O no hydrogen 3.320 N/A VAL 123.A N ALA 220.A O no hydrogen 2.940 N/A THR 131.A N THR 129.A O no hydrogen 2.853 N/A THR 131.A OG1 THR 129.A O no hydrogen 3.418 N/A MET 134.A N HIS 132.A O no hydrogen 2.810 N/A ASP 137.A N ILE 135.A O no hydrogen 2.924 N/A ASN 138.A ND2 GLU 114.A OE1 no hydrogen 3.184 N/A THR 143.A N ALA 110.A O no hydrogen 3.183 N/A THR 143.A OG1 ALA 110.A O no hydrogen 2.480 N/A PHE 144.A N ALA 110.A O no hydrogen 2.933 N/A TYR 146.A N ILE 108.A O no hydrogen 2.857 N/A SER 148.A N VAL 106.A O no hydrogen 3.033 N/A ASP 149.A N SER 148.A OG no hydrogen 2.567 N/A PHE 151.A N THR 104.A O no hydrogen 3.158 N/A LYS 158.A NZ ASP 154.A OD2 no hydrogen 3.399 N/A GLY 160.A N SER 159.A OG no hydrogen 2.585 N/A ARG 166.A N ALA 74.A O no hydrogen 2.910 N/A ARG 166.A NH2 ASN 79.A OD1 no hydrogen 2.544 N/A PHE 168.A N PHE 72.A O no hydrogen 2.864 N/A VAL 169.A N TYR 180.A O no hydrogen 3.429 N/A PHE 170.A N ILE 70.A O no hydrogen 3.005 N/A LYS 171.A N TYR 178.A O no hydrogen 2.937 N/A LYS 171.A NZ TYR 24.A OH no hydrogen 2.419 N/A LYS 171.A NZ ASP 40.A OD1 no hydrogen 3.146 N/A LYS 171.A NZ ASP 40.A OD2 no hydrogen 3.086 N/A LYS 173.A N PHE 176.A O no hydrogen 2.925 N/A LYS 173.A NZ ASP 174.A OD2 no hydrogen 2.419 N/A PHE 176.A N LYS 173.A O no hydrogen 2.851 N/A LEU 177.A N LEU 205.A O no hydrogen 2.887 N/A TYR 178.A N LYS 171.A O no hydrogen 2.828 N/A VAL 179.A N PHE 203.A O no hydrogen 2.869 N/A TYR 180.A N VAL 169.A O no hydrogen 3.008 N/A LYS 181.A N LYS 200.A O no hydrogen 3.097 N/A TYR 183.A OH HIS 164.A ND1 no hydrogen 3.329 N/A ILE 186.A N PHE 162.A O no hydrogen 2.880 N/A SER 194.A OG SER 19.A OG no hydrogen 2.994 N/A LYS 200.A N LYS 181.A O no hydrogen 2.748 N/A PHE 203.A N VAL 179.A O no hydrogen 2.993 N/A LEU 205.A N LEU 177.A O no hydrogen 2.868 N/A THR 212.A N GLY 87.A O no hydrogen 3.382 N/A THR 212.A OG1 GLY 87.A O no hydrogen 3.350 N/A THR 212.A OG1 SER 88.A O no hydrogen 2.635 N/A ASN 213.A N GLY 87.A O no hydrogen 2.921 N/A ASN 213.A ND2 SER 88.A O no hydrogen 2.975 N/A PHE 214.A N ILE 64.A O no hydrogen 2.702 N/A ARG 215.A N VAL 85.A O no hydrogen 2.930 N/A ARG 215.A NE ASN 61.A OD1 no hydrogen 3.120 N/A ARG 215.A NH2 ASN 61.A O no hydrogen 2.905 N/A ILE 217.A N GLY 83.A O no hydrogen 2.829 N/A THR 219.A OG1 THR 219.A O no hydrogen 2.508 N/A PHE 221.A N GLY 225.A O no hydrogen 3.112 N/A SER 222.A N VAL 123.A O no hydrogen 2.887 N/A THR 226.A N ASN 56.A OD1 no hydrogen 3.221 N/A THR 226.A OG1 ASN 56.A OD1 no hydrogen 2.908 N/A ALA 230.A N THR 75.A O no hydrogen 2.955 N/A ALA 230.A N THR 75.A OG1 no hydrogen 3.391 N/A TYR 231.A N PHE 52.A O no hydrogen 3.416 N/A TYR 231.A OH GLY 60.A O no hydrogen 3.007 N/A PHE 232.A N ALA 73.A O no hydrogen 2.869 N/A VAL 233.A N THR 50.A O no hydrogen 3.397 N/A GLY 234.A N TYR 71.A O no hydrogen 2.952 N/A TYR 235.A OH PRO 65.A O no hydrogen 2.507 N/A LEU 236.A N GLY 69.A O no hydrogen 3.366 N/A LYS 237.A N PHE 42.A O no hydrogen 2.870 N/A THR 239.A OG1 ASP 256.A OD1 no hydrogen 3.355 N/A THR 239.A OG1 SER 258.A OG no hydrogen 2.748 N/A THR 240.A N THR 239.A OG1 no hydrogen 2.658 N/A PHE 241.A N THR 38.A O no hydrogen 2.906 N/A MET 242.A N VAL 255.A O no hydrogen 2.893 N/A LEU 243.A N TYR 36.A O no hydrogen 2.883 N/A