Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7rqs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH2 GLU 119.A OE2 no hydrogen 3.522 N/A SER 4.A OG PHE 41.A O no hydrogen 2.626 N/A SER 4.A OG THR 43.A O no hydrogen 2.933 N/A THR 5.A N ASN 2.A O no hydrogen 3.073 N/A THR 5.A OG1 ARG 3.A O no hydrogen 3.156 N/A VAL 6.A N VAL 39.A O no hydrogen 3.115 N/A ILE 8.A N ALA 37.A O no hydrogen 2.626 N/A SER 9.A N ARG 67.A O no hydrogen 2.630 N/A SER 9.A OG ASN 10.A OD1 no hydrogen 3.536 N/A SER 9.A OG ARG 67.A O no hydrogen 3.272 N/A LEU 20.A N VAL 16.A O no hydrogen 2.992 N/A LEU 21.A N ALA 17.A O no hydrogen 3.221 N/A ARG 22.A N ASP 18.A O no hydrogen 3.237 N/A PHE 23.A N GLU 19.A O no hydrogen 2.711 N/A LEU 24.A N LEU 20.A O no hydrogen 2.602 N/A GLU 25.A N LEU 21.A O no hydrogen 2.805 N/A GLU 25.A N ARG 22.A O no hydrogen 3.211 N/A HIS 27.A N LEU 24.A O no hydrogen 2.964 N/A LEU 28.A N LEU 24.A O no hydrogen 2.425 N/A THR 32.A OG1 GLY 29.A O no hydrogen 3.104 N/A PHE 34.A N GLN 40.A O no hydrogen 2.587 N/A ALA 35.A N GLN 40.A O no hydrogen 2.838 N/A LEU 36.A N PHE 186.A O no hydrogen 3.329 N/A VAL 39.A N VAL 6.A O no hydrogen 3.229 N/A GLN 40.A N ALA 35.A O no hydrogen 2.869 N/A PHE 41.A N SER 4.A O no hydrogen 2.678 N/A THR 42.A N THR 32.A O no hydrogen 2.851 N/A THR 43.A OG1 GLU 45.A OE2 no hydrogen 2.866 N/A LYS 47.A N LEU 44.A O no hydrogen 3.148 N/A LYS 47.A NZ ASN 2.A OD1 no hydrogen 3.195 N/A SER 48.A OG GLU 45.A O no hydrogen 2.884 N/A ALA 50.A N VAL 46.A O no hydrogen 2.753 N/A GLN 51.A N LYS 47.A O no hydrogen 2.578 N/A GLN 51.A NE2 LEU 68.A O no hydrogen 3.547 N/A LEU 52.A N SER 48.A O no hydrogen 2.926 N/A LEU 53.A N ARG 49.A O no hydrogen 2.970 N/A SER 54.A N ALA 50.A O no hydrogen 2.913 N/A SER 54.A OG GLN 51.A O no hydrogen 2.360 N/A SER 55.A N GLN 51.A O no hydrogen 3.464 N/A SER 55.A OG LEU 52.A O no hydrogen 2.563 N/A GLN 56.A N LEU 52.A O no hydrogen 3.374 N/A SER 57.A N SER 54.A O no hydrogen 3.096 N/A SER 57.A OG ASN 65.A OD1 no hydrogen 2.540 N/A HIS 64.A ND1 LYS 62.A O no hydrogen 2.955 N/A ARG 67.A N SER 9.A OG no hydrogen 2.548 N/A ARG 67.A NH1 SER 55.A O no hydrogen 3.318 N/A SER 69.A N LYS 7.A O no hydrogen 2.545 N/A ILE 76.A N ASP 74.A OD1 no hydrogen 2.900 N/A LYS 84.A N ASP 81.A O no hydrogen 3.172 N/A ARG 85.A N PRO 82.A O no hydrogen 3.221 N/A ILE 89.A N VAL 112.A O no hydrogen 3.141 N/A LEU 91.A N TRP 109.A O no hydrogen 2.880 N/A THR 92.A N CYS 214.A O no hydrogen 3.044 N/A THR 92.A OG1 TYR 242.A OH no hydrogen 3.177 N/A GLY 94.A N CYS 212.A O no hydrogen 3.249 N/A SER 98.A OG GLU 97.A O no hydrogen 2.825 N/A PHE 103.A N THR 241.A O no hydrogen 2.802 N/A CYS 104.A N PHE 95.A O no hydrogen 3.067 N/A LEU 106.A N VAL 93.A O no hydrogen 2.836 N/A TRP 109.A N LEU 91.A O no hydrogen 2.962 N/A GLY 111.A N ASP 110.A OD1 no hydrogen 2.835 N/A VAL 112.A N ILE 89.A O no hydrogen 2.836 N/A ARG 113.A N TRP 126.A O no hydrogen 3.189 N/A ARG 113.A NE ASP 87.A OD1 no hydrogen 3.113 N/A CYS 114.A N LEU 86.A O no hydrogen 2.717 N/A TRP 115.A N GLU 124.A O no hydrogen 2.836 N/A ILE 116.A N LYS 84.A O no hydrogen 2.940 N/A LEU 117.A N TRP 115.A O no hydrogen 3.048 N/A THR 118.A OG1 ILE 116.A O no hydrogen 3.493 N/A GLU 124.A N TRP 115.A O no hydrogen 3.026 N/A PHE 125.A N ILE 136.A O no hydrogen 2.759 N/A TRP 126.A N ARG 113.A O no hydrogen 2.954 N/A TRP 126.A NE1 GLU 124.A OE1 no hydrogen 3.123 N/A VAL 127.A N TYR 134.A O no hydrogen 2.976 N/A ASP 132.A N GLU 129.A O no hydrogen 3.418 N/A TYR 134.A N VAL 127.A O no hydrogen 2.712 N/A