Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7u5c_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N GLU 1.A OE2 no hydrogen 2.626 N/A PHE 6.A N LEU 162.A O no hydrogen 2.829 N/A TYR 7.A N LYS 27.A O no hydrogen 2.320 N/A LEU 9.A N PHE 25.A O no hydrogen 2.478 N/A ASP 10.A N PHE 25.A O no hydrogen 2.890 N/A TYR 12.A N PHE 23.A O no hydrogen 2.902 N/A ASN 17.A N ASP 14.A OD2 no hydrogen 2.645 N/A ASN 17.A ND2 ASP 14.A OD2 no hydrogen 2.290 N/A VAL 22.A N VAL 43.A O no hydrogen 2.913 N/A PHE 23.A N TYR 12.A O no hydrogen 2.897 N/A LEU 24.A N VAL 41.A O no hydrogen 2.889 N/A PHE 25.A N ASP 10.A O no hydrogen 2.882 N/A LYS 27.A NZ HIS 36.A O no hydrogen 2.856 N/A VAL 28.A N VAL 37.A O no hydrogen 2.942 N/A ILE 30.A N THR 35.A O no hydrogen 2.437 N/A GLU 34.A N GLU 31.A O no hydrogen 3.114 N/A THR 35.A OG1 HIS 36.A O no hydrogen 3.462 N/A HIS 36.A N THR 35.A OG1 no hydrogen 2.569 N/A VAL 37.A N VAL 28.A O no hydrogen 2.828 N/A CYS 39.A SG CYS 40.A O no hydrogen 3.372 N/A CYS 39.A SG VAL 179.A O no hydrogen 3.266 N/A CYS 39.A SG GLU 180.A OE1 no hydrogen 3.818 N/A CYS 40.A N GLU 180.A OE1 no hydrogen 2.765 N/A CYS 40.A SG SER 175.A OG no hydrogen 2.883 N/A VAL 41.A N LEU 24.A O no hydrogen 2.907 N/A VAL 43.A N VAL 22.A O no hydrogen 2.908 N/A LYS 44.A NZ LEU 184.A O no hydrogen 3.154 N/A ASN 45.A ND2 LEU 184.A O no hydrogen 3.498 N/A THR 49.A OG1 GLU 47.A O no hydrogen 3.138 N/A LEU 50.A N VAL 118.A O no hydrogen 2.876 N/A TYR 51.A N PHE 140.A O no hydrogen 2.905 N/A PHE 52.A N LEU 116.A O no hydrogen 2.890 N/A LEU 53.A N HIS 138.A O no hydrogen 2.838 N/A ARG 55.A N THR 135.A O no hydrogen 3.207 N/A ARG 55.A NE GLY 133.A O no hydrogen 3.284 N/A ARG 55.A NE PHE 136.A O no hydrogen 2.347 N/A ASN 62.A N ASP 60.A OD2 no hydrogen 2.920 N/A THR 63.A N ASP 60.A O no hydrogen 3.239 N/A GLY 64.A N ASP 60.A O no hydrogen 2.688 N/A LYS 65.A NZ THR 63.A O no hydrogen 2.709 N/A LYS 65.A NZ THR 63.A OG1 no hydrogen 2.431 N/A THR 67.A OG1 LYS 58.A O no hydrogen 2.433 N/A THR 69.A OG1 PRO 70.A O no hydrogen 3.329 N/A ILE 71.A N GLU 56.A OE1 no hydrogen 3.208 N/A LYS 74.A N SER 72.A OG no hydrogen 2.716 N/A VAL 76.A N SER 72.A O no hydrogen 3.033 N/A TYR 77.A N MET 73.A O no hydrogen 2.934 N/A GLU 78.A N LYS 74.A O no hydrogen 2.849 N/A GLU 79.A N ASP 75.A O no hydrogen 2.944 N/A PHE 80.A N VAL 76.A O no hydrogen 2.862 N/A ASP 81.A N TYR 77.A O no hydrogen 2.908 N/A GLU 82.A N GLU 78.A O no hydrogen 2.881 N/A LYS 83.A N PHE 80.A O no hydrogen 3.153 N/A LYS 83.A NZ LYS 83.A O no hydrogen 3.323 N/A ILE 84.A N PHE 80.A O no hydrogen 2.955 N/A THR 86.A OG1 GLU 82.A O no hydrogen 2.112 N/A LYS 87.A N LYS 83.A O no hydrogen 2.958 N/A LYS 87.A N ILE 84.A O no hydrogen 2.963 N/A TYR 88.A N ILE 84.A O no hydrogen 2.289 N/A SER 95.A OG GLU 117.A O no hydrogen 2.316 N/A LYS 96.A N GLU 117.A O no hydrogen 2.918 N/A VAL 98.A N TYR 115.A O no hydrogen 2.870 N/A LYS 100.A N SER 113.A O no hydrogen 2.978 N/A LYS 100.A NZ ASN 456.A OD1 no hydrogen 2.334 N/A ASN 101.A ND2 ASN 455.A O no hydrogen 3.201 N/A ILE 106.A N PHE 104.A O no hydrogen 2.988 N/A SER 113.A N LYS 100.A O no hydrogen 2.967 N/A SER 113.A OG GLU 114.A O no hydrogen 3.028 N/A TYR 115.A N VAL 98.A O no hydrogen 2.880 N/A LEU 116.A N PHE 52.A O no hydrogen 2.923 N/A GLU 117.A N LYS 96.A O no hydrogen 2.842 N/A VAL 118.A N LEU 50.A O no hydrogen 2.870 N/A LYS 119.A N LYS 94.A O no hydrogen 2.905 N/A TYR 120.A N ARG 48.A O no hydrogen 2.980 N/A SER 121.A OG ILE 46.A O no hydrogen 3.541 N/A ALA 122.A N ILE 46.A O no hydrogen 2.979 N/A MET 124.A N SER 121.A O no hydrogen 3.410 N/A THR 135.A OG1 GLU 79.A OE1 no hydrogen 2.589 N/A SER 137.A N LEU 53.A O no hydrogen 2.865 N/A SER 137.A OG LEU 53.A O no hydrogen 2.478 N/A SER 137.A OG PRO 54.A O no hydrogen 2.861 N/A HIS 138.A N LEU 