LYS 244.A N ASP 253.A O no hydrogen 2.920 N/A TYR 245.A N THR 34.A O no hydrogen 3.172 N/A ASP 246.A N THR 250.A O no hydrogen 3.143 N/A GLU 247.A N GLU 247.A OE1 no hydrogen 2.720 N/A GLY 249.A N ASP 246.A OD1 no hydrogen 2.565 N/A THR 250.A N ASP 246.A OD1 no hydrogen 2.440 N/A THR 252.A N LYS 244.A O no hydrogen 3.241 N/A THR 252.A OG1 LYS 244.A O no hydrogen 3.260 N/A VAL 255.A N MET 242.A O no hydrogen 2.908 N/A CYS 257.A N THR 240.A O no hydrogen 3.096 N/A CYS 257.A SG THR 240.A O no hydrogen 3.384 N/A SER 258.A N ASP 256.A OD1 no hydrogen 3.280 N/A SER 258.A OG THR 239.A OG1 no hydrogen 2.748 N/A SER 258.A OG ASP 256.A OD1 no hydrogen 3.533 N/A SER 258.A OG ASP 256.A OD2 no hydrogen 3.477 N/A GLU 264.A N ASN 260.A O no hydrogen 2.924 N/A LEU 265.A N PRO 261.A O no hydrogen 2.965 N/A LYS 266.A N LEU 262.A O no hydrogen 2.944 N/A CYS 267.A N ALA 263.A O no hydrogen 2.986 N/A CYS 267.A SG ALA 263.A O no hydrogen 3.489 N/A CYS 267.A SG GLU 264.A O no hydrogen 3.628 N/A SER 268.A N LEU 265.A O no hydrogen 3.137 N/A SER 268.A OG GLU 264.A O no hydrogen 2.335 N/A VAL 269.A N LEU 265.A O no hydrogen 3.019 N/A SER 271.A N LYS 266.A O no hydrogen 3.185 N/A SER 271.A OG GLU 273.A O no hydrogen 2.581 N/A ILE 274.A N THR 567.A OG1 no hydrogen 3.086 N/A LYS 276.A NZ ASP 628.A OD1 no hydrogen 3.236 N/A LYS 276.A NZ ASP 628.A OD2 no hydrogen 2.890 N/A TYR 279.A N VAL 562.A O no hydrogen 3.069 N/A GLN 280.A NE2 THR 281.A O no hydrogen 2.969 N/A SER 282.A N THR 281.A OG1 no hydrogen 2.510 N/A PHE 284.A N GLY 558.A O no hydrogen 2.839 N/A ARG 285.A N THR 595.A OG1 no hydrogen 3.141 N/A VAL 286.A N SER 556.A O no hydrogen 3.268 N/A VAL 287.A N GLN 593.A O no hydrogen 3.080 N/A SER 289.A N CYS 503.A O no hydrogen 2.467 N/A VAL 292.A N ASN 505.A O no hydrogen 3.107 N/A VAL 293.A N THR 496.A OG1 no hydrogen 2.645 N/A ARG 294.A N ASN 507.A O no hydrogen 3.130 N/A ARG 294.A NE ASP 543.A OD1 no hydrogen 2.603 N/A ARG 294.A NH1 THR 496.A O no hydrogen 3.051 N/A ARG 294.A NH2 ASP 543.A OD1 no hydrogen 3.417 N/A ARG 294.A NH2 ASP 543.A OD2 no hydrogen 2.859 N/A ASN 300.A ND2 ASN 326.A O no hydrogen 2.996 N/A GLU 306.A N PRO 303.A O no hydrogen 2.881 N/A VAL 307.A N PRO 303.A O no hydrogen 2.839 N/A PHE 308.A N PHE 304.A O no hydrogen 3.020 N/A GLU 320.A N SER 365.A O no hydrogen 2.937 N/A LYS 322.A N ALA 363.A O no hydrogen 2.861 N/A LYS 322.A NZ GLU 320.A OE2 no hydrogen 3.271 N/A ILE 324.A N VAL 361.A O no hydrogen 2.904 N/A SER 325.A OG ASN 360.A OD1 no hydrogen 2.857 N/A CYS 327.A SG ASN 300.A O no hydrogen 3.289 N/A VAL 328.A N ASN 300.A O no hydrogen 2.634 N/A ALA 329.A N CYS 490.A O no hydrogen 2.519 N/A TYR 331.A N ASP 330.A OD1 no hydrogen 2.647 N/A TYR 335.A N SER 332.A O no hydrogen 3.083 N/A TYR 335.A OH ALA 350.A O no hydrogen 2.479 N/A ASN 336.A N SER 332.A O no hydrogen 2.836 N/A PHE 339.A N SER 337.A OG no hydrogen 2.989 N/A THR 342.A N ALA 401.A O no hydrogen 2.925 N/A LYS 344.A N VAL 399.A O no hydrogen 2.959 N/A TYR 346.A N GLY 397.A O no hydrogen 3.403 N/A TYR 346.A OH ILE 376.A O no hydrogen 3.042 N/A PHE 358.A N VAL 489.A O no hydrogen 2.437 N/A ASN 360.A N THR 488.A OG1 no hydrogen 3.029 N/A TYR 362.A N SER 479.A O no hydrogen 2.901 N/A TYR 362.A OH GLU 481.A OE1 no hydrogen 