ILE 136.A N PHE 125.A O no hydrogen 2.552 N/A GLU 137.A N LYS 170.A O no hydrogen 3.314 N/A VAL 138.A N VAL 123.A O no hydrogen 2.670 N/A ARG 139.A NH1 ASP 393.A OD2 no hydrogen 3.056 N/A ARG 139.A NH2 GLU 141.A OE1 no hydrogen 2.892 N/A ASP 142.A N ARG 139.A O no hydrogen 3.265 N/A ILE 143.A N PHE 140.A O no hydrogen 3.172 N/A ILE 144.A N LYS 164.A O no hydrogen 2.775 N/A GLU 145.A N LYS 164.A O no hydrogen 3.316 N/A THR 146.A N TYR 232.A O no hydrogen 3.058 N/A LEU 147.A N LEU 162.A O no hydrogen 2.685 N/A CYS 149.A N ALA 160.A O no hydrogen 2.421 N/A CYS 150.A N LEU 238.A O no hydrogen 2.905 N/A CYS 150.A SG ASN 152.A O no hydrogen 3.379 N/A CYS 150.A SG GLY 153.A O no hydrogen 3.093 N/A CYS 150.A SG SER 156.A O no hydrogen 4.039 N/A CYS 150.A SG GLU 157.A O no hydrogen 3.259 N/A ASP 159.A N CYS 149.A O no hydrogen 3.108 N/A ALA 160.A N CYS 149.A O no hydrogen 2.972 N/A PHE 161.A N LEU 215.A O no hydrogen 2.678 N/A LEU 162.A N LEU 147.A O no hydrogen 2.712 N/A LEU 163.A N PHE 213.A O no hydrogen 2.391 N/A LYS 164.A N GLU 145.A O no hydrogen 2.568 N/A LEU 165.A N THR 211.A O no hydrogen 3.128 N/A LYS 166.A N ASP 142.A OD1 no hydrogen 2.981 N/A LYS 166.A NZ GLU 141.A O no hydrogen 3.008 N/A LYS 166.A NZ GLU 141.A OE1 no hydrogen 3.023 N/A LYS 166.A NZ GLU 141.A OE2 no hydrogen 2.953 N/A TYR 167.A N ASP 142.A OD1 no hydrogen 2.485 N/A LYS 170.A N GLU 137.A O no hydrogen 3.363 N/A PHE 172.A N LYS 135.A O no hydrogen 3.179 N/A LYS 184.A NZ ILE 15.A O no hydrogen 3.101 N/A LYS 188.A NZ ASP 31.A OD1 no hydrogen 2.642 N/A LYS 188.A NZ VAL 33.A O no hydrogen 3.516 N/A THR 198.A N VAL 171.A O no hydrogen 2.786 N/A THR 198.A OG1 ILE 196.A O no hydrogen 2.811 N/A SER 202.A OG SER 206.A OG no hydrogen 3.377 N/A LYS 205.A N SER 202.A O no hydrogen 2.952 N/A SER 206.A N SER 202.A OG no hydrogen 2.978 N/A SER 206.A OG GLU 107.A OE1 no hydrogen 2.993 N/A THR 209.A OG1 LYS 205.A O no hydrogen 2.968 N/A THR 209.A OG1 PRO 256.A O no hydrogen 2.694 N/A SER 210.A N SER 206.A O no hydrogen 2.598 N/A SER 210.A OG SER 206.A O no hydrogen 2.845 N/A SER 210.A OG ILE 207.A O no hydrogen 2.890 N/A THR 211.A N GLY 94.A O no hydrogen 3.322 N/A THR 211.A OG1 LEU 165.A O no hydrogen 3.260 N/A CYS 212.A SG THR 211.A O no hydrogen 3.311 N/A PHE 213.A N LEU 163.A O no hydrogen 2.698 N/A CYS 214.A N THR 92.A O no hydrogen 2.879 N/A CYS 214.A SG PHE 161.A O no hydrogen 4.031 N/A CYS 214.A SG TYR 242.A OH no hydrogen 3.056 N/A LEU 215.A N PHE 161.A O no hydrogen 2.377 N/A GLU 216.A N VAL 90.A O no hydrogen 2.891 N/A HIS 218.A ND1 ASN 219.A OD1 no hydrogen 2.562 N/A THR 237.A OG1 SER 148.A O no hydrogen 2.946 N/A LEU 238.A N SER 148.A O no hydrogen 3.362 N/A LEU 240.A N CYS 150.A O no hydrogen 2.903 N/A THR 241.A N LYS 101.A O no hydrogen 2.756 N/A VAL 243.A N PHE 103.A O no hydrogen 3.052 N/A LYS 246.A N ASP 244.A OD2 no hydrogen 3.392 N/A PHE 248.A N GLY 245.A O no hydrogen 3.160 N/A ALA 249.A N LYS 246.A O no hydrogen 3.450 N/A SER 250.A N SER 204.A O no hydrogen 3.148 N/A ILE 271.A N PHE 267.A O no hydrogen 3.174 N/A PHE 273.A N PRO 268.A O no hydrogen 2.736 N/A GLN 274.A N ILE 271.A O no hydrogen 2.914 N/A LEU 275.A N ILE 271.A O no hydrogen 2.343 N/A ASN 276.A N LEU 272.A O no hydrogen 3.258 N/A ASN 276.A ND2 LEU 272.A O no hydrogen 3.106 N/A LEU 278.A N GLN 274.A O no hydrogen 2.878 N/A VAL 279.A N LEU 275.A O no hydrogen 2.922 N/A HIS 280.A N ASN 276.A O no hydrogen 2.901 N/A ALA 281.A N ALA 277.A O no hydrogen 2.881 N/A GLN 282.A N VAL 279.A O no hydrogen 3.053 N/A GLN 282.A NE2 LEU 