Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7fem_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N VAL 36.A O no hydrogen 2.905 N/A THR 3.A OG1 ASP 142.A OD1 no hydrogen 2.287 N/A SER 5.A N SER 34.A O no hydrogen 3.128 N/A SER 5.A OG SER 34.A OG no hydrogen 3.299 N/A ARG 8.A NE TYR 53.A OH no hydrogen 3.099 N/A TYR 11.A OH LEU 28.A O no hydrogen 2.517 N/A TYR 12.A N LEU 150.A O no hydrogen 2.972 N/A SER 19.A OG ARG 18.A O no hydrogen 2.320 N/A HIS 23.A N LEU 184.A O no hydrogen 2.967 N/A THR 25.A N PHE 182.A O no hydrogen 2.944 N/A ASP 27.A N ARG 180.A O no hydrogen 2.989 N/A PHE 29.A N GLN 178.A O no hydrogen 2.892 N/A PHE 33.A N PHE 6.A O no hydrogen 3.290 N/A SER 34.A N SER 5.A O no hydrogen 3.472 N/A SER 34.A OG SER 5.A OG no hydrogen 3.299 N/A SER 34.A OG PRO 31.A O no hydrogen 3.196 N/A VAL 36.A N THR 3.A O no hydrogen 2.891 N/A TRP 38.A N ALA 1.A O no hydrogen 2.608 N/A PHE 39.A N TYR 172.A O no hydrogen 3.060 N/A PHE 48.A N THR 163.A O no hydrogen 2.681 N/A ASP 50.A N ASN 49.A OD1 no hydrogen 2.375 N/A VAL 52.A N PHE 121.A O no hydrogen 2.877 N/A PHE 54.A N PHE 119.A O no hydrogen 2.879 N/A SER 56.A N ARG 117.A O no hydrogen 2.923 N/A ILE 62.A N SER 60.A OG no hydrogen 3.171 N/A ARG 64.A N LEU 168.A O no hydrogen 3.246 N/A TRP 66.A N ILE 81.A O no hydrogen 2.843 N/A ILE 67.A N GLN 166.A O no hydrogen 2.863 N/A PHE 68.A N LEU 79.A O no hydrogen 2.875 N/A THR 70.A OG1 THR 163.A OG1 no hydrogen 2.481 N/A LYS 75.A NZ THR 71.A O no hydrogen 3.505 N/A GLN 77.A NE2 GLU 94.A OE2 no hydrogen 2.409 N/A SER 78.A OG PHE 68.A O no hydrogen 2.785 N/A SER 78.A OG LEU 79.A O no hydrogen 3.196 N/A LEU 79.A N PHE 68.A O no hydrogen 2.897 N/A LEU 80.A N LYS 91.A O no hydrogen 2.901 N/A ILE 81.A N TRP 66.A O no hydrogen 3.026 N/A VAL 82.A N VAL 89.A O no hydrogen 2.940 N/A ASN 83.A N ARG 64.A O no hydrogen 2.481 N/A ASN 84.A N ASN 87.A O no hydrogen 3.228 N/A VAL 89.A N VAL 82.A O no hydrogen 2.949 N/A LYS 91.A N LEU 80.A O no hydrogen 2.931 N/A GLN 96.A N SER 74.A OG no hydrogen 2.384 N/A CYS 98.A N GLN 96.A O no hydrogen 2.726 N/A LEU 103.A N ASP 100.A O no hydrogen 2.820 N/A LEU 116.A N THR 135.A O no hydrogen 3.041 N/A ARG 117.A N SER 56.A O no hydrogen 2.880 N/A ARG 117.A NH1 ASN 115.A O no hydrogen 2.615 N/A PHE 119.A N PHE 54.A O no hydrogen 2.815 N/A VAL 120.A N TYR 131.A O no hydrogen 2.971 N/A PHE 121.A N VAL 52.A O no hydrogen 2.943 N/A LYS 122.A NZ TYR 11.A OH no hydrogen 3.416 N/A TYR 127.A N ILE 124.A O no hydrogen 2.895 N/A LYS 129.A N LYS 122.A O no hydrogen 2.915 N/A ILE 130.A N VAL 154.A O no hydrogen 2.962 N/A SER 132.A N GLU 151.A O no hydrogen 2.783 N/A THR 135.A OG1 LEU 116.A O no hydrogen 3.287 N/A THR 135.A OG1 GLU 118.A OE2 no hydrogen 3.095 N/A ILE 137.A N LYS 114.A O no hydrogen 3.366 N/A ARG 141.A NH1 ARG 141.A O no hydrogen 3.476 N/A ARG 141.A NH2 TYR 2.A O no hydrogen 2.889 N/A LEU 150.A N VAL 10.A O no hydrogen 2.937 N/A GLU 151.A N SER 132.A O no hydrogen 3.097 N/A LEU 153.A N ILE 130.A O no hydrogen 2.646 N/A ILE 158.A N LEU 156.A O no hydrogen 3.266 N/A THR 163.A OG1 THR 70.A OG1 no hydrogen 2.481 N/A PHE 165.A N LEU 46.A O no hydrogen 2.997 N/A GLN 166.A N ILE 67.A O no hydrogen 2.905 N/A GLN 166.A NE2 PRO 44.A O no hydrogen 2.833 N/A ALA 171.A N GLU 58.A OE1 no hydrogen 3.453 N/A TYR 176.A OH PRO 47.A O no hydrogen 3.200 N/A LEU 177.A N GLY 51.A O no hydrogen 3.297 N/A GLN 178.A N PHE 29.A O no hydrogen 2.882 N/A ARG 180.A