2.609 N/A ALA 363.A N LYS 322.A O no hydrogen 2.939 N/A ASP 364.A N VAL 477.A O no hydrogen 2.908 N/A SER 365.A N GLU 320.A O no hydrogen 2.886 N/A PHE 366.A N VAL 475.A O no hydrogen 2.976 N/A VAL 367.A N PRO 314.A O no hydrogen 3.055 N/A VAL 368.A N TYR 473.A O no hydrogen 2.910 N/A LYS 369.A NZ TYR 460.A O no hydrogen 3.388 N/A ALA 385.A N GLN 375.A OE1 no hydrogen 2.941 N/A ASP 386.A N VAL 383.A O no hydrogen 3.154 N/A TYR 387.A N VAL 383.A O no hydrogen 2.672 N/A ASN 388.A N ILE 384.A O no hydrogen 2.740 N/A ASN 388.A ND2 ARG 420.A O no hydrogen 2.525 N/A TYR 389.A N ILE 384.A O no hydrogen 3.280 N/A TYR 389.A OH ASP 364.A OD2 no hydrogen 3.381 N/A LYS 390.A NZ LEU 427.A O no hydrogen 3.047 N/A CYS 398.A N LEU 478.A O no hydrogen 2.957 N/A VAL 399.A N LYS 344.A O no hydrogen 2.870 N/A LEU 400.A N VAL 476.A O no hydrogen 2.954 N/A ALA 401.A N THR 342.A O no hydrogen 2.871 N/A TRP 402.A N ARG 474.A O no hydrogen 2.949 N/A ASN 403.A ND2 GLN 471.A OE1 no hydrogen 2.400 N/A THR 404.A N PRO 472.A O no hydrogen 2.790 N/A THR 404.A OG1 PRO 472.A O no hydrogen 3.364 N/A ARG 405.A N ASN 403.A OD1 no hydrogen 3.234 N/A THR 410.A OG1 THR 412.A OG1 no hydrogen 2.721 N/A THR 412.A OG1 THR 410.A OG1 no hydrogen 2.721 N/A GLY 413.A N THR 410.A OG1 no hydrogen 3.060 N/A ASN 414.A N PHE 462.A O no hydrogen 3.254 N/A LYS 418.A N SER 315.A OG no hydrogen 3.149 N/A LYS 418.A NZ ASP 459.A OD1 no hydrogen 2.531 N/A TYR 419.A N ASN 458.A O no hydrogen 2.861 N/A LYS 426.A NZ ASP 386.A OD1 no hydrogen 3.557 N/A LYS 426.A NZ ASP 386.A OD2 no hydrogen 3.159 N/A ARG 428.A N GLU 431.A OE1 no hydrogen 3.327 N/A ARG 428.A NE GLU 431.A OE1 no hydrogen 2.960 N/A ARG 428.A NH2 GLU 431.A OE2 no hydrogen 2.724 N/A PHE 430.A N LYS 390.A O no hydrogen 2.867 N/A SER 435.A OG ASN 436.A O no hydrogen 3.294 N/A SER 440.A OG ASN 452.A O no hydrogen 3.277 N/A LYS 444.A NZ ASP 442.A OD2 no hydrogen 2.889 N/A CYS 446.A SG LYS 444.A O no hydrogen 3.243 N/A ALA 450.A N THR 447.A O no hydrogen 3.275 N/A CYS 453.A N ALA 450.A O no hydrogen 3.038 N/A CYS 453.A SG SER 440.A OG no hydrogen 3.593 N/A CYS 453.A SG LEU 451.A O no hydrogen 3.753 N/A TYR 454.A N PHE 439.A O no hydrogen 3.085 N/A ASN 458.A N TYR 419.A O no hydrogen 2.907 N/A TYR 463.A OH TYR 415.A OH no hydrogen 2.424 N/A THR 464.A OG1 ALA 409.A O no hydrogen 2.306 N/A GLY 467.A N THR 466.A OG1 no hydrogen 2.686 N/A TYR 470.A N GLY 467.A O no hydrogen 3.363 N/A GLN 471.A N ILE 468.A O no hydrogen 3.023 N/A TYR 473.A N VAL 368.A O no hydrogen 2.889 N/A ARG 474.A N TRP 402.A O no hydrogen 2.895 N/A ARG 474.A NH1 ALA 310.A O no hydrogen 2.600 N/A VAL 475.A N PHE 366.A O no hydrogen 2.874 N/A VAL 476.A N LEU 400.A O no hydrogen 2.858 N/A VAL 477.A N ASP 364.A O no hydrogen 2.874 N/A LEU 478.A N CYS 398.A O no hydrogen 2.896 N/A SER 479.A N TYR 362.A O no hydrogen 2.940 N/A THR 488.A N PHE 358.A O no hydrogen 2.537 N/A THR 488.A OG1 SER 325.A OG no hydrogen 3.390 N/A THR 488.A OG1 PHE 358.A O no hydrogen 3.374 N/A VAL 489.A N PHE 358.A O no hydrogen 2.806 N/A CYS 490.A N CYS 327.A O no hydrogen 2.854 N/A THR 496.A N VAL 293.A O no hydrogen 2.624 N/A THR 496.A OG1 ASP 291.A O no hydrogen 3.485 N/A THR 496.A OG1 VAL 293.A O no hydrogen 3.264 N/A ASN 501.A N LEU 