165.A O no hydrogen 3.000 N/A LYS 283.A N LEU 278.A O no hydrogen 2.971 N/A LYS 283.A NZ ALA 281.A O no hydrogen 2.376 N/A ALA 288.A N SER 285.A OG no hydrogen 3.170 N/A ALA 289.A N SER 285.A O no hydrogen 3.347 N/A ALA 289.A N LEU 286.A O no hydrogen 3.390 N/A SER 290.A N LEU 286.A O no hydrogen 2.876 N/A ASP 291.A N PHE 287.A O no hydrogen 3.152 N/A ILE 295.A N ASP 291.A O no hydrogen 3.338 N/A LYS 296.A N MET 292.A O no hydrogen 2.890 N/A ILE 297.A N GLU 293.A O no hydrogen 2.927 N/A LEU 298.A N LEU 294.A O no hydrogen 2.874 N/A ARG 299.A N ILE 295.A O no hydrogen 2.918 N/A GLY 300.A N ILE 297.A O no hydrogen 2.881 N/A SER 302.A OG GLU 304.A OE1 no hydrogen 2.412 N/A GLU 304.A N GLU 304.A OE1 no hydrogen 2.727 N/A THR 305.A OG1 SER 302.A O no hydrogen 3.184 N/A ALA 306.A N SER 302.A O no hydrogen 3.279 N/A LEU 307.A N LEU 303.A O no hydrogen 2.875 N/A VAL 308.A N GLU 304.A O no hydrogen 2.945 N/A ILE 309.A N THR 305.A O no hydrogen 2.899 N/A LEU 310.A N ALA 306.A O no hydrogen 2.905 N/A LYS 311.A N LEU 307.A O no hydrogen 2.904 N/A LYS 312.A N VAL 308.A O no hydrogen 2.942 N/A LEU 313.A N ILE 309.A O no hydrogen 2.894 N/A HIS 314.A N LEU 310.A O no hydrogen 2.887 N/A GLN 315.A N LYS 311.A O no hydrogen 2.934 N/A GLN 316.A N LEU 313.A O no hydrogen 3.091 N/A CYS 320.A N LYS 283.A O no hydrogen 2.543 N/A PHE 325.A N ASP 322.A OD1 no hydrogen 3.225 N/A PHE 326.A N ASP 322.A O no hydrogen 3.413 N/A VAL 327.A N PRO 323.A O no hydrogen 2.880 N/A LYS 328.A N VAL 324.A O no hydrogen 2.887 N/A THR 329.A N PHE 325.A O no hydrogen 2.885 N/A THR 329.A OG1 PHE 325.A O no hydrogen 2.686 N/A GLN 330.A N PHE 326.A O no hydrogen 2.930 N/A MET 331.A N LYS 328.A O no hydrogen 3.399 N/A GLN 332.A N LYS 328.A O no hydrogen 2.893 N/A SER 333.A OG THR 329.A O no hydrogen 2.291 N/A GLU 344.A N ARG 341.A O no hydrogen 3.122 N/A GLN 345.A N ARG 341.A O no hydrogen 2.682 N/A ASN 346.A N LEU 342.A O no hydrogen 2.939 N/A MET 348.A N GLU 368.A O no hydrogen 2.452 N/A ARG 352.A NE GLU 366.A OE2 no hydrogen 2.357 N/A ARG 352.A NH2 GLU 368.A OE1 no hydrogen 2.458 N/A ALA 353.A N ARG 386.A O no hydrogen 2.665 N/A TYR 354.A N TYR 361.A O no hydrogen 3.003 N/A VAL 355.A N THR 388.A O no hydrogen 2.765 N/A THR 356.A OG1 GLU 392.A OE1 no hydrogen 3.277 N/A SER 358.A N THR 356.A OG1 no hydrogen 3.340 N/A SER 358.A OG ASP 200.A OD1 no hydrogen 3.224 N/A SER 358.A OG GLU 392.A OE2 no hydrogen 2.356 N/A LEU 362.A N HIS 280.A ND1 no hydrogen 3.425 N/A LEU 363.A N ARG 352.A O no hydrogen 3.132 N/A GLU 366.A N CYS 350.A O no hydrogen 3.111 N/A GLU 368.A N MET 348.A O no hydrogen 2.840 N/A ALA 370.A N ASN 346.A O no hydrogen 2.749 N/A VAL 374.A N ASN 371.A OD1 no hydrogen 3.195 N/A LYS 375.A N ASN 371.A O no hydrogen 2.615 N/A ASN 376.A N TYR 372.A O no hydrogen 2.942 N/A PHE 377.A N VAL 373.A O no hydrogen 2.914 N/A HIS 380.A N PHE 377.A O no hydrogen 2.681 N/A ASP 383.A N HIS 380.A O no hydrogen 3.096 N/A PHE 384.A N VAL 381.A O no hydrogen 3.387 N/A ARG 386.A NE GLU 368.A OE2 no hydrogen 3.185 N/A ARG 386.A NH2 GLU 368.A OE2 no hydrogen 2.846 N/A VAL 387.A N VAL 450.A O no hydrogen 2.561 N/A THR 388.A N ALA 353.A O no hydrogen 2.957 N/A PHE 389.A N ASN 448.A O no hydrogen 2.665 N/A VAL 390.A N VAL 355.A O no hydrogen 3.017 N/A SER 395.A N ASP 393.A OD1 no hydrogen 3.060 N/A ALA 401.A N PRO 398.A O no hydrogen 3.090 N/A SER 403.A N ALA 399.A O no hydrogen 3.053 N/A SER 403.A OG ASN 405.A OD1 no hydrogen 3.259 N/A ASN 405.A N SER 403.A OG no hydrogen 3.255 N/A THR 414.A N LEU 402.A O no hydrogen 