N ASP 27.A O no hydrogen 2.862 N/A ARG 180.A NH1 GLN 178.A OE1 no hydrogen 3.507 N/A ARG 180.A NH2 ASP 197.A OD1 no hydrogen 2.631 N/A PHE 182.A N THR 25.A O no hydrogen 2.915 N/A LEU 184.A N HIS 23.A O no hydrogen 2.861 N/A LYS 185.A N ASP 194.A O no hydrogen 3.496 N/A TYR 186.A N VAL 21.A O no hydrogen 3.410 N/A GLU 188.A N ASN 187.A OD1 no hydrogen 2.365 N/A GLY 190.A N ASN 187.A O no hydrogen 2.356 N/A THR 191.A OG1 ASN 189.A O no hydrogen 3.414 N/A THR 193.A N LYS 185.A O no hydrogen 3.226 N/A THR 193.A OG1 LYS 185.A O no hydrogen 3.276 N/A ALA 195.A N ASP 194.A OD1 no hydrogen 2.278 N/A CYS 198.A SG THR 181.A O no hydrogen 3.318 N/A ALA 199.A N ASP 197.A OD1 no hydrogen 2.227 N/A ASP 201.A N SER 204.A OG no hydrogen 3.399 N/A SER 204.A N ASP 201.A OD1 no hydrogen 3.181 N/A SER 204.A OG ASP 201.A O no hydrogen 2.719 N/A GLU 205.A N PRO 202.A O no hydrogen 2.636 N/A THR 206.A N PRO 202.A O no hydrogen 2.893 N/A THR 206.A OG1 LEU 203.A O no hydrogen 2.237 N/A LYS 207.A N LEU 203.A O no hydrogen 2.991 N/A CYS 208.A N SER 204.A O no hydrogen 2.851 N/A CYS 208.A SG ASP 197.A O no hydrogen 3.272 N/A CYS 208.A SG SER 204.A O no hydrogen 3.072 N/A THR 209.A N GLU 205.A O no hydrogen 2.943 N/A THR 209.A OG1 GLU 205.A O no hydrogen 3.242 N/A THR 209.A OG1 THR 206.A O no hydrogen 3.277 N/A LEU 210.A N THR 206.A O no hydrogen 2.927 N/A LEU 210.A N LYS 207.A O no hydrogen 3.393 N/A SER 212.A OG THR 214.A O no hydrogen 3.193 N/A THR 214.A N SER 212.A OG no hydrogen 2.827 N/A TYR 220.A N VAL 504.A O no hydrogen 3.097 N/A TYR 220.A OH GLU 216.A O no hydrogen 2.724 N/A THR 222.A N VAL 502.A O no hydrogen 2.903 N/A THR 222.A OG1 VAL 502.A O no hydrogen 3.189 N/A SER 223.A N VAL 502.A O no hydrogen 3.069 N/A SER 223.A OG ASN 224.A O no hydrogen 3.239 N/A PHE 225.A N GLY 500.A O no hydrogen 2.829 N/A GLN 228.A NE2 ARG 226.A O no hydrogen 3.028 N/A ARG 235.A NE VAL 234.A O no hydrogen 3.168 N/A ARG 235.A NE THR 438.A O no hydrogen 2.751 N/A CYS 243.A N VAL 269.A O no hydrogen 3.208 N/A CYS 243.A SG VAL 269.A O no hydrogen 3.407 N/A PHE 245.A N CYS 243.A O no hydrogen 2.934 N/A GLU 247.A N PRO 244.A O no hydrogen 3.059 N/A PHE 249.A N PHE 245.A O no hydrogen 3.141 N/A ASN 250.A N GLY 246.A O no hydrogen 2.450 N/A THR 252.A OG1 THR 252.A O no hydrogen 2.518 N/A SER 256.A OG LEU 359.A O no hydrogen 2.263 N/A LYS 263.A N ALA 304.A O no hydrogen 2.920 N/A ILE 265.A N VAL 302.A O no hydrogen 2.891 N/A SER 266.A OG ILE 265.A O no hydrogen 2.570 N/A SER 266.A OG THR 300.A O no hydrogen 2.973 N/A SER 266.A OG ASN 301.A OD1 no hydrogen 2.722 N/A SER 273.A OG ASP 271.A OD1 no hydrogen 2.932 N/A SER 273.A OG ASP 271.A OD2 no hydrogen 2.549 N/A VAL 274.A N ASP 271.A OD1 no hydrogen 2.491 N/A TYR 276.A N TYR 272.A O no hydrogen 3.286 N/A ASN 277.A N SER 273.A O no hydrogen 2.921 N/A SER 278.A OG LEU 275.A O no hydrogen 3.313 N/A SER 280.A N SER 278.A OG no hydrogen 3.195 N/A SER 280.A OG SER 278.A O no hydrogen 3.425 N/A PHE 281.A N SER 278.A OG no hydrogen 3.213 N/A THR 283.A N ALA 342.A O no hydrogen 3.161 N/A THR 283.A OG1 ALA 342.A O no hydrogen 2.217 N/A LYS 285.A N VAL 340.A O no hydrogen 3.449 N/A LYS 285.A NZ SER 282.A O no hydrogen 3.530 N/A TYR 287.A OH PRO 319.A O no hydrogen 3.146 N/A THR 292.A OG1 SER 290.A OG no hydrogen 2.195 N/A LYS 293.A N SER 290.A O no hydrogen 3.075 N/A LYS 293.A NZ ASP 296.A OD2 no hydrogen 3.170 N/A PHE 299.A N VAL 431.A O no hydrogen 3.391 N/A THR 300.A