Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7c97_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 16.A N SER 13.A O no hydrogen 2.655 N/A ILE 17.A N SER 13.A O no hydrogen 3.031 N/A SER 19.A N MET 16.A O no hydrogen 2.616 N/A TRP 20.A N MET 16.A O no hydrogen 3.185 N/A SER 21.A OG HIS 91.A ND1 no hydrogen 3.135 N/A PHE 22.A N MET 89.A O no hydrogen 2.849 N/A VAL 25.A N HIS 91.A O no hydrogen 3.311 N/A LYS 26.A N ASP 41.A O no hydrogen 3.313 N/A LEU 43.A N GLU 29.A O no hydrogen 3.114 N/A CYS 45.A SG GLU 39.A O no hydrogen 3.998 N/A TYR 55.A N THR 80.A O no hydrogen 3.247 N/A CYS 57.A N TYR 62.A O no hydrogen 3.355 N/A CYS 57.A SG CYS 75.A O no hydrogen 3.996 N/A LYS 61.A NZ GLU 73.A OE2 no hydrogen 3.265 N/A TYR 62.A OH GLU 73.A OE1 no hydrogen 3.422 N/A LYS 63.A NZ GLY 60.A O no hydrogen 2.261 N/A ARG 68.A NH2 TYR 55.A OH no hydrogen 3.034 N/A CYS 72.A N VAL 77.A O no hydrogen 2.853 N/A VAL 77.A N CYS 75.A O no hydrogen 2.432 N/A VAL 79.A N VAL 70.A O no hydrogen 3.284 N/A THR 80.A OG1 GLU 78.A O no hydrogen 3.303 N/A THR 82.A OG1 VAL 52.A O no hydrogen 2.817 N/A VAL 84.A N GLN 81.A O no hydrogen 3.291 N/A ARG 85.A N THR 82.A O no hydrogen 3.440 N/A ARG 85.A NH1 CYS 45.A O no hydrogen 2.974 N/A ARG 85.A NH2 PHE 44.A O no hydrogen 3.073 N/A ARG 85.A NH2 CYS 45.A O no hydrogen 3.271 N/A ARG 86.A N LYS 83.A O no hydrogen 3.002 N/A ARG 88.A NH2 GLU 78.A OE2 no hydrogen 2.810 N/A HIS 91.A ND1 GLY 23.A O no hydrogen 3.093 N/A HIS 91.A NE2 GLU 93.A OE1 no hydrogen 3.055 N/A ILE 92.A N LEU 229.A O no hydrogen 2.841 N/A ALA 95.A N ASN 263.A OD1 no hydrogen 3.107 N/A SER 96.A OG PRO 97.A O no hydrogen 2.891 N/A THR 98.A OG1 ALA 99.A O no hydrogen 3.413 N/A THR 98.A OG1 GLN 287.A OE1 no hydrogen 2.557 N/A HIS 100.A N MET 224.A O no hydrogen 3.313 N/A TRP 102.A N HIS 100.A ND1 no hydrogen 3.384 N/A LYS 105.A N ILE 101.A O no hydrogen 3.223 N/A SER 106.A N TRP 102.A O no hydrogen 3.109 N/A SER 109.A OG LEU 104.A O no hydrogen 3.493 N/A ILE 111.A N PHE 103.A O no hydrogen 3.174 N/A LEU 113.A N SER 109.A O no hydrogen 2.805 N/A LEU 115.A N GLY 112.A O no hydrogen 2.772 N/A ARG 120.A NH1 ARG 120.A O no hydrogen 2.964 N/A ASP 121.A N PRO 118.A O no hydrogen 2.720 N/A ILE 122.A N PRO 118.A O no hydrogen 3.408 N/A GLU 123.A N LEU 119.A O no hydrogen 3.308 N/A VAL 125.A N ILE 122.A O no hydrogen 2.956 N/A LEU 126.A N ILE 122.A O no hydrogen 2.957 N/A PHE 128.A N VAL 125.A O no hydrogen 3.284 N/A SER 130.A OG ARG 124.A O no hydrogen 2.643 N/A VAL 132.A N LYS 166.A O no hydrogen 2.988 N/A VAL 133.A N GLN 145.A O no hydrogen 3.325 N/A ILE 134.A N ASP 164.A O no hydrogen 2.531 N/A THR 139.A