3.406 N/A THR 414.A OG1 ALA 401.A O no hydrogen 2.255 N/A TYR 417.A N THR 414.A O no hydrogen 2.888 N/A ASN 418.A N THR 414.A O no hydrogen 3.415 N/A ARG 419.A N ASN 415.A O no hydrogen 2.890 N/A ARG 419.A NH1 THR 356.A O no hydrogen 2.327 N/A ARG 419.A NH2 LYS 359.A O no hydrogen 3.186 N/A VAL 420.A N ILE 416.A O no hydrogen 2.870 N/A LEU 421.A N TYR 417.A O no hydrogen 2.929 N/A SER 422.A N ASN 418.A O no hydrogen 2.882 N/A SER 422.A OG GLU 426.A OE2 no hydrogen 2.617 N/A ILE 423.A N ARG 419.A O no hydrogen 2.847 N/A LEU 424.A N VAL 420.A O no hydrogen 2.915 N/A GLY 425.A N LEU 421.A O no hydrogen 2.923 N/A GLU 426.A N SER 422.A O no hydrogen 2.868 N/A ILE 428.A N PHE 435.A O no hydrogen 3.092 N/A VAL 430.A N LYS 433.A O no hydrogen 3.111 N/A LYS 433.A N VAL 430.A O no hydrogen 3.271 N/A ARG 434.A NE GLU 426.A O no hydrogen 2.908 N/A ARG 434.A NH1 GLU 436.A OE2 no hydrogen 2.495 N/A ARG 434.A NH2 GLU 426.A O no hydrogen 3.028 N/A ARG 434.A NH2 GLU 436.A OE2 no hydrogen 2.762 N/A PHE 435.A N ILE 428.A O no hydrogen 2.672 N/A GLU 436.A N PHE 453.A O no hydrogen 2.610 N/A LEU 438.A N TRP 451.A O no hydrogen 3.098 N/A SER 441.A N GLN 444.A OE1 no hydrogen 2.779 N/A GLN 444.A NE2 SER 449.A O no hydrogen 3.553 N/A LEU 445.A N SER 441.A O no hydrogen 2.616 N/A ARG 446.A N ALA 442.A O no hydrogen 2.929 N/A ARG 446.A NH1 TYR 845.A OH no hydrogen 3.527 N/A GLY 447.A N SER 443.A O no hydrogen 2.893 N/A ASN 448.A N LEU 445.A O no hydrogen 3.221 N/A SER 449.A N GLN 444.A O no hydrogen 3.101 N/A SER 449.A OG GLN 444.A O no hydrogen 2.994 N/A VAL 450.A N VAL 387.A O no hydrogen 2.442 N/A TRP 451.A N ALA 439.A O no hydrogen 3.304 N/A MET 452.A N MET 385.A O no hydrogen 2.708 N/A PHE 453.A N GLU 436.A O no hydrogen 2.687 N/A ALA 454.A N ASP 383.A OD2 no hydrogen 2.627 N/A GLU 457.A N GLU 457.A OE1 no hydrogen 2.855 N/A LYS 460.A N ASP 463.A OD2 no hydrogen 3.460 N/A ASP 463.A N LYS 460.A O no hydrogen 3.261 N/A GLU 466.A N GLU 462.A O no hydrogen 3.357 N/A TRP 467.A N ASP 463.A O no hydrogen 2.906 N/A MET 468.A N ILE 464.A O no hydrogen 2.916 N/A GLY 469.A N GLU 466.A O no hydrogen 3.429 N/A CYS 470.A N ARG 465.A O no hydrogen 3.466 N/A ARG 475.A NH1 MET 829.A O no hydrogen 3.445 N/A ARG 475.A NH1 ASP 830.A O no hydrogen 2.557 N/A SER 476.A OG PRO 826.A O no hydrogen 3.070 N/A SER 478.A OG ALA 888.A O no hydrogen 3.143 N/A CYS 480.A N SER 476.A O no hydrogen 3.159 N/A ALA 481.A N ILE 477.A O no hydrogen 2.890 N/A ALA 482.A N SER 478.A O no hydrogen 2.910 N/A ARG 483.A N LYS 479.A O no hydrogen 2.875 N/A MET 484.A N CYS 480.A O no hydrogen 2.901 N/A GLY 485.A N ALA 481.A O no hydrogen 2.914 N/A GLN 486.A N ALA 482.A O no hydrogen 2.890 N/A PHE 488.A N GLY 485.A O no hydrogen 3.350 N/A SER 491.A OG ARG 492.A O no hydrogen 3.510 N/A ARG 492.A N VAL 586.A O no hydrogen 3.120 N/A THR 494.A N LEU 584.A O no hydrogen 2.727 N/A VAL 497.A N ARG 582.A O no hydrogen 2.798 N/A ASP 501.A N ARG 498.A O no hydrogen 3.185 N/A VAL 510.A N TYR 517.A O no hydrogen 3.072 N/A THR 511.A OG1 ASP 516.A OD1 no hydrogen 3.033 N/A THR 511.A OG1 ASP 516.A OD2 no hydrogen 3.105 N/A THR 512.A OG1 GLU 785.A O no hydrogen 2.401 N/A ALA 515.A N ASP 513.A O no hydrogen 2.807 N/A CYS 518.A SG ILE 508.A O no hydrogen 3.215 N/A CYS 518.A SG SER 520.A O no hydrogen 3.238 N/A CYS 518.A SG ASP 521.A OD1 no hydrogen 3.579 N/A PHE 519.A N ILE 508.A O no hydrogen 2.984 N/A SER 520.A OG SER 520.A O no hydrogen 2.575 N/A GLY 524.A N VAL 557.A O no hydrogen 3.380 N/A ILE 526.A N ALA 559.A O no hydrogen 2.594 N/A ALA 