53.A O no hydrogen 2.894 N/A HIS 138.A ND1 LEU 131.A O no hydrogen 3.139 N/A PHE 140.A N TYR 51.A O no hydrogen 2.869 N/A SER 146.A OG GLU 13.A OE2 no hydrogen 2.155 N/A LEU 149.A N SER 145.A O no hydrogen 2.800 N/A PHE 150.A N SER 146.A O no hydrogen 2.912 N/A LEU 151.A N LEU 147.A O no hydrogen 2.970 N/A MET 152.A N GLU 148.A O no hydrogen 2.855 N/A ASN 153.A N LEU 149.A O no hydrogen 2.936 N/A ASN 153.A N PHE 150.A O no hydrogen 3.275 N/A ARG 154.A N PHE 150.A O no hydrogen 2.910 N/A ARG 154.A NH1 ARG 154.A O no hydrogen 2.904 N/A ARG 154.A NH2 VAL 189.A O no hydrogen 2.228 N/A LYS 155.A N LEU 151.A O no hydrogen 2.546 N/A LYS 155.A NZ GLU 454.A OE1 no hydrogen 3.147 N/A LYS 155.A NZ GLU 454.A OE2 no hydrogen 2.923 N/A CYS 160.A SG GLY 158.A O no hydrogen 3.115 N/A LEU 162.A N PHE 6.A O no hydrogen 2.926 N/A VAL 164.A N PHE 4.A O no hydrogen 2.924 N/A SER 166.A N GLN 2.A O no hydrogen 3.142 N/A SER 166.A OG SER 166.A O no hydrogen 2.346 N/A GLN 168.A N MET 182.A O no hydrogen 3.369 N/A GLN 168.A NE2 SER 166.A O no hydrogen 2.450 N/A GLN 168.A NE2 SER 166.A OG no hydrogen 2.577 N/A GLN 172.A N ASN 171.A OD1 no hydrogen 2.370 N/A CYS 177.A SG SER 175.A OG no hydrogen 3.256 N/A MET 182.A N GLN 168.A O no hydrogen 3.106 N/A ALA 183.A N MET 42.A O no hydrogen 2.989 N/A LEU 188.A N LYS 185.A O no hydrogen 3.007 N/A SER 196.A OG PRO 197.A O no hydrogen 3.541 N/A SER 196.A OG ASP 234.A OD2 no hydrogen 2.296 N/A LEU 200.A N PHE 231.A O no hydrogen 2.912 N/A VAL 202.A N HIS 228.A O no hydrogen 3.148 N/A MET 203.A N ILE 296.A O no hydrogen 3.342 N/A ALA 204.A N LEU 226.A O no hydrogen 2.618 N/A SER 206.A N ALA 224.A O no hydrogen 3.439 N/A SER 206.A OG PHE 205.A O no hydrogen 2.643 N/A THR 209.A OG1 ASN 218.A O no hydrogen 2.589 N/A THR 209.A OG1 GLU 219.A O no hydrogen 2.257 N/A MET 210.A N GLU 219.A O no hydrogen 2.387 N/A ASN 215.A N ASN 212.A OD1 no hydrogen 2.881 N/A GLN 217.A N ASN 212.A O no hydrogen 2.963 N/A MET 223.A N VAL 248.A O no hydrogen 2.933 N/A LEU 226.A N ALA 204.A O no hydrogen 2.964 N/A VAL 227.A N SER 244.A O no hydrogen 2.471 N/A HIS 228.A N VAL 202.A O no hydrogen 3.203 N/A HIS 229.A N GLN 243.A OE1 no hydrogen 2.305 N/A SER 230.A N GLN 243.A OE1 no hydrogen 2.908 N/A SER 230.A OG PRO 199.A O no hydrogen 2.702 N/A PHE 231.A N LEU 200.A O no hydrogen 2.840 N/A LYS 239.A NZ ALA 237.A O no hydrogen 2.330 N/A GLN 243.A N VAL 227.A O no hydrogen 2.479 N/A SER 244.A N VAL 227.A O no hydrogen 2.684 N/A SER 244.A OG HIS 245.A O no hydrogen 3.334 N/A CYS 247.A SG MET 223.A O no hydrogen 3.169 N/A CYS 247.A SG VAL 248.A O no hydrogen 3.447 N/A VAL 248.A N MET 223.A O no hydrogen 2.901 N/A SER 250.A N ILE 221.A O no hydrogen 2.429 N/A SER 250.A OG LYS 251.A O no hydrogen 3.538 N/A SER 250.A OG ALA 276.A O no hydrogen 2.943 N/A CYS 255.A N ASP 254.A OD1 no hydrogen 2.528 N/A CYS 255.A SG ILE 256.A O no hydrogen 3.631 N/A VAL 264.A N ALA 260.A O no hydrogen 2.962 N/A ILE 265.A N PHE 261.A O no hydrogen 2.924 N/A GLU 266.A N LYS 262.A O no hydrogen 3.159 N/A LYS 268.A N ILE 265.A O no hydrogen 2.302 N/A ASN 269.A N ILE 265.A O no hydrogen 2.546 N/A LYS 271.A NZ HIS 245.A O no hydrogen 2.657 N/A THR 277.A OG1 THR 280.A OG1 no hydrogen 2.526 N/A THR 280.A N THR 277.A OG1 no hydrogen 2.451 N/A THR 280.A OG1 THR 277.A OG1 no hydrogen 2.526 N/A LEU 281.A N THR 277.A O no hydrogen 2.478 N/A LEU 282.A N GLU 278.A O no hydrogen 2.878 N/A GLY 283.A N ARG 279.A O no hydrogen 2.901 N/A PHE 284.A N THR 280.A O no hydrogen 2.905 N/A PHE 285.A N LEU 281.A O no hydrogen 2.832 N/A LEU 286.A N LEU 282.A O no hydrogen 2.915 N/A ALA 287.A N GLY 283.A O no hydrogen 2.898 N/A LYS 288.A N PHE 284.A O no hydrogen 2.802 N/A VAL 289.A N PHE 285.A O no hydrogen 2.953 N/A HIS 290.A N LEU 286.A O no hydrogen 2.872 N/A LYS 291.A N ALA 