517.A O no hydrogen 2.919 N/A GLN 502.A NE2 SER 289.A OG no hydrogen 2.875 N/A CYS 503.A SG VAL 286.A O no hydrogen 4.017 N/A VAL 504.A N GLY 515.A O no hydrogen 2.920 N/A PHE 506.A N GLY 513.A O no hydrogen 2.911 N/A ASN 507.A N VAL 292.A O no hydrogen 3.224 N/A ASN 507.A ND2 ASP 355.A OD1 no hydrogen 3.516 N/A PHE 508.A N LEU 511.A O no hydrogen 2.646 N/A GLY 510.A N ASN 509.A OD1 no hydrogen 2.697 N/A THR 512.A OG1 PHE 506.A O no hydrogen 2.992 N/A THR 514.A OG1 ASN 505.A OD1 no hydrogen 3.226 N/A GLY 515.A N VAL 504.A O no hydrogen 2.931 N/A VAL 516.A N ILE 552.A O no hydrogen 2.870 N/A SER 520.A N GLU 548.A O no hydrogen 3.070 N/A GLN 525.A N GLN 528.A OE1 no hydrogen 3.038 N/A GLN 525.A NE2 ARG 523.A O no hydrogen 3.508 N/A GLN 529.A NE2 LEU 483.A O no hydrogen 3.549 N/A ASP 533.A N PHE 537.A O no hydrogen 2.682 N/A SER 540.A N THR 538.A O no hydrogen 2.647 N/A VAL 541.A N ILE 549.A O no hydrogen 2.839 N/A ASP 543.A N SER 547.A O no hydrogen 2.817 N/A LYS 545.A N ASP 543.A OD2 no hydrogen 2.736 N/A ILE 549.A N VAL 541.A O no hydrogen 2.938 N/A LEU 550.A N THR 518.A O no hydrogen 2.852 N/A ASP 551.A N ASP 539.A O no hydrogen 2.900 N/A ILE 552.A N VAL 516.A O no hydrogen 2.929 N/A CYS 555.A N SER 553.A O no hydrogen 2.898 N/A CYS 555.A SG SER 553.A O no hydrogen 3.986 N/A SER 556.A OG ASP 579.A O no hydrogen 3.462 N/A GLY 558.A N PHE 284.A O no hydrogen 2.971 N/A GLY 559.A N GLN 578.A OE1 no hydrogen 2.951 N/A VAL 560.A N SER 282.A O no hydrogen 3.197 N/A SER 561.A N LEU 576.A O no hydrogen 2.924 N/A SER 561.A OG LEU 576.A O no hydrogen 3.415 N/A VAL 562.A N TYR 279.A O no hydrogen 3.128 N/A ILE 563.A N ALA 574.A O no hydrogen 2.882 N/A GLY 566.A N THR 564.A OG1 no hydrogen 3.428 N/A THR 567.A OG1 ILE 274.A O no hydrogen 3.250 N/A THR 567.A OG1 GLY 566.A O no hydrogen 2.627 N/A ASN 568.A ND2 GLU 273.A OE2 no hydrogen 2.881 N/A GLU 572.A N SER 570.A OG no hydrogen 2.726 N/A ALA 574.A N ILE 563.A O no hydrogen 2.976 N/A VAL 575.A N ILE 616.A O no hydrogen 3.219 N/A LEU 576.A N SER 561.A O no hydrogen 2.920 N/A TYR 577.A N CYS 614.A O no hydrogen 2.885 N/A CYS 582.A SG ASN 606.A OD1 no hydrogen 3.203 N/A THR 583.A OG1 ASN 581.A O no hydrogen 3.447 N/A THR 587.A N THR 583.A O no hydrogen 3.382 N/A THR 587.A OG1 THR 583.A O no hydrogen 2.797 N/A ALA 588.A N ASP 584.A O no hydrogen 2.873 N/A ILE 589.A N VAL 585.A O no hydrogen 2.890 N/A HIS 590.A N SER 586.A O no hydrogen 2.921 N/A ASP 592.A N ILE 589.A O no hydrogen 3.093 N/A GLN 593.A N ALA 588.A O no hydrogen 2.670 N/A GLN 593.A NE2 ALA 591.A O no hydrogen 2.671 N/A THR 595.A OG1 ARG 285.A O no hydrogen 3.425 N/A ARG 599.A N GLN 259.A O no hydrogen 3.215 N/A ILE 600.A N GLN 259.A O no hydrogen 3.468 N/A ASN 605.A ND2 GLU 619.A OE2 no hydrogen 2.384 N/A THR 610.A OG1 GLN 609.A O no hydrogen 2.596 N/A THR 610.A OG1 THR 610.A O no hydrogen 2.533 N/A LEU 615.A N VAL 607.A O no hydrogen 3.323 N/A ILE 616.A N VAL 575.A O no hydrogen 3.087 N/A THR 623.A N ASP 622.A OD1 no hydrogen 2.705 N/A THR 623.A OG1 ASP 622.A OD1 no hydrogen 3.482 N/A GLU 626.A N GLU 626.A OE1 no hydrogen 2.673 N/A ILE 631.A N ILE 635.A O no hydrogen 2.954 N/A GLY 632.A N PRO 630.A O no hydrogen 3.264 N/A ALA 633.A N ILE 631.A O no hydrogen 2.898 N/A CYS 636.A