531.A N SER 527.A O no hydrogen 2.729 N/A LYS 532.A N LEU 528.A O no hydrogen 2.902 N/A GLN 533.A N ALA 529.A O no hydrogen 2.919 N/A VAL 534.A N PHE 530.A O no hydrogen 2.906 N/A ALA 535.A N ALA 531.A O no hydrogen 2.876 N/A GLN 536.A N LYS 532.A O no hydrogen 2.979 N/A LYS 537.A N GLN 533.A O no hydrogen 2.917 N/A CYS 538.A N VAL 534.A O no hydrogen 2.871 N/A GLY 539.A N ALA 535.A O no hydrogen 3.031 N/A LEU 540.A N ALA 535.A O no hydrogen 2.864 N/A SER 545.A N THR 590.A OG1 no hydrogen 3.145 N/A PHE 547.A N ILE 558.A O no hydrogen 2.750 N/A GLN 548.A N ARG 588.A O no hydrogen 2.790 N/A ILE 549.A N GLY 556.A O no hydrogen 2.755 N/A TYR 554.A N TYR 551.A O no hydrogen 3.374 N/A GLY 556.A N ILE 549.A O no hydrogen 3.498 N/A VAL 557.A N GLY 522.A O no hydrogen 2.947 N/A ILE 558.A N PHE 547.A O no hydrogen 2.696 N/A ALA 559.A N GLY 524.A O no hydrogen 2.680 N/A VAL 560.A N SER 545.A O no hydrogen 2.984 N/A ASP 561.A N ILE 526.A O no hydrogen 2.802 N/A SER 563.A N ASP 561.A OD1 no hydrogen 2.956 N/A ARG 566.A N SER 564.A OG no hydrogen 3.133 N/A SER 573.A OG SER 520.A O no hydrogen 2.507 N/A SER 573.A OG ASP 521.A O no hydrogen 2.552 N/A PHE 577.A N GLY 553.A O no hydrogen 2.992 N/A ASN 581.A N SER 579.A OG no hydrogen 3.228 N/A LEU 584.A N LEU 495.A O no hydrogen 3.455 N/A THR 587.A N GLN 548.A O no hydrogen 2.942 N/A ARG 588.A NH2 GLY 799.A O no hydrogen 2.938 N/A SER 592.A OG THR 717.A OG1 no hydrogen 3.232 N/A CYS 595.A SG VAL 804.A O no hydrogen 3.889 N/A LEU 597.A N ILE 689.A O no hydrogen 3.379 N/A ASN 598.A ND2 ASN 750.A OD1 no hydrogen 3.329 N/A ARG 599.A NE SER 685.A O no hydrogen 2.926 N/A ARG 599.A NH2 SER 685.A O no hydrogen 2.805 N/A ILE 602.A N ASN 598.A O no hydrogen 3.006 N/A CYS 603.A N ARG 599.A O no hydrogen 2.897 N/A LEU 604.A N GLU 600.A O no hydrogen 2.919 N/A LEU 605.A N ILE 601.A O no hydrogen 2.896 N/A SER 606.A N ILE 602.A O no hydrogen 2.910 N/A SER 606.A OG ILE 602.A O no hydrogen 3.386 N/A SER 606.A OG CYS 603.A O no hydrogen 2.754 N/A THR 607.A N CYS 603.A O no hydrogen 2.904 N/A LEU 608.A N LEU 604.A O no hydrogen 2.959 N/A GLY 609.A N SER 606.A O no hydrogen 3.311 N/A ILE 610.A N LEU 605.A O no hydrogen 3.100 N/A MET 614.A N GLU 611.A O no hydrogen 3.139 N/A ALA 617.A N MET 614.A O no hydrogen 3.349 N/A GLN 619.A N PHE 615.A O no hydrogen 3.024 N/A GLN 619.A NE2 LEU 926.A O no hydrogen 3.388 N/A ALA 620.A N GLU 616.A O no hydrogen 2.859 N/A VAL 621.A N ALA 617.A O no hydrogen 2.940 N/A HIS 622.A N MET 618.A O no hydrogen 2.916 N/A LEU 623.A N GLN 619.A O no hydrogen 2.822 N/A SER 624.A N ALA 620.A O no hydrogen 2.865 N/A MET 625.A N VAL 621.A O no hydrogen 2.937 N/A LEU 626.A N HIS 622.A O no hydrogen 2.902 N/A GLY 627.A N LEU 623.A O no hydrogen 2.857 N/A ALA 636.A N ARG 633.A O no hydrogen 2.992 N/A ASN 638.A ND2 ASP 634.A O no hydrogen 3.238 N/A ASN 638.A ND2 ASP 634.A OD2 no hydrogen 2.780 N/A LYS 642.A NZ ASN 638.A O no hydrogen 2.593 N/A SER 644.A N VAL 639.A O no hydrogen 2.977 N/A SER 644.A OG LEU 640.A O no hydrogen 2.394 N/A ASN 650.A N ASN 647.A O no hydrogen 3.372 N/A LYS 654.A N ASN 650.A O no hydrogen 3.360 N/A LYS 654.A NZ SER 648.A O no hydrogen 2.213 N/A MET 655.A N LEU 651.A O no hydrogen 2.920 N/A LEU 656.A N LEU 652.A O no hydrogen 2.871 N/A LEU 657.A N VAL 653.A O no hydrogen 2.879 N/A GLN 658.A N LYS 654.A O no hydrogen 3.359 N/A GLN 658.A NE2 LYS 654.A O no hydrogen 3.445 N/A SER 663.A OG LEU 630.A O no hydrogen 2.970 N/A SER 664.A N ALA 661.A O no hydrogen 3.149 N/A SER 664.A OG ALA 661.A O no hydrogen 