OG1 LEU 425.A O no hydrogen 3.524 N/A THR 300.A OG1 ALA 427.A O no hydrogen 3.173 N/A ASN 301.A N GLU 423.A O no hydrogen 3.288 N/A VAL 302.A N ILE 265.A O no hydrogen 2.981 N/A ALA 304.A N LYS 263.A O no hydrogen 2.881 N/A PHE 307.A N VAL 417.A O no hydrogen 3.511 N/A ARG 315.A NH1 GLY 311.A O no hydrogen 2.637 N/A GLN 316.A N ASP 312.A O no hydrogen 3.297 N/A GLN 316.A NE2 GLN 316.A O no hydrogen 3.245 N/A ILE 317.A N GLU 313.A O no hydrogen 2.364 N/A ALA 318.A N GLN 316.A O no hydrogen 2.989 N/A GLN 321.A N ALA 318.A O no hydrogen 2.530 N/A GLN 321.A NE2 THR 322.A O no hydrogen 3.263 N/A THR 322.A OG1 ASP 327.A OD2 no hydrogen 3.440 N/A LYS 324.A NZ LEU 362.A O no hydrogen 3.478 N/A ASP 327.A N GLY 323.A O no hydrogen 3.065 N/A TYR 328.A N LYS 324.A O no hydrogen 2.921 N/A ASN 329.A N ILE 325.A O no hydrogen 2.764 N/A ASN 329.A ND2 ARG 361.A O no hydrogen 2.929 N/A TYR 330.A N ILE 325.A O no hydrogen 2.983 N/A TYR 330.A OH GLN 316.A O no hydrogen 2.870 N/A LYS 331.A NZ LEU 368.A O no hydrogen 3.055 N/A THR 337.A OG1 PHE 422.A O no hydrogen 2.114 N/A CYS 339.A SG LYS 285.A O no hydrogen 3.091 N/A CYS 339.A SG VAL 340.A O no hydrogen 3.075 N/A TRP 343.A N TYR 415.A O no hydrogen 2.494 N/A SER 345.A N PRO 414.A O no hydrogen 2.770 N/A SER 345.A OG ASP 349.A OD1 no hydrogen 3.187 N/A ASP 349.A N SER 345.A O no hydrogen 3.311 N/A LYS 351.A N ASN 355.A OD1 no hydrogen 2.675 N/A LYS 351.A NZ GLY 354.A O no hydrogen 2.902 N/A GLY 354.A N LYS 351.A O no hydrogen 3.326 N/A ASN 355.A N PHE 404.A O no hydrogen 2.712 N/A TYR 356.A OH GLY 353.A O no hydrogen 2.913 N/A TYR 358.A OH PHE 254.A O no hydrogen 2.817 N/A TYR 360.A N GLN 400.A O no hydrogen 2.877 N/A ARG 361.A NH1 SER 376.A OG no hydrogen 3.017 N/A LEU 362.A N PRO 398.A O no hydrogen 2.475 N/A ARG 364.A NH1 SER 366.A O no hydrogen 3.470 N/A SER 366.A OG ASN 367.A OD1 no hydrogen 3.226 N/A ASN 367.A N SER 366.A OG no hydrogen 2.593 N/A LYS 369.A NZ PRO 370.A O no hydrogen 2.740 N/A SER 376.A N ASP 374.A OD1 no hydrogen 3.104 N/A SER 376.A OG ASP 374.A OD1 no hydrogen 3.178 N/A SER 376.A OG ASP 374.A OD2 no hydrogen 2.389 N/A TYR 380.A N TYR 396.A O no hydrogen 3.033 N/A GLN 381.A NE2 GLY 383.A O no hydrogen 3.308 N/A ALA 382.A N ASN 394.A O no hydrogen 2.306 N/A GLY 383.A N ASN 394.A O no hydrogen 3.302 N/A CYS 387.A SG TYR 380.A O no hydrogen 3.929 N/A CYS 387.A SG VAL 390.A O no hydrogen 3.930 N/A VAL 390.A N CYS 387.A O no hydrogen 2.511 N/A ASN 394.A N TYR 396.A OH no hydrogen 3.274 N/A ASN 394.A ND2 THR 385.A OG1 no hydrogen 2.720 N/A CYS 395.A N GLY 392.A O no hydrogen 2.887 N/A CYS 395.A SG VAL 390.A O no hydrogen 3.500 N/A CYS 395.A SG PHE 393.A O no hydrogen 3.981 N/A GLN 400.A N TYR 360.A O no hydrogen 2.911 N/A SER 401.A OG TYR 356.A O no hydrogen 3.205 N/A SER 401.A OG TYR 358.A O no hydrogen 2.783 N/A SER 401.A OG TYR 402.A O no hydrogen 3.436 N/A TYR 402.A N TYR 358.A O no hydrogen 3.089 N/A TYR 408.A N GLN 405.A O no hydrogen 3.029 N/A TYR 412.A N GLY 409.A O no hydrogen 2.942 N/A GLN 413.A N VAL 410.A O no hydrogen 3.260 N/A GLN 413.A NE2 TYR 408.A O no hydrogen 2.895 N/A TYR 415.A OH GLN 413.A OE1 no hydrogen 3.167 N/A VAL 418.A N ILE 341.A O no hydrogen 2.566 N/A VAL 419.A N ASP 305.A O no hydrogen 2.516 N/A LEU 420.A N CYS 339.A O no hydrogen 3.200 N/A PHE 422.A N THR 337.A O no hydrogen 3.025 N/A GLU 423.A N ASN 301.A O no hydrogen 3.179 N/A THR 430.A OG1 ASN 267.A OD1 no hydrogen 2.999 N/A CYS 