N TYR 643.A O no hydrogen 3.039 N/A CYS 636.A SG GLY 634.A O no hydrogen 3.258 N/A CYS 636.A SG THR 644.A O no hydrogen 3.843 N/A TYR 639.A N SER 638.A OG no hydrogen 2.466 N/A ALA 642.A N GLU 619.A O no hydrogen 2.922 N/A TYR 643.A N CYS 636.A O no hydrogen 3.308 N/A THR 644.A OG1 MET 645.A O no hydrogen 3.506 N/A MET 645.A N THR 644.A OG1 no hydrogen 2.400 N/A SER 646.A N TYR 625.A O no hydrogen 2.645 N/A ILE 660.A N PHE 1003.A O no hydrogen 2.483 N/A THR 664.A N GLN 999.A O no hydrogen 3.055 N/A THR 664.A OG1 GLN 999.A O no hydrogen 3.364 N/A THR 664.A OG1 GLN 999.A OE1 no hydrogen 3.064 N/A SER 667.A OG VAL 996.A O no hydrogen 2.486 N/A THR 671.A N HIS 992.A O no hydrogen 2.949 N/A MET 675.A N VAL 988.A O no hydrogen 2.979 N/A VAL 677.A N HIS 986.A O no hydrogen 3.184 N/A SER 678.A N HIS 986.A O no hydrogen 3.250 N/A SER 678.A OG MET 679.A O no hydrogen 3.404 N/A LYS 681.A NZ ASP 723.A OD1 no hydrogen 2.943 N/A LYS 681.A NZ ASP 723.A OD2 no hydrogen 2.751 N/A LYS 681.A NZ PRO 790.A O no hydrogen 3.081 N/A THR 682.A OG1 TYR 935.A OH no hydrogen 3.148 N/A SER 683.A N THR 787.A O no hydrogen 2.911 N/A ASP 685.A N GLY 785.A O no hydrogen 3.030 N/A CYS 686.A SG CYS 708.A O no hydrogen 3.161 N/A MET 688.A N ASP 685.A O no hydrogen 3.167 N/A TYR 689.A N ASP 685.A O no hydrogen 3.343 N/A TYR 689.A OH LEU 890.A O no hydrogen 2.359 N/A ASN 699.A ND2 GLU 696.A OE1 no hydrogen 3.144 N/A LEU 700.A N GLU 696.A O no hydrogen 2.907 N/A LEU 701.A N CYS 697.A O no hydrogen 2.866 N/A LEU 702.A N ALA 698.A O no hydrogen 2.913 N/A GLN 703.A N ASN 699.A O no hydrogen 2.966 N/A TYR 704.A N LEU 701.A O no hydrogen 2.990 N/A TYR 704.A OH THR 926.A OG1 no hydrogen 3.263 N/A GLY 705.A N LEU 702.A O no hydrogen 3.338 N/A CYS 708.A SG ASN 687.A OD1 no hydrogen 3.377 N/A LEU 711.A N PHE 707.A O no hydrogen 2.920 N/A ASN 712.A N CYS 708.A O no hydrogen 2.997 N/A ARG 713.A N THR 709.A O no hydrogen 2.935 N/A ALA 714.A N GLN 710.A O no hydrogen 2.867 N/A LEU 715.A N LEU 711.A O no hydrogen 2.965 N/A SER 716.A N ASN 712.A O no hydrogen 2.930 N/A SER 716.A OG ASN 712.A O no hydrogen 2.970 N/A SER 716.A OG ARG 713.A O no hydrogen 2.763 N/A GLY 717.A N ARG 713.A O no hydrogen 2.907 N/A ILE 718.A N ALA 714.A O no hydrogen 2.959 N/A ALA 719.A N LEU 715.A O no hydrogen 2.902 N/A ALA 720.A N SER 716.A O no hydrogen 2.905 N/A GLU 721.A N GLY 717.A O no hydrogen 2.919 N/A GLN 722.A N ILE 718.A O no hydrogen 2.962 N/A ASP 723.A N ALA 719.A O no hydrogen 3.033 N/A ARG 724.A N ALA 720.A O no hydrogen 2.860 N/A ARG 724.A NH2 GLU 728.A OE2 no hydrogen 3.532 N/A ASN 725.A N GLU 721.A O no hydrogen 2.844 N/A THR 726.A N GLN 722.A O no hydrogen 3.028 N/A THR 726.A OG1 GLN 722.A O no hydrogen 3.095 N/A ARG 727.A N ASP 723.A O no hydrogen 2.948 N/A GLU 728.A N ARG 724.A O no hydrogen 2.850 N/A VAL 729.A N ASN 725.A O no hydrogen 2.915 N/A PHE 730.A N THR 726.A O no hydrogen 2.943 N/A ALA 731.A N ARG 727.A O no hydrogen 2.967 N/A GLN 732.A N PHE 730.A O no hydrogen 2.600 N/A GLN 732.A NE2 GLU 728.A O no hydrogen 2.434 N/A THR 741.A OG1 PRO 740.A O no hydrogen 2.631 N/A LYS 743.A NZ PRO 755.A O no hydrogen 2.435 N/A LYS 743.A NZ ASP 756.A OD1 no hydrogen 2.412 N/A PHE 745.A N PHE 748.A O no hydrogen 3.428 N/A PHE 748.A N