287.A O no hydrogen 2.812 N/A ILE 292.A N LYS 288.A O no hydrogen 2.931 N/A ILE 292.A N VAL 289.A O no hydrogen 2.657 N/A ILE 297.A N MET 345.A O no hydrogen 2.871 N/A GLU 306.A N ILE 302.A O no hydrogen 2.654 N/A LEU 307.A N ILE 302.A O no hydrogen 2.778 N/A GLU 308.A N GLU 308.A OE1 no hydrogen 2.411 N/A VAL 309.A N GLU 306.A O no hydrogen 2.546 N/A LEU 310.A N GLU 306.A O no hydrogen 3.126 N/A LEU 311.A N LEU 307.A O no hydrogen 3.007 N/A GLN 312.A N GLU 308.A O no hydrogen 2.856 N/A ARG 313.A N VAL 309.A O no hydrogen 2.891 N/A ILE 314.A N LEU 310.A O no hydrogen 2.938 N/A ASN 315.A N LEU 311.A O no hydrogen 2.930 N/A VAL 316.A N GLN 312.A O no hydrogen 2.920 N/A CYS 317.A N ARG 313.A O no hydrogen 2.894 N/A LYS 318.A N ILE 314.A O no hydrogen 3.386 N/A LYS 318.A NZ VAL 316.A O no hydrogen 2.263 N/A LYS 324.A N HIS 321.A O no hydrogen 3.383 N/A ILE 325.A N TRP 322.A O no hydrogen 3.385 N/A GLY 326.A N SER 323.A O no hydrogen 3.120 N/A ARG 327.A NH1 ASP 295.A OD1 no hydrogen 2.406 N/A ARG 327.A NH2 GLY 26.A O no hydrogen 2.947 N/A ARG 327.A NH2 CYS 39.A O no hydrogen 2.744 N/A LYS 329.A N VAL 174.A O no hydrogen 3.018 N/A LYS 329.A NZ VAL 174.A O no hydrogen 2.548 N/A LYS 329.A NZ SER 175.A O no hydrogen 2.702 N/A ARG 330.A N SER 323.A OG no hydrogen 3.414 N/A MET 333.A N ASN 332.A OD1 no hydrogen 2.493 N/A THR 341.A OG1 ARG 338.A O no hydrogen 3.045 N/A ARG 344.A NE GLY 326.A O no hydrogen 2.699 N/A MET 345.A N ASP 295.A O no hydrogen 3.164 N/A CYS 347.A N MET 345.A O no hydrogen 3.009 N/A CYS 347.A SG ASP 348.A O no hydrogen 3.604 N/A ILE 351.A N ASP 348.A OD1 no hydrogen 2.791 N/A SER 352.A N ASP 348.A OD2 no hydrogen 2.228 N/A SER 352.A OG GLU 355.A OE1 no hydrogen 2.366 N/A LYS 354.A N ILE 351.A O no hydrogen 2.701 N/A GLU 355.A N SER 352.A O no hydrogen 3.019 N/A LEU 356.A N ALA 353.A O no hydrogen 3.534 N/A CYS 359.A SG SER 361.A O no hydrogen 3.122 N/A SER 361.A OG SER 365.A OG no hydrogen 2.679 N/A HIS 363.A N SER 361.A OG no hydrogen 2.751 N/A VAL 368.A N LEU 364.A O no hydrogen 2.707 N/A VAL 368.A N SER 365.A O no hydrogen 3.208 N/A GLN 369.A N GLU 366.A O no hydrogen 3.083 N/A GLN 370.A N GLU 366.A O no hydrogen 3.331 N/A GLN 370.A N LEU 367.A O no hydrogen 3.245 N/A LYS 373.A NZ ILE 371.A O no hydrogen 2.230 N/A THR 374.A N VAL 368.A O no hydrogen 3.161 N/A THR 374.A OG1 LEU 372.A O no hydrogen 3.182 N/A ILE 384.A N MET 381.A O no hydrogen 2.643 N/A GLN 385.A NE2 ASP 254.A OD2 no hydrogen 2.362 N/A MET 387.A N ASN 383.A O no hydrogen 2.928 N/A TYR 388.A N ILE 384.A O no hydrogen 2.827 N/A SER 389.A N GLN 385.A O no hydrogen 2.908 N/A SER 389.A OG ASN 386.A O no hydrogen 2.616 N/A SER 389.A OG ASN 386.A OD1 no hydrogen 3.504 N/A GLU 390.A N MET 387.A O no hydrogen 3.138 N/A SER 392.A N GLU 390.A OE2 no hydrogen 3.001 N/A LEU 395.A N SER 391.A O no hydrogen 3.247 N/A LEU 397.A N GLN 393.A O no hydrogen 2.838 N/A LEU 398.A N LEU 394.A O no hydrogen 2.961 N/A GLU 399.A N LEU 395.A O no hydrogen 2.881 N/A HIS 400.A N TYR 396.A O no hydrogen 2.749 N/A THR 401.A N LEU 397.A O no hydrogen 2.818 N/A THR 401.A OG1 LEU 397.A O no hydrogen 2.845 N/A TRP 402.A N LEU 398.A O no hydrogen 2.924 N/A LYS 403.A N GLU 399.A O no hydrogen 2.873 N/A ASP 404.A N HIS 400.A O no hydrogen 2.746 N/A ALA 405.A N THR 401.A O no hydrogen 2.923 N/A LYS 406.A N TRP 402.A O no hydrogen 2.951 N/A PHE 407.A N LYS 403.A O no hydrogen 2.854 N/A ILE 408.A N ASP 404.A O no hydrogen 2.867 N/A LEU 409.A N ALA 405.A O no hydrogen 2.892 N/A GLN 410.A N LYS 406.A O no hydrogen 2.893 N/A GLN 410.A NE2 LYS 406.A O no hydrogen 2.305 N/A ILE 411.A N PHE 407.A O no hydrogen 2.917 N/A CYS 413.A N LEU 409.A O no hydrogen 2.847 N/A CYS 413.A SG LEU 409.A O no hydrogen 3.044 N/A CYS 413.A SG GLN 410.A OE1 no hydrogen 3.592 N/A GLU 414.A N GLN 410.A