3.564 N/A SER 669.A N GLU 665.A O no hydrogen 2.741 N/A MET 670.A N PRO 666.A O no hydrogen 2.890 N/A MET 671.A N TYR 667.A O no hydrogen 2.963 N/A LEU 672.A N LEU 668.A O no hydrogen 2.886 N/A ARG 673.A N SER 669.A O no hydrogen 2.865 N/A VAL 674.A N MET 670.A O no hydrogen 2.924 N/A HIS 675.A N MET 671.A O no hydrogen 2.943 N/A HIS 676.A N LEU 672.A O no hydrogen 2.846 N/A GLU 677.A N ARG 673.A O no hydrogen 2.909 N/A SER 678.A N VAL 674.A O no hydrogen 2.912 N/A GLN 679.A N HIS 675.A O no hydrogen 2.878 N/A LEU 680.A N HIS 676.A O no hydrogen 2.913 N/A SER 681.A N GLU 677.A O no hydrogen 2.910 N/A GLU 682.A N SER 678.A O no hydrogen 2.898 N/A LEU 683.A N GLN 679.A O no hydrogen 2.890 N/A LYS 684.A N LEU 680.A O no hydrogen 2.903 N/A SER 685.A N SER 681.A O no hydrogen 2.919 N/A ARG 686.A N GLU 682.A O no hydrogen 2.519 N/A CYS 687.A SG LEU 683.A O no hydrogen 3.795 N/A ARG 688.A N ARG 686.A O no hydrogen 2.473 N/A ARG 695.A NH1 PRO 692.A O no hydrogen 3.186 N/A ARG 695.A NH1 GLY 694.A O no hydrogen 3.182 N/A LEU 697.A N PHE 802.A O no hydrogen 3.002 N/A GLY 699.A N ASP 800.A O no hydrogen 2.921 N/A CYS 700.A N ILE 778.A O no hydrogen 2.813 N/A CYS 700.A SG ILE 698.A O no hydrogen 3.293 N/A ILE 706.A N MET 704.A O no hydrogen 2.974 N/A GLU 708.A N GLN 711.A OE1 no hydrogen 3.279 N/A TYR 709.A OH GLU 791.A OE2 no hydrogen 3.429 N/A GLY 710.A N HIS 788.A NE2 no hydrogen 2.967 N/A GLN 711.A N GLU 708.A O no hydrogen 3.154 N/A VAL 712.A N ASP 762.A O no hydrogen 2.702 N/A TYR 713.A N ILE 779.A O no hydrogen 3.247 N/A ARG 715.A NH2 THR 738.A OG1 no hydrogen 3.088 N/A VAL 716.A N SER 739.A O no hydrogen 3.139 N/A THR 717.A N ASP 776.A OD1 no hydrogen 3.105 N/A THR 717.A OG1 ASP 776.A OD1 no hydrogen 3.117 N/A THR 717.A OG1 ASP 776.A OD2 no hydrogen 2.914 N/A LEU 718.A N GLU 737.A O no hydrogen 3.018 N/A LEU 723.A N THR 719.A O no hydrogen 2.653 N/A LYS 724.A N LYS 720.A O no hydrogen 2.915 N/A SER 725.A N ALA 721.A O no hydrogen 3.414 N/A SER 725.A OG ALA 721.A O no hydrogen 3.430 N/A SER 725.A OG SER 725.A O no hydrogen 2.543 N/A GLN 728.A NE2 SER 725.A O no hydrogen 2.375 N/A PHE 731.A N GLN 728.A O no hydrogen 3.473 N/A ARG 732.A N VAL 740.A O no hydrogen 2.965 N/A ASP 735.A N THR 738.A O no hydrogen 3.399 N/A GLU 736.A N ASP 735.A OD1 no hydrogen 2.596 N/A SER 739.A N VAL 716.A O no hydrogen 3.263 N/A SER 739.A OG THR 738.A O no hydrogen 2.762 N/A VAL 740.A N ARG 732.A O no hydrogen 3.083 N/A VAL 741.A N VAL 714.A O no hydrogen 3.039 N/A ILE 742.A N TYR 730.A O no hydrogen 2.789 N/A VAL 745.A N LEU 761.A O no hydrogen 2.985 N/A VAL 746.A N SER 805.A O no hydrogen 3.431 N/A VAL 747.A N ARG 759.A O no hydrogen 2.877 N/A THR 748.A N PHE 803.A O no hydrogen 3.299 N/A THR 748.A OG1 ASP 757.A OD1 no hydrogen 3.323 N/A CYS 752.A SG THR 748.A OG1 no hydrogen 2.815 N/A CYS 752.A SG ASP 757.A OD1 no hydrogen 3.251 N/A CYS 752.A SG ASP 757.A OD2 no hydrogen 3.918 N/A ASP 757.A N HIS 754.A O no hydrogen 3.266 N/A ARG 759.A N VAL 747.A O no hydrogen 2.977 N/A ASP 762.A N GLY 710.A O no hydrogen 2.804 N/A ALA 763.A N GLY 743.A O no hydrogen 3.365 N/A ILE 764.A N VAL 712.A O no hydrogen 2.947 N/A HIS 768.A ND1 GLU 771.A OE1 no hydrogen 2.703 N/A GLU 770.A N GLU 770.A OE1 no hydrogen 3.079 N/A LYS 772.A N HIS 768.A O no hydrogen 2.838 N/A GLY 773.A N PHE 769.A O no hydrogen 2.649 N/A ASP 776.A N ARG 715.A O no hydrogen 2.912 N/A CYS 777.A SG SER 545.A OG no hydrogen 3.214 N/A CYS 777.A SG LEU 775.A O no hydrogen 3.674 N/A ILE 778.A N ILE 698.A O no hydrogen 3.276 N/A ILE 