PHE 745.A O no hydrogen 3.247 N/A ASN 749.A N ASN 856.A OD1 no hydrogen 2.839 N/A PHE 750.A N LYS 743.A O no hydrogen 3.026 N/A SER 751.A OG GLN 752.A OE1 no hydrogen 2.795 N/A ILE 753.A N PHE 750.A O no hydrogen 3.323 N/A LYS 762.A NZ ASP 796.A OD2 no hydrogen 3.464 N/A SER 764.A N GLU 767.A OE1 no hydrogen 3.216 N/A SER 764.A OG ILE 753.A O no hydrogen 3.257 N/A SER 764.A OG GLN 982.A OE1 no hydrogen 3.456 N/A ASP 768.A N SER 764.A O no hydrogen 3.092 N/A LEU 769.A N PHE 765.A O no hydrogen 2.967 N/A LEU 770.A N ILE 766.A O no hydrogen 2.927 N/A PHE 771.A N GLU 767.A O no hydrogen 2.880 N/A ASN 772.A N ASP 768.A O no hydrogen 2.937 N/A LYS 773.A N LEU 769.A O no hydrogen 2.929 N/A LYS 773.A N LEU 770.A O no hydrogen 3.248 N/A LYS 773.A NZ LEU 866.A O no hydrogen 2.417 N/A VAL 774.A N LEU 770.A O no hydrogen 3.280 N/A CYS 779.A SG ILE 778.A O no hydrogen 3.263 N/A THR 787.A N SER 683.A O no hydrogen 2.931 N/A THR 794.A OG1 LEU 792.A O no hydrogen 2.852 N/A ILE 798.A N THR 794.A O no hydrogen 2.935 N/A ALA 799.A N ASP 795.A O no hydrogen 2.911 N/A ALA 800.A N ASP 796.A O no hydrogen 2.851 N/A TYR 801.A N MET 797.A O no hydrogen 2.912 N/A THR 802.A N ILE 798.A O no hydrogen 2.922 N/A THR 802.A OG1 GLU 767.A OE2 no hydrogen 2.935 N/A THR 802.A OG1 ILE 798.A O no hydrogen 3.556 N/A THR 802.A OG1 ALA 799.A O no hydrogen 2.579 N/A ALA 803.A N ALA 799.A O no hydrogen 2.895 N/A ALA 804.A N ALA 800.A O no hydrogen 2.867 N/A LEU 805.A N TYR 801.A O no hydrogen 2.903 N/A VAL 806.A N THR 802.A O no hydrogen 2.931 N/A SER 807.A N ALA 803.A O no hydrogen 2.856 N/A SER 807.A OG ALA 803.A O no hydrogen 3.107 N/A SER 807.A OG ALA 804.A O no hydrogen 2.540 N/A GLY 808.A N ALA 804.A O no hydrogen 2.911 N/A THR 809.A N LEU 805.A O no hydrogen 2.894 N/A THR 809.A OG1 LEU 805.A O no hydrogen 2.467 N/A ALA 810.A N VAL 806.A O no hydrogen 2.846 N/A THR 811.A N SER 807.A O no hydrogen 2.485 N/A THR 811.A OG1 SER 807.A O no hydrogen 2.617 N/A PHE 816.A N TRP 814.A O no hydrogen 2.757 N/A GLN 829.A NE2 THR 809.A O no hydrogen 2.852 N/A GLN 829.A NE2 THR 811.A O no hydrogen 2.890 N/A ALA 831.A N ALA 827.A O no hydrogen 2.889 N/A TYR 832.A N MET 828.A O no hydrogen 2.929 N/A ARG 833.A N GLN 829.A O no hydrogen 2.825 N/A ARG 833.A NH1 LEU 977.A O no hydrogen 2.779 N/A PHE 834.A N MET 830.A O no hydrogen 3.196 N/A ASN 835.A N TYR 832.A O no hydrogen 2.926 N/A VAL 843.A N THR 840.A O no hydrogen 3.511 N/A GLU 846.A N ASN 842.A O no hydrogen 3.309 N/A ASN 847.A N LEU 844.A O no hydrogen 3.138 N/A ASN 847.A ND2 VAL 843.A O no hydrogen 3.000 N/A ILE 851.A N ASN 847.A O no hydrogen 3.067 N/A ALA 852.A N GLN 848.A O no hydrogen 2.949 N/A ASN 853.A N LYS 849.A O no hydrogen 2.893 N/A GLN 854.A N GLN 850.A O no hydrogen 2.918 N/A PHE 855.A N ILE 851.A O no hydrogen 2.907 N/A ASN 856.A N ALA 852.A O no hydrogen 2.911 N/A ASN 856.A ND2 GLY 747.A O no hydrogen 2.402 N/A LYS 857.A N ASN 853.A O no hydrogen 2.906 N/A ALA 858.A N GLN 854.A O no hydrogen 2.873 N/A ILE 859.A N PHE 855.A O no hydrogen 3.000 N/A SER 860.A N ASN 856.A O no hydrogen 2.948 N/A SER 860.A OG ASN 856.A O no hydrogen 3.164 N/A GLN 861.A N LYS 857.A O no hydrogen 2.864 N/A ILE 862.A N ALA 858.A O no hydrogen 2.867 N/A GLN 863.A N ILE 859.A O no