432.A SG ALA 429.A O no hydrogen 3.811 N/A THR 438.A N VAL 234.A O no hydrogen 2.873 N/A ASN 439.A N THR 438.A OG1 no hydrogen 2.666 N/A ASN 443.A N LEU 459.A O no hydrogen 2.962 N/A LYS 444.A NZ GLU 231.A OE1 no hydrogen 3.318 N/A VAL 446.A N GLY 457.A O no hydrogen 2.906 N/A ASN 451.A N ASN 449.A O no hydrogen 2.661 N/A THR 454.A OG1 GLY 452.A O no hydrogen 3.299 N/A THR 454.A OG1 THR 454.A O no hydrogen 2.676 N/A THR 456.A OG1 GLY 455.A O no hydrogen 2.471 N/A GLY 457.A N VAL 446.A O no hydrogen 2.971 N/A VAL 458.A N THR 495.A O no hydrogen 2.853 N/A THR 460.A N ASP 493.A O no hydrogen 2.929 N/A THR 460.A OG1 GLU 461.A O no hydrogen 3.189 N/A LEU 467.A N GLN 470.A OE1 no hydrogen 3.077 N/A ARG 474.A NH1 ASP 478.A OD1 no hydrogen 3.315 N/A ILE 476.A N ASP 475.A OD1 no hydrogen 2.439 N/A ASP 478.A N ASP 475.A O no hydrogen 2.555 N/A ASP 481.A N GLY 473.A O no hydrogen 2.608 N/A ALA 482.A N GLY 473.A O no hydrogen 3.015 N/A VAL 483.A N LEU 492.A O no hydrogen 2.931 N/A ARG 484.A NE GLN 471.A OE1 no hydrogen 3.055 N/A ASP 485.A N GLU 490.A O no hydrogen 3.493 N/A GLN 487.A N ASP 485.A OD1 no hydrogen 3.013 N/A THR 488.A N ASP 485.A OD2 no hydrogen 2.709 N/A THR 488.A OG1 GLN 487.A OE1 no hydrogen 2.237 N/A GLU 490.A N THR 488.A O no hydrogen 2.683 N/A LEU 492.A N VAL 483.A O no hydrogen 2.845 N/A ASP 493.A N THR 460.A O no hydrogen 2.880 N/A THR 495.A N VAL 458.A O no hydrogen 2.985 N/A THR 495.A OG1 ILE 494.A O no hydrogen 2.735 N/A SER 498.A OG GLU 526.A OE2 no hydrogen 3.396 N/A GLY 500.A N PHE 225.A O no hydrogen 3.037 N/A VAL 502.A N SER 223.A O no hydrogen 2.866 N/A SER 503.A N LEU 518.A O no hydrogen 2.992 N/A SER 503.A OG LEU 518.A O no hydrogen 3.355 N/A VAL 504.A N TYR 220.A O no hydrogen 3.063 N/A ILE 505.A N ALA 516.A O no hydrogen 2.933 N/A THR 506.A OG1 PRO 507.A O no hydrogen 2.513 N/A THR 509.A N VAL 215.A O no hydrogen 2.739 N/A THR 511.A N GLY 508.A O no hydrogen 3.027 N/A THR 511.A OG1 GLY 508.A O no hydrogen 3.092 N/A SER 512.A N GLY 508.A O no hydrogen 3.347 N/A SER 512.A OG TYR 562.A OH no hydrogen 2.936 N/A ASN 513.A N SER 512.A OG no hydrogen 2.539 N/A GLN 514.A N SER 512.A OG no hydrogen 3.220 N/A VAL 517.A N ILE 539.A O no hydrogen 2.962 N/A LEU 518.A N SER 503.A O no hydrogen 2.886 N/A TYR 519.A N CYS 537.A O no hydrogen 2.883 N/A GLN 520.A N GLY 501.A O no hydrogen 2.883 N/A THR 525.A OG1 ASN 523.A O no hydrogen 2.916 N/A THR 525.A OG1 ASN 523.A OD1 no hydrogen 2.563 N/A GLU 526.A N ASN 523.A O no hydrogen 2.989 N/A PHE 531.A N LEU 538.A O no hydrogen 3.089 N/A GLN 532.A NE2 THR 533.A O no hydrogen 3.622 N/A THR 533.A N GLY 536.A O no hydrogen 2.832 N/A THR 533.A OG1 GLY 536.A O no hydrogen 2.126 N/A GLY 536.A N THR 533.A O no hydrogen 2.667 N/A GLY 536.A N THR 533.A OG1 no hydrogen 2.891 N/A CYS 537.A N TYR 519.A O no hydrogen 3.001 N/A CYS 537.A SG VAL 522.A O no hydrogen 3.518 N/A LEU 538.A N PHE 531.A O no hydrogen 3.226 N/A ILE 539.A N VAL 517.A O no hydrogen 2.872 N/A ASN 546.A ND2 TYR 548.A OH no hydrogen 3.027 N/A SER 547.A OG THR 572.A O no hydrogen 3.174 N/A SER 547.A OG THR 572.A OG1 no hydrogen 3.410 N/A ILE 554.A N ILE 558.A O no hydrogen 3.179 N/A GLY 555.A N ILE 558.A O no hydrogen 3.000 N/A ILE 558.A N GLY 555.A O no hydrogen 2.901 N/A CYS 559.A N TYR 571.A O no hydrogen 2.932 N/A CYS 559.A SG ILE 552.A O no hydrogen 2.943 N/A SER 561.A N ILE 569.A O no hydrogen 2.876 N/A SER 561.A OG ASP 551.A OD2 no hydrogen 2.504 