O no hydrogen 2.911 N/A LEU 415.A N ILE 411.A O no hydrogen 2.886 N/A ASN 416.A N MET 412.A O no hydrogen 2.600 N/A LEU 420.A N ASN 416.A O no hydrogen 3.358 N/A ALA 421.A N VAL 417.A O no hydrogen 2.885 N/A LEU 422.A N LEU 418.A O no hydrogen 2.883 N/A GLN 423.A N PRO 419.A O no hydrogen 2.861 N/A GLN 423.A NE2 GLN 423.A O no hydrogen 2.542 N/A ILE 424.A N LEU 420.A O no hydrogen 2.932 N/A THR 425.A N ALA 421.A O no hydrogen 2.913 N/A THR 425.A OG1 ALA 421.A O no hydrogen 3.048 N/A THR 425.A OG1 LEU 422.A O no hydrogen 2.458 N/A ASN 426.A N LEU 422.A O no hydrogen 2.872 N/A ILE 427.A N GLN 423.A O no hydrogen 2.915 N/A ALA 428.A N ILE 424.A O no hydrogen 2.405 N/A GLY 429.A N THR 425.A O no hydrogen 2.679 N/A SER 433.A OG LEU 9.A O no hydrogen 3.567 N/A ARG 434.A N ILE 431.A O no hydrogen 2.821 N/A THR 435.A N MET 432.A O no hydrogen 2.586 N/A THR 435.A OG1 ILE 431.A O no hydrogen 2.980 N/A LEU 436.A N MET 432.A O no hydrogen 3.418 N/A GLY 438.A N THR 435.A O no hydrogen 2.978 N/A ARG 443.A NH2 THR 435.A O no hydrogen 2.273 N/A ASN 444.A ND2 ARG 443.A O no hydrogen 2.857 N/A GLU 445.A N SER 441.A O no hydrogen 2.839 N/A PHE 446.A N GLU 442.A O no hydrogen 2.970 N/A LEU 448.A N ASN 444.A O no hydrogen 2.915 N/A LEU 449.A N GLU 445.A O no hydrogen 2.974 N/A HIS 450.A N LEU 447.A O no hydrogen 3.020 N/A PHE 452.A N LEU 448.A O no hydrogen 2.951 N/A TYR 453.A N LEU 449.A O no hydrogen 2.936 N/A GLU 454.A N ALA 451.A O no hydrogen 2.670 N/A ASN 455.A N PHE 452.A O no hydrogen 3.332 N/A VAL 459.A N TYR 453.A OH no hydrogen 2.729 N/A TYR 475.A N LEU 655.A O no hydrogen 2.944 N/A TYR 475.A OH LYS 471.A O no hydrogen 3.133 N/A PHE 478.A N SER 620.A O no hydrogen 3.487 N/A ILE 479.A N PHE 652.A O no hydrogen 2.734 N/A LEU 480.A N ILE 616.A O no hydrogen 3.375 N/A LEU 481.A N GLY 650.A O no hydrogen 2.999 N/A LEU 482.A N ILE 614.A O no hydrogen 2.940 N/A ASP 483.A N ASP 647.A O no hydrogen 2.952 N/A SER 486.A OG ASN 485.A O no hydrogen 2.389 N/A ILE 491.A N LEU 487.A O no hydrogen 2.909 N/A ILE 492.A N TYR 488.A O no hydrogen 2.933 N/A GLN 493.A N PRO 489.A O no hydrogen 2.956 N/A GLU 494.A N SER 490.A O no hydrogen 2.865 N/A PHE 495.A N ILE 491.A O no hydrogen 2.980 N/A PHE 495.A N ILE 492.A O no hydrogen 3.322 N/A ASN 496.A N GLN 493.A O no hydrogen 3.258 N/A THR 501.A N CYS 498.A O no hydrogen 2.573 N/A THR 501.A OG1 CYS 498.A O no hydrogen 2.241 N/A VAL 505.A N GLN 503.A O no hydrogen 3.094 N/A SER 513.A N ASP 511.A OD1 no hydrogen 2.994 N/A SER 513.A OG ASP 511.A OD2 no hydrogen 2.655 N/A ARG 521.A NH1 ARG 521.A O no hydrogen 3.338 N/A GLU 522.A N ILE 518.A O no hydrogen 3.248 N/A ILE 523.A N LEU 519.A O no hydrogen 2.993 N/A ARG 524.A N PRO 520.A O no hydrogen 2.803 N/A LYS 525.A N ARG 521.A O no hydrogen 2.891 N/A LEU 526.A N GLU 522.A O no hydrogen 2.969 N/A VAL 527.A N ILE 523.A O no hydrogen 2.902 N/A GLU 528.A N ARG 524.A O no hydrogen 2.850 N/A ARG 529.A N LYS 525.A O no hydrogen 2.937 N/A ARG 530.A N LEU 526.A O no hydrogen 2.954 N/A LYS 531.A N VAL 527.A O no hydrogen 2.862 N/A GLN 532.A N GLU 528.A O no hydrogen 2.802 N/A VAL 533.A N ARG 529.A O no hydrogen 2.946 N/A LYS 534.A N ARG 530.A O no hydrogen 2.900 N/A GLN 535.A N LYS 531.A O no hydrogen 2.832 N/A LEU 536.A N GLN 532.A O no hydrogen 2.964 N/A LYS 538.A N GLN 535.A O no hydrogen 3.281 N/A GLN 540.A NE2 ASP 541.A OD1 no hydrogen 3.500 N/A ASP 545.A N ASN 543.A OD1 no hydrogen 3.291 N/A ILE 547.A N ASN 543.A O no hydrogen 3.120 N/A LEU 548.A N PRO 544.A O no hydrogen 2.930 N/A GLN 549.A N ASP 545.A O no hydrogen 2.896 N/A TYR 550.A N LEU 546.A O no hydrogen 2.853 N/A ASP 551.A N ILE 547.A O no hydrogen 2.979 N/A ILE 552.A N LEU 548.A O no hydrogen 2.874 N/A ARG 553.A N GLN 549.A O no hydrogen 2.883 N/A GLN 554.A N TYR 550.A O no hydrogen 2.911 