hydrogen 2.957 N/A GLN 863.A NE2 GLN 752.A OE1 no hydrogen 2.918 N/A GLU 864.A N SER 860.A O no hydrogen 2.952 N/A SER 865.A N GLN 861.A O no hydrogen 2.811 N/A SER 865.A OG GLN 861.A O no hydrogen 2.608 N/A SER 865.A OG ILE 862.A O no hydrogen 3.185 N/A LEU 866.A N GLN 863.A O no hydrogen 3.118 N/A THR 867.A N GLN 863.A O no hydrogen 2.939 N/A THR 867.A OG1 GLN 863.A O no hydrogen 3.305 N/A THR 867.A OG1 GLU 864.A O no hydrogen 3.026 N/A THR 869.A OG1 SER 865.A O no hydrogen 2.483 N/A ASP 878.A N GLY 874.A O no hydrogen 2.861 N/A VAL 879.A N LYS 875.A O no hydrogen 2.948 N/A VAL 880.A N LEU 876.A O no hydrogen 2.986 N/A ASN 881.A N GLN 877.A O no hydrogen 2.815 N/A GLN 882.A N ASP 878.A O no hydrogen 2.929 N/A ASN 883.A N VAL 879.A O no hydrogen 2.987 N/A ALA 884.A N VAL 880.A O no hydrogen 2.933 N/A GLN 885.A N ASN 881.A O no hydrogen 2.833 N/A ALA 886.A N GLN 882.A O no hydrogen 2.947 N/A LEU 887.A N ASN 883.A O no hydrogen 2.952 N/A ASN 888.A N ALA 884.A O no hydrogen 2.862 N/A THR 889.A N GLN 885.A O no hydrogen 2.893 N/A THR 889.A OG1 GLN 885.A O no hydrogen 2.293 N/A LEU 890.A N ALA 886.A O no hydrogen 2.940 N/A VAL 891.A N LEU 887.A O no hydrogen 2.982 N/A LYS 892.A N ASN 888.A O no hydrogen 2.918 N/A GLN 893.A N THR 889.A O no hydrogen 2.879 N/A LEU 894.A N LEU 890.A O no hydrogen 3.061 N/A SER 895.A N VAL 891.A O no hydrogen 2.990 N/A SER 895.A OG LYS 892.A O no hydrogen 2.397 N/A SER 896.A N LYS 892.A O no hydrogen 2.876 N/A SER 896.A OG ASN 897.A O no hydrogen 2.813 N/A ASN 897.A ND2 ALA 900.A O no hydrogen 2.414 N/A PHE 898.A N ASN 897.A OD1 no hydrogen 2.565 N/A ALA 900.A N ASN 897.A OD1 no hydrogen 2.849 N/A SER 902.A OG ASP 907.A OD2 no hydrogen 2.999 N/A SER 903.A OG SER 895.A O no hydrogen 3.129 N/A SER 910.A N ASP 907.A O no hydrogen 2.807 N/A SER 910.A OG ASP 907.A O no hydrogen 2.337 N/A ALA 917.A N LYS 914.A O no hydrogen 2.436 N/A VAL 919.A N VAL 915.A O no hydrogen 2.674 N/A GLN 920.A N GLU 916.A O no hydrogen 2.997 N/A ILE 921.A N ALA 917.A O no hydrogen 2.907 N/A ASP 922.A N GLU 918.A O no hydrogen 2.852 N/A ARG 923.A N VAL 919.A O no hydrogen 3.008 N/A ARG 923.A NH1 GLY 899.A O no hydrogen 3.248 N/A LEU 924.A N GLN 920.A O no hydrogen 3.008 N/A ILE 925.A N ILE 921.A O no hydrogen 2.885 N/A THR 926.A N ASP 922.A O no hydrogen 2.926 N/A THR 926.A OG1 ASP 922.A O no hydrogen 2.735 N/A GLY 927.A N ARG 923.A O no hydrogen 3.012 N/A ARG 928.A N LEU 924.A O no hydrogen 2.936 N/A LEU 929.A N ILE 925.A O no hydrogen 2.858 N/A GLN 930.A N THR 926.A O no hydrogen 2.973 N/A SER 931.A N GLY 927.A O no hydrogen 3.030 N/A SER 931.A OG GLY 927.A O no hydrogen 3.377 N/A SER 931.A OG ARG 928.A O no hydrogen 2.544 N/A LEU 932.A N ARG 928.A O no hydrogen 2.899 N/A GLN 933.A N LEU 929.A O no hydrogen 2.909 N/A THR 934.A N GLN 930.A O no hydrogen 2.930 N/A THR 934.A OG1 GLN 930.A O no hydrogen 2.621 N/A TYR 935.A N SER 931.A O no hydrogen 2.969 N/A TYR 935.A OH THR 682.A OG1 no hydrogen 3.148 N/A VAL 936.A N LEU 932.A O no hydrogen 2.947 N/A THR 937.A N GLN 933.A O no hydrogen 2.980 N/A THR 937.A OG1 GLN 933.A O no hydrogen 3.180 N/A GLN 938.A N THR 934.A O no hydrogen 2.994 N/A GLN 939.A N TYR 935.A O no hydrogen 2.894 N/A LEU 940.A N VAL 936.A O no hydrogen 2.978 N/A