N/A TYR 562.A N SER 561.A OG no hydrogen 2.592 N/A GLN 563.A N SER 567.A O no hydrogen 2.969 N/A SER 567.A N GLN 563.A O no hydrogen 2.937 N/A SER 567.A OG ILE 568.A O no hydrogen 3.441 N/A ILE 569.A N SER 561.A O no hydrogen 2.932 N/A THR 572.A OG1 SER 547.A OG no hydrogen 3.410 N/A MET 573.A N GLY 557.A O no hydrogen 2.874 N/A SER 584.A OG ASN 586.A OD1 no hydrogen 2.739 N/A ASN 586.A N SER 584.A OG no hydrogen 3.091 N/A ILE 588.A N PHE 925.A O no hydrogen 2.933 N/A ILE 590.A N LYS 923.A O no hydrogen 2.936 N/A ILE 592.A N GLN 921.A O no hydrogen 3.258 N/A ASN 593.A N ALA 920.A O no hydrogen 3.053 N/A PHE 594.A N ASN 593.A OD1 no hydrogen 2.863 N/A THR 595.A OG1 PHE 594.A O no hydrogen 2.661 N/A SER 597.A N THR 916.A O no hydrogen 2.951 N/A SER 597.A OG THR 916.A O no hydrogen 3.123 N/A THR 599.A N HIS 914.A O no hydrogen 2.977 N/A GLU 601.A N PHE 912.A O no hydrogen 3.034 N/A LEU 603.A N VAL 910.A O no hydrogen 2.982 N/A LYS 609.A NZ ASP 651.A OD2 no hydrogen 2.857 N/A LYS 609.A NZ PRO 712.A O no hydrogen 3.207 N/A THR 610.A OG1 THR 709.A O no hydrogen 3.535 N/A SER 611.A N THR 709.A O no hydrogen 2.945 N/A SER 611.A OG THR 610.A O no hydrogen 2.426 N/A CYS 614.A N ASP 613.A OD1 no hydrogen 2.194 N/A CYS 614.A SG ASP 613.A OD1 no hydrogen 3.749 N/A CYS 614.A SG THR 615.A OG1 no hydrogen 3.144 N/A TYR 617.A OH LEU 812.A O no hydrogen 3.229 N/A ILE 618.A N CYS 614.A O no hydrogen 3.015 N/A CYS 619.A N THR 615.A O no hydrogen 3.175 N/A CYS 619.A SG THR 615.A O no hydrogen 3.781 N/A GLY 620.A N THR 615.A O no hydrogen 3.309 N/A THR 623.A OG1 GLU 624.A OE2 no hydrogen 2.814 N/A GLU 624.A N GLU 624.A OE2 no hydrogen 2.457 N/A CYS 625.A N SER 622.A O no hydrogen 2.406 N/A ASN 627.A N THR 623.A O no hydrogen 2.363 N/A LEU 628.A N GLU 624.A O no hydrogen 2.949 N/A LEU 629.A N CYS 625.A O no hydrogen 2.845 N/A GLN 631.A N LEU 628.A O no hydrogen 2.947 N/A TYR 632.A N LEU 629.A O no hydrogen 3.009 N/A TYR 632.A OH ASP 844.A OD1 no hydrogen 3.140 N/A GLY 633.A N LEU 630.A O no hydrogen 3.174 N/A PHE 635.A N TYR 632.A O no hydrogen 3.352 N/A ARG 641.A N GLN 638.A O no hydrogen 2.844 N/A ARG 641.A NH1 ARG 641.A O no hydrogen 2.914 N/A ALA 642.A N GLN 638.A O no hydrogen 3.327 N/A LEU 643.A N LEU 639.A O no hydrogen 3.265 N/A THR 644.A N ASN 640.A O no hydrogen 2.940 N/A THR 644.A OG1 ASN 640.A O no hydrogen 3.005 N/A THR 644.A OG1 ASN 640.A OD1 no hydrogen 3.212 N/A GLY 645.A N ARG 641.A O no hydrogen 2.972 N/A ILE 646.A N ALA 642.A O no hydrogen 2.970 N/A ALA 647.A N LEU 643.A O no hydrogen 2.866 N/A ALA 647.A N THR 644.A O no hydrogen 3.239 N/A VAL 648.A N GLY 645.A O no hydrogen 3.255 N/A GLU 649.A N GLY 645.A O no hydrogen 3.063 N/A LYS 652.A N VAL 648.A O no hydrogen 3.127 N/A ASN 653.A N GLU 649.A O no hydrogen 2.900 N/A ASN 653.A ND2 VAL 605.A O no hydrogen 3.601 N/A THR 654.A N GLN 650.A O no hydrogen 3.041 N/A THR 654.A OG1 ASP 651.A O no hydrogen 2.976 N/A GLN 655.A N ASP 651.A O no hydrogen 3.024 N/A GLU 656.A N LYS 652.A O no hydrogen 2.912 N/A VAL 657.A N ASN 653.A O no hydrogen 2.990 N/A VAL 657.A N THR 654.A O no hydrogen 3.318 N/A PHE 658.A N THR 654.A O no hydrogen 2.993 N/A GLN 660.A NE2 GLU 656.A O no hydrogen 3.281 N/A LYS 662.A NZ GLY 741.A O no hydrogen 3.110 N/A ASP 672.A N ILE 670.A O no hydrogen 3.225 N/A PHE 676.A N PHE 673.A O no hydrogen 2.740 N/A SER 679.A N ASN 677.A OD1 no hydrogen 3.146 N/A SER 679.A OG ASN 677.A OD1 no hydrogen 2.736 N/A GLN 