N/A LYS 555.A N ASP 551.A O no hydrogen 2.940 N/A ALA 556.A N ILE 552.A O no hydrogen 2.869 N/A LEU 557.A N ARG 553.A O no hydrogen 2.947 N/A LYS 558.A N GLN 554.A O no hydrogen 2.952 N/A LEU 559.A N LYS 555.A O no hydrogen 2.853 N/A THR 560.A N ALA 556.A O no hydrogen 3.025 N/A ALA 561.A N LEU 557.A O no hydrogen 2.939 N/A ASN 562.A N LYS 558.A O no hydrogen 2.932 N/A ASN 562.A ND2 LYS 558.A O no hydrogen 3.450 N/A SER 563.A N LEU 559.A O no hydrogen 2.925 N/A SER 563.A OG THR 560.A O no hydrogen 2.314 N/A MET 564.A N ALA 561.A O no hydrogen 3.189 N/A GLY 566.A N SER 563.A O no hydrogen 2.771 N/A CYS 567.A N MET 564.A O no hydrogen 3.060 N/A CYS 567.A SG CYS 567.A O no hydrogen 2.975 N/A LEU 568.A N TYR 565.A O no hydrogen 2.866 N/A SER 573.A N PHE 570.A O no hydrogen 2.569 N/A ARG 574.A NH1 GLU 148.A OE1 no hydrogen 3.413 N/A ARG 574.A NH1 GLU 445.A OE2 no hydrogen 2.700 N/A ARG 574.A NH2 GLU 148.A OE2 no hydrogen 3.215 N/A ALA 577.A N PHE 575.A O no hydrogen 2.719 N/A LEU 580.A N ALA 577.A O no hydrogen 2.685 N/A ALA 582.A N LYS 578.A O no hydrogen 2.908 N/A LEU 583.A N PRO 579.A O no hydrogen 2.920 N/A VAL 584.A N LEU 580.A O no hydrogen 2.926 N/A THR 585.A N ALA 581.A O no hydrogen 2.913 N/A THR 585.A OG1 ALA 581.A O no hydrogen 2.881 N/A THR 585.A OG1 ALA 582.A O no hydrogen 2.362 N/A TYR 586.A N ALA 582.A O no hydrogen 2.969 N/A LYS 587.A N LEU 583.A O no hydrogen 2.921 N/A GLY 588.A N VAL 584.A O no hydrogen 2.943 N/A ARG 589.A N THR 585.A O no hydrogen 2.890 N/A GLU 590.A N TYR 586.A O no hydrogen 3.034 N/A ILE 591.A N LYS 587.A O no hydrogen 2.861 N/A LEU 592.A N GLY 588.A O no hydrogen 2.914 N/A MET 593.A N ARG 589.A O no hydrogen 2.986 N/A HIS 594.A N GLU 590.A O no hydrogen 2.922 N/A HIS 594.A ND1 GLU 590.A O no hydrogen 2.671 N/A THR 595.A N ILE 591.A O no hydrogen 2.940 N/A THR 595.A OG1 ILE 591.A O no hydrogen 2.728 N/A LYS 596.A N LEU 592.A O no hydrogen 2.909 N/A GLU 597.A N MET 593.A O no hydrogen 2.987 N/A MET 598.A N HIS 594.A O no hydrogen 2.882 N/A VAL 599.A N THR 595.A O no hydrogen 3.013 N/A GLN 600.A N LYS 596.A O no hydrogen 2.789 N/A LYS 601.A N GLU 597.A O no hydrogen 2.956 N/A MET 602.A N VAL 599.A O no hydrogen 2.776 N/A ASN 603.A N GLN 600.A O no hydrogen 3.358 N/A TYR 608.A N MET 615.A O no hydrogen 2.973 N/A TYR 608.A OH ASP 610.A OD2 no hydrogen 3.055 N/A ASP 610.A N SER 613.A O no hydrogen 2.957 N/A THR 611.A N ASP 610.A OD1 no hydrogen 2.569 N/A SER 613.A N ASP 610.A O no hydrogen 2.940 N/A SER 613.A OG ASP 612.A O no hydrogen 2.251 N/A ILE 614.A N LEU 482.A O no hydrogen 2.971 N/A MET 615.A N TYR 608.A O no hydrogen 2.922 N/A ILE 616.A N LEU 480.A O no hydrogen 3.304 N/A ASN 617.A N GLU 605.A O no hydrogen 3.264 N/A THR 618.A OG1 PHE 478.A O no hydrogen 2.189 N/A SER 620.A OG GLU 625.A OE2 no hydrogen 2.307 N/A ASN 622.A N SER 620.A OG no hydrogen 3.180 N/A LEU 623.A N ASN 622.A OD1 no hydrogen 2.326 N/A GLU 624.A N ASN 622.A OD1 no hydrogen 3.330 N/A LYS 628.A N GLU 624.A O no hydrogen 3.293 N/A LEU 629.A N GLU 625.A O no hydrogen 2.920 N/A GLY 630.A N VAL 626.A O no hydrogen 2.904 N/A ASN 631.A N PHE 627.A O no hydrogen 2.874 N/A LYS 632.A N LYS 628.A O no hydrogen 2.828 N/A VAL 633.A N LEU 629.A O no hydrogen 2.979 N/A LYS 634.A N GLY 630.A O no hydrogen 2.852 N/A SER 635.A N ASN 631.A O no hydrogen 2.935 N/A SER 635.A OG LYS 632.A O no hydrogen 2.897 N/A GLU 636.A N LYS 632.A O no hydrogen 2.863 N/A VAL 637.A N VAL 633.A O no hydrogen 2.977 N/A LYS 639.A N SER 635.A O no hydrogen 2.947 N/A LYS 639.A N GLU 636.A O no hydrogen 2.884 N/A LYS 639.A NZ GLU 636.A OE1 no hydrogen 2.547 N/A LYS 639.A NZ GLU 636.A OE2 no hydrogen 3.167 N/A LEU 640.A N VAL 637.A O no hydrogen 3.117 N/A TYR 641.A N VAL 637.A O no hydrogen 3.328 N/A ASP 647.A N ASP 483.A O no hydrogen 2.954 N/A ASP 