ILE 941.A N THR 937.A O no hydrogen 3.006 N/A ARG 942.A N GLN 938.A O no hydrogen 2.927 N/A ALA 943.A N GLN 939.A O no hydrogen 2.861 N/A ALA 944.A N LEU 940.A O no hydrogen 2.954 N/A GLU 945.A N ILE 941.A O no hydrogen 3.020 N/A ILE 946.A N ARG 942.A O no hydrogen 2.869 N/A ARG 947.A N ALA 943.A O no hydrogen 2.889 N/A ALA 948.A N ALA 944.A O no hydrogen 3.002 N/A SER 949.A N GLU 945.A O no hydrogen 3.008 N/A SER 949.A OG PRO 676.A O no hydrogen 2.580 N/A SER 949.A OG GLU 945.A O no hydrogen 3.445 N/A SER 949.A OG ILE 946.A O no hydrogen 2.501 N/A ALA 950.A N ILE 946.A O no hydrogen 2.845 N/A ASN 951.A N ARG 947.A O no hydrogen 2.855 N/A LEU 952.A N ALA 948.A O no hydrogen 3.026 N/A ALA 953.A N SER 949.A O no hydrogen 2.868 N/A ALA 954.A N ALA 950.A O no hydrogen 2.851 N/A THR 955.A N ASN 951.A O no hydrogen 2.911 N/A THR 955.A OG1 ASN 951.A O no hydrogen 2.546 N/A LYS 956.A N LEU 952.A O no hydrogen 2.897 N/A LYS 956.A NZ GLU 673.A OE2 no hydrogen 2.330 N/A LYS 956.A NZ PHE 970.A O no hydrogen 3.511 N/A MET 957.A N ALA 953.A O no hydrogen 2.896 N/A SER 958.A N ALA 954.A O no hydrogen 2.933 N/A SER 958.A OG ALA 954.A O no hydrogen 3.154 N/A SER 958.A OG THR 955.A O no hydrogen 2.361 N/A GLU 959.A N THR 955.A O no hydrogen 2.806 N/A CYS 960.A N LYS 956.A O no hydrogen 2.686 N/A GLN 964.A NE2 ARG 833.A O no hydrogen 3.180 N/A HIS 976.A NE2 CYS 960.A O no hydrogen 3.124 N/A MET 978.A N VAL 993.A O no hydrogen 2.921 N/A SER 979.A OG LEU 991.A O no hydrogen 3.438 N/A SER 979.A OG HIS 992.A ND1 no hydrogen 3.273 N/A PHE 980.A N LEU 991.A O no hydrogen 2.898 N/A VAL 988.A N MET 675.A O no hydrogen 2.856 N/A VAL 989.A N GLN 982.A O no hydrogen 2.956 N/A PHE 990.A N GLU 673.A O no hydrogen 2.870 N/A LEU 991.A N PHE 980.A O no hydrogen 2.929 N/A HIS 992.A N THR 671.A O no hydrogen 2.902 N/A VAL 993.A N MET 978.A O no hydrogen 2.889 N/A THR 994.A OG1 SER 669.A O no hydrogen 2.658 N/A SER 998.A OG SER 998.A O no hydrogen 2.613 N/A GLU 1000.A N GLU 1000.A OE1 no hydrogen 2.718 N/A ARG 1001.A NH1 GLU 1000.A O no hydrogen 2.854 N/A PHE 1003.A N ILE 660.A O no hydrogen 2.768 N/A THR 1004.A OG1 ASN 1026.A O no hydrogen 2.579 N/A THR 1005.A OG1 VAL 1024.A O no hydrogen 2.875 N/A ALA 1015.A N SER 1051.A O no hydrogen 2.924 N/A TYR 1016.A N ILE 1009.A O no hydrogen 2.990 N/A PHE 1025.A N PHE 1031.A O no hydrogen 2.860 N/A ASN 1026.A N VAL 1024.A O no hydrogen 2.984 N/A SER 1029.A OG ASN 1026.A OD1 no hydrogen 2.345 N/A TRP 1030.A N PHE 1025.A O no hydrogen 3.228 N/A PHE 1031.A N PHE 1025.A O no hydrogen 3.371 N/A THR 1033.A N PHE 1023.A O no hydrogen 3.291 N/A THR 1033.A OG1 GLN 1034.A O no hydrogen 3.315 N/A SER 1039.A OG PHE 1038.A O no hydrogen 2.774 N/A GLN 1041.A NE2 ILE 1032.A O no hydrogen 2.830 N/A GLN 1041.A NE2 SER 1039.A O no hydrogen 2.767 N/A ASP 1046.A N THR 1044.A OG1 no hydrogen 3.020 N/A ASN 1047.A N THR 1044.A OG1 no hydrogen 3.355 N/A ASN 1047.A ND2 ILE 1042.A O no hydrogen 3.097 N/A THR 1048.A N THR 1045.A O no hydrogen 3.387 N/A THR 1048.A OG1 PHE 1017.A O no hydrogen 2.922 N/A THR 1048.A OG1 PHE 1049.A O no hydrogen 3.507 N/A PHE 1049.A N PHE 1017.A O no hydrogen 3.223 N/A SER 1051.A N ALA 1015.A O no hydrogen 2.892 N/A THR 1064.A N HIS 1011.A ND1 no hydrogen 3.011 N/A