680.A NE2 GLN 785.A OE1 no hydrogen 2.580 N/A ILE 681.A N PHE 678.A O no hydrogen 2.695 N/A LEU 682.A N PHE 678.A O no hydrogen 3.486 N/A SER 686.A N ASP 684.A OD2 no hydrogen 3.219 N/A SER 686.A OG ASP 684.A OD2 no hydrogen 2.900 N/A LYS 687.A NZ ASP 684.A O no hydrogen 3.427 N/A LYS 687.A NZ ASP 684.A OD2 no hydrogen 3.436 N/A ARG 691.A N SER 689.A O no hydrogen 2.244 N/A SER 692.A OG ILE 681.A O no hydrogen 3.072 N/A SER 692.A OG LEU 682.A O no hydrogen 2.620 N/A GLU 695.A N GLU 695.A OE1 no hydrogen 2.845 N/A ASP 696.A N SER 692.A O no hydrogen 2.714 N/A LEU 697.A N PHE 693.A O no hydrogen 2.971 N/A LEU 698.A N ILE 694.A O no hydrogen 2.961 N/A PHE 699.A N GLU 695.A O no hydrogen 2.826 N/A ASN 700.A N ASP 696.A O no hydrogen 2.876 N/A LYS 701.A N LEU 697.A O no hydrogen 3.044 N/A LYS 701.A NZ SER 787.A O no hydrogen 2.698 N/A LYS 701.A NZ THR 791.A O no hydrogen 2.797 N/A VAL 702.A N PHE 699.A O no hydrogen 2.879 N/A THR 709.A OG1 GLY 707.A O no hydrogen 3.311 N/A THR 709.A OG1 LEU 708.A O no hydrogen 2.638 N/A LEU 711.A N LYS 609.A O no hydrogen 2.928 N/A ILE 720.A N THR 716.A O no hydrogen 3.180 N/A ALA 721.A N ASP 717.A O no hydrogen 2.926 N/A GLN 722.A N GLU 718.A O no hydrogen 2.972 N/A GLN 722.A NE2 GLU 718.A OE2 no hydrogen 2.249 N/A TYR 723.A N MET 719.A O no hydrogen 2.942 N/A THR 724.A N ILE 720.A O no hydrogen 2.918 N/A THR 724.A OG1 ALA 721.A O no hydrogen 2.921 N/A SER 725.A N ALA 721.A O no hydrogen 2.914 N/A SER 725.A OG ALA 721.A O no hydrogen 3.496 N/A SER 725.A OG GLN 722.A O no hydrogen 2.511 N/A ALA 726.A N GLN 722.A O no hydrogen 2.921 N/A LEU 727.A N TYR 723.A O no hydrogen 2.867 N/A LEU 728.A N THR 724.A O no hydrogen 3.109 N/A ALA 729.A N SER 725.A O no hydrogen 2.910 N/A GLY 730.A N ALA 726.A O no hydrogen 2.928 N/A ILE 732.A N LEU 728.A O no hydrogen 2.972 N/A THR 733.A N ALA 729.A O no hydrogen 2.938 N/A THR 733.A OG1 ALA 729.A O no hydrogen 2.933 N/A THR 733.A OG1 GLY 730.A O no hydrogen 3.098 N/A SER 734.A N GLY 730.A O no hydrogen 2.846 N/A GLY 739.A N TRP 736.A O no hydrogen 2.896 N/A ALA 740.A N THR 737.A O no hydrogen 2.918 N/A GLN 751.A N PRO 747.A O no hydrogen 3.115 N/A MET 752.A N PHE 748.A O no hydrogen 2.880 N/A ALA 753.A N ALA 749.A O no hydrogen 2.958 N/A TYR 754.A N MET 750.A O no hydrogen 2.951 N/A ARG 755.A N GLN 751.A O no hydrogen 2.928 N/A ARG 755.A NH1 LEU 899.A O no hydrogen 2.457 N/A PHE 756.A N MET 752.A O no hydrogen 2.963 N/A ASN 757.A N ALA 753.A O no hydrogen 2.939 N/A GLY 758.A N TYR 754.A O no hydrogen 2.926 N/A ILE 759.A N ARG 755.A O no hydrogen 3.100 N/A ILE 759.A N PHE 756.A O no hydrogen 3.172 N/A GLY 760.A N ASN 757.A O no hydrogen 3.455 N/A VAL 761.A N PHE 756.A O no hydrogen 3.202 N/A THR 762.A N GLN 956.A OE1 no hydrogen 2.584 N/A THR 762.A OG1 GLN 956.A OE1 no hydrogen 2.303 N/A VAL 765.A N THR 762.A O no hydrogen 3.326 N/A TYR 767.A N GLN 763.A O no hydrogen 3.386 N/A GLU 768.A N ASN 764.A O no hydrogen 2.931 N/A GLU 768.A N VAL 765.A O no hydrogen 2.968 N/A ASN 769.A N VAL 765.A O no hydrogen 3.138 N/A ASN 769.A N LEU 766.A O no hydrogen 2.952 N/A GLN 770.A NE2 GLY 674.A O no hydrogen 3.338 N/A ILE 773.A N ASN 769.A O no hydrogen 3.065 N/A ALA 774.A N GLN 770.A O no hydrogen 3.080 N/A ASN 775.A N LYS 771.A O no hydrogen 3.146 N/A GLN 776.A N LEU 772.A O no hydrogen 3.133 N/A PHE 777.A N ILE 773.A O no hydrogen 2.820 N/A ASN 778.A N ALA 774.A O no hydrogen 2.881 N/A SER 779.A N ASN 775.A O