649.A N LEU 481.A O no hydrogen 3.162 N/A PHE 652.A N ILE 479.A O no hydrogen 2.584 N/A LYS 653.A NZ ASP 710.A OD2 no hydrogen 3.093 N/A SER 654.A OG TYR 475.A O no hydrogen 3.286 N/A SER 654.A OG ASP 476.A O no hydrogen 2.262 N/A SER 654.A OG ASP 476.A OD1 no hydrogen 3.469 N/A SER 654.A OG LYS 653.A O no hydrogen 2.871 N/A LEU 655.A N TYR 475.A O no hydrogen 2.948 N/A LEU 656.A N ALA 664.A O no hydrogen 2.978 N/A LYS 659.A N LYS 662.A O no hydrogen 2.990 N/A LYS 662.A N LYS 659.A O no hydrogen 3.128 N/A LYS 662.A NZ GLU 951.A OE1 no hydrogen 2.433 N/A TYR 663.A N LYS 683.A O no hydrogen 2.893 N/A ALA 665.A N GLU 681.A O no hydrogen 2.915 N/A VAL 667.A N LYS 679.A O no hydrogen 2.887 N/A VAL 668.A N VAL 651.A O no hydrogen 3.206 N/A ASN 675.A N SER 672.A O no hydrogen 3.132 N/A VAL 677.A N GLU 669.A O no hydrogen 3.002 N/A LYS 679.A N VAL 667.A O no hydrogen 2.933 N/A GLU 681.A N ALA 665.A O no hydrogen 2.896 N/A ARG 689.A NH1 THR 953.A O no hydrogen 2.938 N/A LYS 697.A N CYS 693.A O no hydrogen 2.898 N/A ASP 698.A N ASP 694.A O no hydrogen 2.891 N/A THR 699.A N LEU 695.A O no hydrogen 2.862 N/A THR 699.A OG1 LEU 695.A O no hydrogen 2.251 N/A GLY 700.A N ALA 696.A O no hydrogen 2.948 N/A ASN 701.A N LYS 697.A O no hydrogen 2.896 N/A PHE 702.A N ASP 698.A O no hydrogen 2.916 N/A VAL 703.A N THR 699.A O no hydrogen 2.896 N/A ILE 704.A N GLY 700.A O no hydrogen 2.910 N/A GLY 705.A N ASN 701.A O no hydrogen 2.929 N/A GLN 706.A N PHE 702.A O no hydrogen 2.865 N/A GLN 706.A N VAL 703.A O no hydrogen 3.004 N/A GLN 706.A NE2 GLN 711.A OE1 no hydrogen 3.584 N/A LEU 708.A N GLY 705.A O no hydrogen 3.122 N/A SER 709.A N ILE 707.A O no hydrogen 2.886 N/A GLN 711.A N GLN 711.A OE1 no hydrogen 2.670 N/A SER 712.A OG THR 715.A OG1 no hydrogen 2.414 N/A ARG 713.A NE ASP 476.A OD2 no hydrogen 3.440 N/A THR 715.A N SER 712.A OG no hydrogen 2.393 N/A THR 715.A OG1 SER 712.A OG no hydrogen 2.414 N/A ILE 716.A N SER 712.A O no hydrogen 2.467 N/A VAL 717.A N ARG 713.A O no hydrogen 2.929 N/A GLU 718.A N ASP 714.A O no hydrogen 2.869 N/A ASN 719.A N THR 715.A O no hydrogen 2.891 N/A ILE 720.A N ILE 716.A O no hydrogen 2.851 N/A GLN 721.A N GLU 718.A O no hydrogen 3.061 N/A LYS 722.A N GLU 718.A O no hydrogen 2.956 N/A ARG 723.A N ASN 719.A O no hydrogen 3.452 N/A ILE 725.A N GLN 721.A O no hydrogen 2.930 N/A GLU 726.A N LYS 722.A O no hydrogen 2.937 N/A ILE 727.A N ARG 723.A O no hydrogen 2.902 N/A GLY 728.A N LEU 724.A O no hydrogen 2.928 N/A GLU 729.A N ILE 725.A O no hydrogen 2.955 N/A ASN 730.A N GLU 726.A O no hydrogen 2.911 N/A LEU 732.A N GLY 728.A O no hydrogen 2.946 N/A ASN 733.A N GLU 729.A O no hydrogen 2.822 N/A GLY 734.A N VAL 731.A O no hydrogen 2.706 N/A SER 735.A N ASN 730.A O no hydrogen 3.061 N/A SER 735.A OG ASN 733.A O no hydrogen 2.970 N/A SER 735.A OG ASN 733.A OD1 no hydrogen 3.091 N/A GLN 740.A N PRO 737.A O no hydrogen 2.969 N/A PHE 741.A N VAL 738.A O no hydrogen 2.899 N/A LYS 745.A N VAL 783.A O no hydrogen 2.912 N/A THR 748.A OG1 TYR 754.A OH no hydrogen 2.265 N/A LYS 749.A N TYR 754.A OH no hydrogen 2.845 N/A ASP 750.A N ASP 753.A OD2 no hydrogen 2.973 N/A GLN 752.A N GLN 752.A OE1 no hydrogen 2.291 N/A ASP 753.A N ASP 750.A O no hydrogen 2.970 N/A TYR 754.A OH THR 748.A OG1 no hydrogen 2.265 N/A LYS 758.A NZ SER 759.A OG no hydrogen 3.419 N/A SER 759.A N ASP 756.A O no hydrogen 3.487 N/A HIS 764.A ND1 GLN 798.A O no hydrogen 2.770 N/A VAL 765.A N HIS 762.A O no hydrogen 2.774 N/A LEU 767.A N VAL 763.A O no hydrogen 2.890 N/A TRP 768.A N HIS 764.A O no hydrogen 2.907 N/A ILE 769.A N VAL 765.A O no hydrogen 2.811 N/A ASN 770.A N ALA 766.A O no hydrogen 2.973 N/A ASN 770.A ND2 VAL 777.A O no hydrogen 2.720 N/A SER 771.A N TRP 768.A O no hydrogen 3.030 N/A SER 771.A OG LEU 767.A O no hydrogen 2.913 N/A LYS 