OG1 GLY 136.A O no hydrogen 3.360 N/A ARG 143.A NH2 LEU 175.A O no hydrogen 3.418 N/A GLN 145.A NE2 ASN 140.A O no hydrogen 3.600 N/A GLN 145.A NE2 GLU 142.A OE1 no hydrogen 2.272 N/A TYR 152.A N THR 148.A O no hydrogen 3.164 N/A ASP 154.A N GLU 150.A O no hydrogen 2.256 N/A ALA 155.A N TYR 152.A O no hydrogen 2.631 N/A LEU 156.A N TYR 152.A O no hydrogen 2.392 N/A GLU 158.A N ALA 155.A O no hydrogen 3.314 N/A GLU 162.A N ASP 161.A OD2 no hydrogen 2.853 N/A LYS 166.A N VAL 132.A O no hydrogen 2.879 N/A ALA 171.A N GLY 168.A O no hydrogen 2.824 N/A ALA 174.A N ALA 171.A O no hydrogen 2.550 N/A LEU 175.A N ALA 171.A O no hydrogen 2.940 N/A LEU 176.A N ILE 172.A O no hydrogen 3.174 N/A LYS 177.A N GLN 173.A O no hydrogen 3.346 N/A SER 178.A OG ALA 174.A O no hydrogen 3.118 N/A SER 178.A OG LEU 175.A O no hydrogen 3.475 N/A MET 179.A N LEU 175.A O no hydrogen 3.266 N/A CYS 185.A N GLU 182.A O no hydrogen 3.218 N/A CYS 185.A SG GLU 212.A OE2 no hydrogen 3.522 N/A GLU 186.A N GLU 182.A O no hydrogen 3.318 N/A GLN 187.A N GLN 183.A O no hydrogen 3.074 N/A LEU 188.A N CYS 185.A O no hydrogen 3.001 N/A ARG 189.A N CYS 185.A O no hydrogen 2.953 N/A ARG 189.A N GLU 186.A O no hydrogen 2.902 N/A LEU 192.A N LEU 188.A O no hydrogen 3.251 N/A ASN 193.A N GLU 190.A O no hydrogen 2.990 N/A THR 195.A OG1 GLU 191.A O no hydrogen 2.945 N/A LYS 200.A N SER 197.A OG no hydrogen 2.580 N/A ARG 201.A N SER 197.A O no hydrogen 2.752 N/A LYS 202.A N THR 199.A O no hydrogen 3.342 N/A LYS 203.A N THR 199.A O no hydrogen 3.128 N/A LEU 204.A N LYS 200.A O no hydrogen 2.770 N/A LYS 206.A N LYS 203.A O no hydrogen 2.705 N/A ARG 207.A N LYS 203.A O no hydrogen 3.181 N/A ARG 207.A NH2 GLU 184.A OE1 no hydrogen 3.176 N/A ILE 208.A N LEU 204.A O no hydrogen 3.354 N/A LYS 209.A N LYS 206.A O no hydrogen 3.225 N/A LEU 210.A N LYS 206.A O no hydrogen 3.272 N/A LEU 210.A N ARG 207.A O no hydrogen 2.711 N/A LEU 211.A N ARG 207.A O no hydrogen 3.057 N/A ALA 213.A N LEU 210.A O no hydrogen 2.797 N/A PHE 214.A N LEU 210.A O no hydrogen 3.273 N/A SER 217.A N ALA 213.A O no hydrogen 3.382 N/A SER 217.A OG ASN 219.A OD1 no hydrogen 2.255 N/A SER 217.A OG ALA 1305.A O no hydrogen 3.484 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.278 N/A LEU 226.A N THR 98.A O no hydrogen 2.981 N/A THR 227.A OG1 ILE 225.A O no hydrogen 3.538 N/A VAL 231.A N GLY 90.A O no hydrogen 3.521 N/A LEU 232.A N TYR 256.A OH no hydrogen 3.436 N/A LEU 236.A N PRO 233.A O no hydrogen 3.157 N/A ARG 237.A NH1 ASN 253.A OD1 no hydrogen 2.861 N/A ARG 237.A NH2 LEU 232.A O no hydrogen 3.408 N/A LEU 242.A N ARG 246.A O no hydrogen 2.721 N/A ALA 248.A N