no hydrogen 2.735 N/A SER 779.A OG ASN 775.A O no hydrogen 3.077 N/A ALA 780.A N GLN 776.A O no hydrogen 2.846 N/A ILE 781.A N PHE 777.A O no hydrogen 2.995 N/A GLY 782.A N ASN 778.A O no hydrogen 2.635 N/A LYS 783.A N ALA 780.A O no hydrogen 2.898 N/A ILE 784.A N ILE 781.A O no hydrogen 2.903 N/A GLN 785.A N ILE 781.A O no hydrogen 3.475 N/A GLN 785.A NE2 ILE 781.A O no hydrogen 2.884 N/A SER 787.A OG THR 791.A OG1 no hydrogen 3.398 N/A LEU 788.A N ILE 784.A O no hydrogen 3.065 N/A SER 789.A N GLN 785.A O no hydrogen 2.333 N/A SER 789.A N ASP 786.A O no hydrogen 2.978 N/A SER 789.A OG GLN 785.A O no hydrogen 2.502 N/A SER 789.A OG ASP 786.A O no hydrogen 3.090 N/A SER 790.A N SER 787.A O no hydrogen 2.973 N/A SER 790.A OG ASP 786.A O no hydrogen 2.204 N/A SER 790.A OG SER 787.A O no hydrogen 3.556 N/A THR 791.A N SER 787.A O no hydrogen 2.665 N/A THR 791.A OG1 SER 787.A O no hydrogen 3.242 N/A THR 791.A OG1 SER 787.A OG no hydrogen 3.398 N/A GLN 799.A N LEU 795.A O no hydrogen 3.377 N/A ASP 800.A N GLY 796.A O no hydrogen 3.295 N/A ASP 800.A N LYS 797.A O no hydrogen 2.962 N/A VAL 801.A N LEU 798.A O no hydrogen 2.951 N/A GLN 804.A N ASP 800.A O no hydrogen 2.889 N/A ASN 805.A N VAL 802.A O no hydrogen 2.998 N/A ALA 806.A N VAL 802.A O no hydrogen 3.150 N/A GLN 807.A N ASN 803.A O no hydrogen 3.067 N/A ALA 808.A N ASN 805.A O no hydrogen 2.942 N/A LEU 809.A N ASN 805.A O no hydrogen 2.910 N/A ASN 810.A N ALA 806.A O no hydrogen 2.516 N/A THR 811.A OG1 GLN 807.A O no hydrogen 2.692 N/A LEU 812.A N ALA 808.A O no hydrogen 3.010 N/A LYS 814.A N ASN 810.A O no hydrogen 3.131 N/A GLN 815.A N THR 811.A O no hydrogen 3.252 N/A GLN 815.A N LEU 812.A O no hydrogen 3.008 N/A LEU 816.A N VAL 813.A O no hydrogen 2.956 N/A SER 817.A N LYS 814.A O no hydrogen 2.954 N/A SER 817.A OG LYS 814.A O no hydrogen 3.168 N/A SER 818.A N GLN 815.A O no hydrogen 2.857 N/A ALA 822.A N ASN 819.A O no hydrogen 2.939 N/A SER 825.A OG SER 818.A O no hydrogen 2.497 N/A SER 825.A OG ASN 819.A OD1 no hydrogen 3.181 N/A ILE 830.A N VAL 826.A O no hydrogen 2.883 N/A LEU 831.A N LEU 827.A O no hydrogen 2.910 N/A ALA 832.A N ASN 828.A O no hydrogen 2.910 N/A ARG 833.A N ILE 830.A O no hydrogen 3.208 N/A GLU 838.A N ASP 835.A O no hydrogen 3.307 N/A ALA 839.A N ASP 835.A O no hydrogen 2.950 N/A GLU 840.A N PRO 836.A O no hydrogen 2.941 N/A GLN 842.A N GLU 838.A O no hydrogen 3.023 N/A ILE 843.A N ALA 839.A O no hydrogen 2.895 N/A ASP 844.A N GLU 840.A O no hydrogen 2.948 N/A ARG 845.A N VAL 841.A O no hydrogen 2.944 N/A LEU 846.A N GLN 842.A O no hydrogen 3.045 N/A ILE 847.A N ILE 843.A O no hydrogen 2.946 N/A THR 848.A N ASP 844.A O no hydrogen 2.827 N/A THR 848.A OG1 TYR 632.A OH no hydrogen 3.275 N/A THR 848.A OG1 ASP 844.A O no hydrogen 2.919 N/A GLY 849.A N ARG 845.A O no hydrogen 3.093 N/A ARG 850.A N LEU 846.A O no hydrogen 2.947 N/A LEU 851.A N ILE 847.A O no hydrogen 2.932 N/A SER 853.A N GLY 849.A O no hydrogen 3.081 N/A SER 853.A OG GLN 815.A OE1 no hydrogen 2.256 N/A LEU 854.A N ARG 850.A O no hydrogen 3.024 N/A GLN 855.A N LEU 851.A O no hydrogen 2.932 N/A THR 856.A N GLN 852.A O no hydrogen 2.986 N/A THR 856.A OG1 GLN 852.A O no hydrogen 3.253 N/A TYR 857.A N SER 853.A O no hydrogen 3.045 N/A VAL 858.A N LEU 854.A O no hydrogen 2.993 N/A THR 859.A N GLN 855.A O no hydrogen 3.034 N/A THR 859.A OG1 GLN 855.A O no hydrogen 3.453 N/A GLN 860.A N THR 856.A O no hydrogen 3.023 N/A GLN 861.A