778.A N ASP 781.A OD2 no hydrogen 2.583 N/A THR 782.A OG1 ASN 744.A OD1 no hydrogen 2.093 N/A THR 782.A OG1 LYS 745.A O no hydrogen 2.403 N/A VAL 783.A N LYS 745.A O no hydrogen 2.920 N/A TYR 785.A N ILE 743.A O no hydrogen 2.830 N/A TYR 785.A OH PRO 761.A O no hydrogen 2.592 N/A VAL 786.A N TYR 801.A O no hydrogen 2.905 N/A ILE 787.A N TYR 819.A OH no hydrogen 2.780 N/A CYS 788.A N ARG 799.A O no hydrogen 2.699 N/A CYS 788.A SG VAL 786.A O no hydrogen 3.351 N/A SER 792.A OG ASP 790.A O no hydrogen 3.218 N/A THR 795.A OG1 SER 797.A OG no hydrogen 2.356 N/A SER 797.A OG THR 795.A OG1 no hydrogen 2.356 N/A GLN 798.A NE2 LYS 758.A O no hydrogen 3.487 N/A TYR 801.A N VAL 786.A O no hydrogen 2.877 N/A TYR 801.A OH ASP 790.A OD2 no hydrogen 2.262 N/A GLN 805.A N ALA 802.A O no hydrogen 3.337 N/A GLN 807.A N PRO 803.A O no hydrogen 3.070 N/A LYS 808.A N GLN 805.A O no hydrogen 2.918 N/A LYS 808.A NZ GLU 804.A OE1 no hydrogen 3.085 N/A GLN 809.A N GLN 805.A O no hydrogen 3.006 N/A GLN 809.A NE2 ASP 810.A OD1 no hydrogen 3.372 N/A ASN 811.A N ASP 810.A OD1 no hydrogen 2.569 N/A GLN 817.A N ASP 815.A OD2 no hydrogen 2.996 N/A TYR 818.A N ASP 815.A OD2 no hydrogen 2.423 N/A LEU 820.A N GLN 817.A O no hydrogen 3.045 N/A GLN 822.A N TYR 818.A O no hydrogen 3.241 N/A HIS 825.A N LEU 820.A O no hydrogen 3.211 N/A VAL 828.A N ILE 824.A O no hydrogen 2.952 N/A ALA 829.A N HIS 825.A O no hydrogen 2.828 N/A ARG 830.A N PRO 826.A O no hydrogen 3.079 N/A ILE 831.A N VAL 828.A O no hydrogen 3.313 N/A CYS 832.A N VAL 828.A O no hydrogen 2.612 N/A GLU 833.A N ALA 829.A O no hydrogen 3.339 N/A ILE 838.A N ASP 836.A O no hydrogen 2.612 N/A ALA 840.A N ASP 839.A OD1 no hydrogen 2.329 N/A ILE 843.A N ASP 839.A O no hydrogen 3.492 N/A ALA 844.A N ALA 840.A O no hydrogen 3.388 N/A THR 845.A N VAL 841.A O no hydrogen 2.710 N/A THR 845.A OG1 VAL 841.A O no hydrogen 3.305 N/A THR 845.A OG1 LEU 842.A O no hydrogen 2.852 N/A TRP 846.A N ILE 843.A O no hydrogen 2.896 N/A LEU 847.A N ALA 844.A O no hydrogen 2.924 N/A GLY 848.A N ALA 844.A O no hydrogen 3.176 N/A ASP 850.A N GLY 848.A O no hydrogen 2.662 N/A PHE 854.A N ASP 850.A O no hydrogen 3.380 N/A ARG 855.A N PRO 851.A O no hydrogen 2.180 N/A ARG 855.A N THR 852.A O no hydrogen 3.131 N/A VAL 856.A N GLN 853.A O no hydrogen 3.341 N/A HIS 857.A N PHE 854.A O no hydrogen 3.064 N/A LYS 861.A NZ GLN 981.A OE1 no hydrogen 2.341 N/A ASN 865.A ND2 ASP 862.A OD2 no hydrogen 3.179 N/A THR 869.A OG1 ASP 870.A OD1 no hydrogen 3.412 N/A GLU 871.A N ASP 870.A OD1 no hydrogen 2.314 N/A LYS 873.A N ASP 870.A O no hydrogen 3.288 N/A TYR 874.A N GLU 871.A O no hydrogen 2.371 N/A ARG 875.A N GLU 871.A O no hydrogen 3.102 N/A CYS 877.A N TYR 874.A O no hydrogen 2.574 N/A CYS 877.A SG TYR 874.A O no hydrogen 2.995 N/A GLU 878.A N GLN 992.A OE1 no hydrogen 2.843 N/A CYS 882.A N ASN 891.A O no hydrogen 2.895 N/A CYS 882.A SG PRO 883.A O no hydrogen 3.470 N/A CYS 882.A SG TYR 893.A OH no hydrogen 3.762 N/A CYS 884.A N THR 889.A O no hydrogen 3.188 N/A CYS 887.A SG THR 889.A OG1 no hydrogen 3.064 N/A ASN 891.A N CYS 882.A O no hydrogen 2.911 N/A TYR 893.A N PHE 880.A O no hydrogen 2.944 N/A ASN 895.A N ASP 894.A OD1 no hydrogen 2.376 N/A ASP 898.A N GLU 905.A O no hydrogen 2.917 N/A MET 904.A N GLY 901.A O no hydrogen 2.825 N/A SER 907.A OG TYR 1031.A OH no hydrogen 3.127 N/A CYS 911.A N ALA 918.A O no hydrogen 3.392 N/A CYS 916.A SG ASN 913.A O no hydrogen 3.231 N/A THR 922.A N SER 919.A O no hydrogen 3.109 N/A THR 922.A OG1 THR 922.A O no hydrogen 2.476 N/A PHE 923.A N PRO 920.A O no hydrogen 2.876 N/A LEU 927.A N PHE 923.A O no hydrogen 3.129 N/A SER 928.A N THR 924.A O no hydrogen 2.814 N/A ASN 929.A N VAL 925.A O no hydrogen 3.017 N/A LYS 930.A N GLN 926.A O no hydrogen 3.340 N/A LEU 931.A N LEU 927.A O no