779.A N TYR 713.A O no hydrogen 2.818 N/A PHE 780.A N CYS 700.A O no hydrogen 2.595 N/A LYS 783.A NZ GLY 705.A O no hydrogen 2.804 N/A ARG 786.A NH1 ALA 515.A O no hydrogen 3.008 N/A ARG 786.A NH2 ASP 820.A O no hydrogen 3.528 N/A ASN 790.A N PRO 787.A O no hydrogen 3.126 N/A GLU 791.A N HIS 788.A O no hydrogen 2.898 N/A CYS 792.A SG VAL 747.A O no hydrogen 3.795 N/A CYS 792.A SG ASP 757.A O no hydrogen 3.846 N/A CYS 792.A SG HIS 788.A O no hydrogen 3.863 N/A GLY 795.A N CYS 792.A O no hydrogen 2.906 N/A ASP 796.A N ASP 800.A OD2 no hydrogen 3.370 N/A PHE 802.A N LEU 697.A O no hydrogen 2.651 N/A PHE 803.A N THR 748.A O no hydrogen 2.623 N/A GLU 808.A N GLU 808.A OE1 no hydrogen 2.735 N/A ARG 827.A NH1 ARG 825.A O no hydrogen 3.121 N/A ILE 838.A N THR 834.A O no hydrogen 3.270 N/A HIS 839.A N LEU 835.A O no hydrogen 2.943 N/A LYS 840.A N GLU 836.A O no hydrogen 2.894 N/A LYS 840.A NZ ASP 844.A OD2 no hydrogen 2.657 N/A PHE 841.A N GLU 837.A O no hydrogen 2.886 N/A PHE 842.A N ILE 838.A O no hydrogen 2.905 N/A VAL 843.A N HIS 839.A O no hydrogen 2.951 N/A ASP 844.A N LYS 840.A O no hydrogen 2.828 N/A TYR 845.A N PHE 841.A O no hydrogen 2.936 N/A MET 846.A N PHE 842.A O no hydrogen 2.924 N/A ILE 847.A N VAL 843.A O no hydrogen 2.939 N/A SER 848.A N ASP 844.A O no hydrogen 2.879 N/A SER 848.A OG TYR 845.A O no hydrogen 2.866 N/A ASP 849.A N ALA 894.A O no hydrogen 2.816 N/A SER 855.A N LEU 851.A O no hydrogen 2.895 N/A SER 855.A OG GLU 600.A OE2 no hydrogen 2.352 N/A THR 856.A N GLY 852.A O no hydrogen 2.909 N/A ALA 857.A N VAL 853.A O no hydrogen 2.875 N/A HIS 858.A N ILE 854.A O no hydrogen 2.909 N/A LEU 859.A N SER 855.A O no hydrogen 2.925 N/A VAL 860.A N THR 856.A O no hydrogen 2.897 N/A HIS 861.A N ALA 857.A O no hydrogen 2.907 N/A ALA 862.A N LEU 859.A O no hydrogen 3.165 N/A ARG 864.A NH1 GLU 904.A OE2 no hydrogen 2.331 N/A SER 871.A OG ASP 865.A OD2 no hydrogen 3.197 N/A CYS 874.A SG LYS 868.A O no hydrogen 3.728 N/A LEU 875.A N SER 871.A O no hydrogen 2.921 N/A GLU 876.A N GLN 872.A O no hydrogen 2.931 N/A LEU 877.A N LYS 873.A O no hydrogen 2.912 N/A ALA 878.A N CYS 874.A O no hydrogen 2.874 N/A ASN 879.A N LEU 875.A O no hydrogen 2.934 N/A LEU 880.A N GLU 876.A O no hydrogen 2.897 N/A HIS 881.A N LEU 877.A O no hydrogen 2.864 N/A SER 882.A N ALA 878.A O no hydrogen 2.914 N/A ARG 883.A N ASN 879.A O no hydrogen 2.923 N/A ALA 884.A N LEU 880.A O no hydrogen 2.857 N/A VAL 885.A N HIS 881.A O no hydrogen 2.905 N/A ASP 886.A N SER 882.A O no hydrogen 2.906 N/A PHE 887.A N ALA 884.A O no hydrogen 3.256 N/A LYS 889.A N ASP 886.A O no hydrogen 2.711 N/A LYS 889.A NZ ASP 886.A OD1 no hydrogen 2.944 N/A THR 890.A N ASP 886.A O no hydrogen 2.866 N/A THR 890.A OG1 ASP 886.A O no hydrogen 3.306 N/A ALA 892.A N THR 890.A O no hydrogen 2.664 N/A LEU 900.A N PRO 897.A O no hydrogen 3.118 N/A LYS 901.A N TYR 898.A O no hydrogen 3.189 N/A PHE 905.A N PRO 915.A O no hydrogen 2.770 N/A THR 916.A OG1 LYS 914.A O no hydrogen 3.197 N/A TYR 917.A N PHE 905.A O no hydrogen 3.096 N/A SER 919.A OG ASP 907.A OD1 no hydrogen 3.061 N/A SER 921.A OG ASP 863.A O no hydrogen 3.114 N/A LEU 926.A N PHE 923.A O no hydrogen 3.443 N/A ALA 929.A N LYS 925.A O no hydrogen 2.889 N/A VAL 930.A N LEU 926.A O no hydrogen 2.932 N/A LYS 931.A N TYR 927.A O no hydrogen 2.911 N/A LYS 931.A NZ TYR 927.A O no hydrogen 3.349 N/A SER 932.A N ARG 928.A O no hydrogen 2.875 N/A SER 933.A N ALA 929.A O no hydrogen 2.924 N/A LEU 934.A N VAL 930.A O no hydrogen 2.786 N/A ALA 935.A N LYS 931.A O no