N TYR 857.A O no hydrogen 2.949 N/A LEU 862.A N VAL 858.A O no hydrogen 2.937 N/A ILE 863.A N THR 859.A O no hydrogen 3.073 N/A ARG 864.A N GLN 860.A O no hydrogen 2.900 N/A ALA 865.A N LEU 862.A O no hydrogen 3.144 N/A ALA 866.A N LEU 862.A O no hydrogen 3.066 N/A ARG 869.A N ALA 865.A O no hydrogen 2.983 N/A ALA 870.A N ALA 866.A O no hydrogen 2.924 N/A SER 871.A N GLU 867.A O no hydrogen 2.945 N/A SER 871.A N ILE 868.A O no hydrogen 3.231 N/A ALA 872.A N ILE 868.A O no hydrogen 2.943 N/A ASN 873.A N ARG 869.A O no hydrogen 3.265 N/A ALA 875.A N SER 871.A O no hydrogen 2.934 N/A ALA 876.A N ALA 872.A O no hydrogen 2.851 N/A THR 877.A N ASN 873.A O no hydrogen 2.983 N/A THR 877.A OG1 LEU 874.A O no hydrogen 2.658 N/A LYS 878.A N LEU 874.A O no hydrogen 2.962 N/A MET 879.A N ALA 875.A O no hydrogen 2.847 N/A SER 880.A N ALA 876.A O no hydrogen 2.971 N/A SER 880.A N THR 877.A O no hydrogen 3.264 N/A SER 880.A OG THR 877.A O no hydrogen 3.107 N/A GLU 881.A N THR 877.A O no hydrogen 2.915 N/A CYS 882.A N LYS 878.A O no hydrogen 2.873 N/A LEU 884.A N SER 880.A O no hydrogen 2.927 N/A ARG 889.A N SER 887.A OG no hydrogen 2.923 N/A ARG 889.A NH1 GLU 881.A OE1 no hydrogen 3.239 N/A PHE 892.A N ARG 889.A O no hydrogen 3.263 N/A HIS 898.A ND1 CYS 893.A O no hydrogen 2.462 N/A LEU 899.A N VAL 915.A O no hydrogen 3.157 N/A MET 900.A N VAL 915.A O no hydrogen 3.076 N/A SER 901.A OG CYS 882.A O no hydrogen 2.654 N/A PHE 902.A N LEU 913.A O no hydrogen 2.957 N/A GLN 904.A N VAL 911.A O no hydrogen 2.922 N/A GLY 909.A N ALA 906.A O no hydrogen 2.945 N/A VAL 910.A N LEU 603.A O no hydrogen 2.900 N/A VAL 911.A N GLN 904.A O no hydrogen 2.944 N/A PHE 912.A N GLU 601.A O no hydrogen 2.898 N/A LEU 913.A N PHE 902.A O no hydrogen 2.963 N/A HIS 914.A N THR 599.A O no hydrogen 2.932 N/A VAL 915.A N MET 900.A O no hydrogen 2.815 N/A THR 916.A N SER 597.A O no hydrogen 2.963 N/A TYR 917.A N TYR 897.A O no hydrogen 3.296 N/A TYR 917.A OH ASN 958.A O no hydrogen 3.069 N/A VAL 918.A N THR 595.A O no hydrogen 2.991 N/A ALA 920.A N ASN 593.A O no hydrogen 2.857 N/A GLU 922.A N GLU 922.A OE1 no hydrogen 2.487 N/A LYS 923.A N ILE 590.A O no hydrogen 2.961 N/A ASN 924.A N ASN 924.A OD1 no hydrogen 2.538 N/A PHE 925.A N ILE 588.A O no hydrogen 2.868 N/A THR 926.A N SER 947.A O no hydrogen 3.415 N/A THR 927.A N ASN 586.A O no hydrogen 2.842 N/A THR 927.A OG1 PHE 945.A O no hydrogen 3.139 N/A ILE 931.A N HIS 938.A O no hydrogen 3.459 N/A CYS 932.A N VAL 983.A O no hydrogen 3.244 N/A HIS 933.A N LYS 936.A O no hydrogen 2.930 N/A LYS 936.A N HIS 933.A O no hydrogen 2.915 N/A ALA 937.A N GLY 974.A O no hydrogen 3.073 N/A PHE 939.A N PHE 971.A O no hydrogen 2.926 N/A ARG 941.A N ASN 969.A O no hydrogen 2.896 N/A VAL 946.A N PHE 953.A O no hydrogen 3.025 N/A SER 947.A OG THR 926.A O no hydrogen 3.381 N/A THR 950.A N ASN 948.A OD1 no hydrogen 3.339 N/A PHE 953.A N VAL 946.A O no hydrogen 2.788 N/A THR 955.A OG1 GLN 956.A O no hydrogen 2.775 N/A THR 966.A N ASN 969.A OD1 no hydrogen 2.994 N/A ASN 969.A N THR 966.A O no hydrogen 3.461 N/A ASN 969.A ND2 ILE 964.A O no hydrogen 2.884 N/A THR 970.A N THR 966.A O no hydrogen 3.241 N/A THR 970.A OG1 THR 966.A O no hydrogen 3.223 N/A PHE 971.A N PHE 939.A O no hydrogen 2.867 N/A VAL 983.A N ALA 930.A O no hydrogen 3.391 N/A THR 986.A OG1 VAL 987.A O no hydrogen 3.526 N/A TYR 988.A N ILE 965.A O no hydrogen 2.870 N/A GLN 992.A N ASP 989.A O no hydrogen 2.687 N/A