hydrogen 2.978 N/A ILE 932.A N SER 928.A O no hydrogen 3.154 N/A MET 933.A N ASN 929.A O no hydrogen 2.677 N/A ASP 934.A N LEU 931.A O no hydrogen 2.948 N/A ILE 935.A N LEU 931.A O no hydrogen 2.912 N/A ARG 936.A N ILE 932.A O no hydrogen 2.944 N/A ARG 937.A N ASP 934.A O no hydrogen 2.867 N/A ARG 937.A NE ASP 934.A OD1 no hydrogen 2.640 N/A ARG 937.A NH2 GLU 878.A OE2 no hydrogen 3.486 N/A ARG 937.A NH2 ASP 934.A OD1 no hydrogen 2.481 N/A ILE 939.A N ILE 935.A O no hydrogen 3.346 N/A LYS 941.A N ARG 937.A O no hydrogen 2.945 N/A TYR 942.A N PHE 938.A O no hydrogen 3.309 N/A TYR 943.A N ILE 939.A O no hydrogen 3.365 N/A GLY 945.A N TYR 942.A O no hydrogen 2.409 N/A ILE 948.A N GLN 981.A O no hydrogen 2.983 N/A CYS 954.A N GLU 951.A O no hydrogen 2.822 N/A THR 958.A N LEU 947.A O no hydrogen 2.911 N/A HIS 960.A N THR 958.A OG1 no hydrogen 3.411 N/A SER 966.A N GLY 969.A O no hydrogen 2.647 N/A SER 966.A OG GLY 969.A O no hydrogen 3.308 N/A GLN 981.A N ILE 948.A O no hydrogen 2.938 N/A LYS 987.A NZ TYR 1047.A OH no hydrogen 2.255 N/A SER 988.A N SER 985.A O no hydrogen 2.510 N/A SER 988.A OG SER 985.A O no hydrogen 2.317 N/A TYR 990.A N ASP 986.A O no hydrogen 3.002 N/A THR 991.A N LYS 987.A O no hydrogen 2.905 N/A THR 991.A OG1 LYS 987.A O no hydrogen 2.211 N/A GLN 992.A N SER 988.A O no hydrogen 2.835 N/A LEU 993.A N LEU 989.A O no hydrogen 3.041 N/A CYS 994.A N TYR 990.A O no hydrogen 2.949 N/A CYS 994.A SG TYR 874.A OH no hydrogen 2.655 N/A PHE 995.A N THR 991.A O no hydrogen 2.857 N/A TYR 996.A N GLN 992.A O no hydrogen 2.959 N/A TYR 996.A OH ASP 934.A OD2 no hydrogen 2.495 N/A ARG 997.A N LEU 993.A O no hydrogen 3.030 N/A TYR 998.A N CYS 994.A O no hydrogen 2.877 N/A ILE 999.A N TYR 996.A O no hydrogen 2.897 N/A ASP 1001.A N TYR 998.A O no hydrogen 3.332 N/A CYS 1004.A N ASP 1001.A O no hydrogen 3.121 N/A LEU 1006.A N ALA 1002.A O no hydrogen 2.843 N/A GLU 1007.A N GLU 1003.A O no hydrogen 2.923 N/A LYS 1008.A N CYS 1004.A O no hydrogen 2.924 N/A LEU 1009.A N LEU 1006.A O no hydrogen 3.248 N/A THR 1010.A OG1 THR 1011.A OG1 no hydrogen 3.340 N/A THR 1011.A OG1 THR 1010.A OG1 no hydrogen 3.340 N/A LYS 1015.A N THR 1011.A O no hydrogen 3.361 N/A ASP 1016.A N ASP 1012.A O no hydrogen 2.962 N/A LYS 1017.A N HIS 1013.A O no hydrogen 2.868 N/A LEU 1018.A N GLU 1014.A O no hydrogen 2.942 N/A LYS 1019.A N LYS 1015.A O no hydrogen 2.976 N/A LYS 1020.A N ASP 1016.A O no hydrogen 2.886 N/A GLN 1021.A N LYS 1017.A O no hydrogen 2.822 N/A PHE 1022.A N LEU 1018.A O no hydrogen 2.999 N/A PHE 1023.A N LYS 1019.A O no hydrogen 3.475 N/A VAL 1027.A N THR 1024.A OG1 no hydrogen 2.800 N/A GLN 1029.A N PRO 1025.A O no hydrogen 2.851 N/A ASP 1030.A N LYS 1026.A O no hydrogen 2.945 N/A TYR 1031.A N VAL 1027.A O no hydrogen 3.052 N/A TYR 1031.A OH SER 907.A OG no hydrogen 3.127 N/A ARG 1032.A N LEU 1028.A O no hydrogen 2.823 N/A LYS 1033.A N GLN 1029.A O no hydrogen 2.852 N/A LEU 1034.A N ASP 1030.A O no hydrogen 3.097 N/A LYS 1035.A N TYR 1031.A O no hydrogen 2.904 N/A LYS 1035.A NZ ASP 1001.A OD2 no hydrogen 3.503 N/A LYS 1035.A NZ GLU 1039.A OE1 no hydrogen 3.485 N/A ASN 1036.A N ARG 1032.A O no hydrogen 2.861 N/A THR 1037.A N LYS 1033.A O no hydrogen 3.020 N/A THR 1037.A OG1 LYS 1033.A O no hydrogen 3.353 N/A ALA 1038.A N LEU 1034.A O no hydrogen 3.016 N/A GLU 1039.A N LYS 1035.A O no hydrogen 2.911 N/A GLN 1040.A N ASN 1036.A O no hydrogen 2.966 N/A GLN 1040.A NE2 THR 1037.A O no hydrogen 3.222 N/A PHE 1041.A N THR 1037.A O no hydrogen 2.973 N/A LEU 1042.A N ALA 1038.A O no hydrogen 3.109 N/A LEU 1042.A N GLU 1039.A O no hydrogen 3.266 N/A SER 1043.A N GLU 1039.A O no hydrogen 2.936 N/A SER 1045.A OG SER 1045.A O no hydrogen 2.315 N/A LYS 1054.A N ASN 1051.A O no hydrogen 2.937 N/A LEU 1055.A N LEU 1052.A O no hydrogen 2.726 N/A