hydrogen 2.641 N/A GLN 936.A N GLN 936.A OE1 no hydrogen 2.884 N/A VAL 943.A N VAL 939.A O no hydrogen 2.890 N/A THR 944.A N ALA 940.A O no hydrogen 2.919 N/A LEU 945.A N TYR 941.A O no hydrogen 2.870 N/A GLU 947.A N THR 944.A O no hydrogen 3.109 N/A ALA 948.A N THR 944.A O no hydrogen 2.479 N/A HIS 960.A N THR 956.A O no hydrogen 2.905 N/A ARG 961.A N ALA 957.A O no hydrogen 2.861 N/A ASP 962.A N LYS 958.A O no hydrogen 2.922 N/A MET 963.A N HIS 960.A O no hydrogen 2.888 N/A TYR 964.A N HIS 960.A O no hydrogen 2.270 N/A GLY 965.A N HIS 960.A O no hydrogen 3.380 N/A GLU 966.A N ARG 961.A O no hydrogen 2.954 N/A LYS 967.A N MET 963.A O no hydrogen 3.234 N/A LEU 968.A N TYR 964.A O no hydrogen 2.883 N/A THR 969.A N GLY 965.A O no hydrogen 2.910 N/A SER 970.A N GLU 966.A O no hydrogen 2.886 N/A LEU 971.A N LYS 967.A O no hydrogen 2.880 N/A MET 972.A N LEU 968.A O no hydrogen 2.907 N/A ILE 973.A N THR 969.A O no hydrogen 2.877 N/A TYR 974.A N SER 970.A O no hydrogen 2.901 N/A TYR 974.A N LEU 971.A O no hydrogen 3.221 N/A GLY 1000.A N ASN 996.A O no hydrogen 2.588 N/A ASP 1001.A N ARG 997.A O no hydrogen 2.704 N/A MET 1002.A N ARG 998.A O no hydrogen 2.954 N/A LYS 1003.A N TYR 999.A O no hydrogen 3.400 N/A ARG 1005.A N ASP 1001.A O no hydrogen 2.514 N/A ILE 1006.A N MET 1002.A O no hydrogen 2.688 N/A THR 1007.A N LYS 1003.A O no hydrogen 3.310 N/A LEU 1008.A N ASP 1004.A O no hydrogen 3.057 N/A SER 1009.A N ARG 1005.A O no hydrogen 2.755 N/A VAL 1010.A N ILE 1006.A O no hydrogen 2.788 N/A LYS 1011.A N THR 1007.A O no hydrogen 2.809 N/A ASP 1012.A N LEU 1008.A O no hydrogen 2.938 N/A LEU 1013.A N SER 1009.A O no hydrogen 2.926 N/A HIS 1014.A N VAL 1010.A O no hydrogen 2.464 N/A LYS 1015.A N LYS 1011.A O no hydrogen 2.666 N/A GLU 1016.A N ASP 1012.A O no hydrogen 2.716 N/A ALA 1017.A N LEU 1013.A O no hydrogen 2.514 N/A MET 1018.A N HIS 1014.A O no hydrogen 2.607 N/A GLY 1019.A N LYS 1015.A O no hydrogen 2.477 N/A TRP 1020.A N GLU 1016.A O no hydrogen 2.571 N/A PHE 1021.A N ALA 1017.A O no hydrogen 2.791 N/A GLU 1022.A N MET 1018.A O no hydrogen 2.891 N/A LYS 1023.A N TRP 1020.A O no hydrogen 3.059 N/A GLN 1027.A N CYS 1025.A O no hydrogen 2.797 N/A LYS 1031.A N GLN 1027.A O no hydrogen 2.839 N/A LEU 1032.A N GLN 1027.A O no hydrogen 3.306 N/A SER 1034.A N LYS 1030.A O no hydrogen 2.881 N/A ALA 1035.A N LYS 1031.A O no hydrogen 2.931 N/A TRP 1036.A N LEU 1032.A O no hydrogen 2.897 N/A TYR 1037.A N ALA 1033.A O no hydrogen 2.881 N/A TYR 1038.A N SER 1034.A O no hydrogen 2.895 N/A VAL 1039.A N ALA 1035.A O no hydrogen 2.910 N/A THR 1040.A N TRP 1036.A O no hydrogen 2.891 N/A TYR 1041.A N TYR 1037.A O no hydrogen 2.889 N/A ASN 1042.A N TYR 1038.A O no hydrogen 2.904 N/A PRO 1043.A N VAL 1039.A O no hydrogen 2.855 N/A HIS 1045.A N THR 1040.A O no hydrogen 3.015 N/A GLU 1048.A N HIS 1045.A O no hydrogen 2.956 N/A TRP 1057.A N SER 1054.A O no hydrogen 2.842 N/A ILE 1058.A N SER 1054.A O no hydrogen 3.217 N/A GLY 1060.A N TRP 1057.A O no hydrogen 2.943 N/A VAL 1062.A N VAL 1059.A O no hydrogen 3.035 N/A LEU 1063.A N VAL 1059.A O no hydrogen 3.381 N/A LEU 1064.A N GLY 1060.A O no hydrogen 2.871 N/A ASP 1065.A N ASP 1061.A O no hydrogen 2.908 N/A ILE 1066.A N VAL 1062.A O no hydrogen 2.896 N/A LYS 1067.A N LEU 1063.A O no hydrogen 2.891 N/A ALA 1068.A N LEU 1064.A O no hydrogen 2.901 N/A GLU 1069.A N ASP 1065.A O no hydrogen 2.911 N/A ASN 1070.A N ILE 1066.A O no hydrogen 2.880 N/A ALA 1071.A N ALA 1068.A O no hydrogen 3.462 N/A GLN 1074.A N ASN 1070.A O no hydrogen 2.544 N/A