VAL 240.A O no hydrogen 3.038 N/A THR 249.A OG1 SER 250.A O no hydrogen 3.197 N/A SER 250.A N PRO 238.A O no hydrogen 3.251 N/A ASN 253.A ND2 ARG 237.A O no hydrogen 3.328 N/A ASN 253.A ND2 THR 249.A OG1 no hydrogen 3.232 N/A LEU 255.A N LEU 252.A O no hydrogen 2.917 N/A TYR 256.A N LEU 252.A O no hydrogen 2.780 N/A ARG 257.A NH1 ASN 253.A O no hydrogen 3.505 N/A ARG 258.A N LEU 255.A O no hydrogen 3.195 N/A VAL 259.A N TYR 256.A O no hydrogen 3.285 N/A ILE 260.A N TYR 256.A O no hydrogen 3.100 N/A ASN 261.A N ARG 257.A O no hydrogen 3.267 N/A ARG 262.A NH1 MET 285.A O no hydrogen 3.122 N/A ASN 263.A N VAL 259.A O no hydrogen 2.736 N/A ASN 263.A ND2 GLU 93.A O no hydrogen 3.387 N/A ASN 264.A N ILE 260.A O no hydrogen 3.048 N/A ARG 265.A N ASN 261.A O no hydrogen 3.036 N/A ARG 265.A NE GLU 282.A OE2 no hydrogen 3.091 N/A LEU 266.A N ARG 262.A O no hydrogen 3.084 N/A LYS 267.A N ASN 263.A O no hydrogen 3.258 N/A ARG 268.A N ARG 265.A O no hydrogen 2.531 N/A LEU 269.A N ARG 265.A O no hydrogen 3.106 N/A ASP 271.A N ARG 268.A O no hydrogen 2.730 N/A LEU 272.A N ARG 268.A O no hydrogen 2.866 N/A ALA 273.A N LEU 269.A O no hydrogen 2.993 N/A ALA 274.A N LEU 269.A O no hydrogen 3.376 N/A ILE 278.A N PRO 275.A O no hydrogen 3.474 N/A GLU 282.A N VAL 279.A O no hydrogen 2.905 N/A LYS 283.A N VAL 279.A O no hydrogen 3.195 N/A ARG 284.A NE ASN 281.A OD1 no hydrogen 3.482 N/A MET 285.A N GLU 282.A O no hydrogen 2.652 N/A LEU 286.A N GLU 282.A O no hydrogen 2.621 N/A GLN 287.A N LYS 283.A O no hydrogen 2.906 N/A ALA 289.A N LEU 286.A O no hydrogen 2.531 N/A VAL 290.A N LEU 286.A O no hydrogen 3.077 N/A ASP 291.A N GLN 287.A O no hydrogen 3.404 N/A LEU 293.A N VAL 290.A O no hydrogen 3.278 N/A LEU 294.A N VAL 290.A O no hydrogen 3.356 N/A ASN 296.A N SER 313.A OG no hydrogen 2.806 N/A ASN 296.A ND2 LEU 311.A O no hydrogen 3.363 N/A ARG 298.A NE ASP 295.A OD2 no hydrogen 2.730 N/A ARG 298.A NH2 ASP 295.A OD2 no hydrogen 3.559 N/A THR 304.A N ARG 309.A O no hydrogen 3.025 N/A THR 304.A OG1 GLY 305.A O no hydrogen 3.264 N/A LYS 308.A N ASN 307.A OD1 no hydrogen 2.405 N/A LEU 314.A N LEU 293.A O no hydrogen 3.191 N/A ALA 315.A N LEU 294.A O no hydrogen 2.872 N/A MET 317.A N LEU 314.A O no hydrogen 2.920 N/A ILE 339.A N ASP 448.A O no hydrogen 3.319 N/A TYR 344.A OH GLN 432.A OE1 no hydrogen 2.886 N/A CYS 350.A SG GLY 351.A O no hydrogen 3.250 N/A LEU 352.A N VAL 424.A O no hydrogen 3.208 N/A LYS 354.A N ILE 426.A O no hydrogen 3.154 N/A LYS 355.A NZ GLU 427.A OE2 no hydrogen 3.518 N/A MET 356.A N PRO 353.A O no hydrogen 3.170 N/A ALA 357.A N PRO 353.A O no hydrogen 3.013 N/A LEU 358.A N LYS 354.A O no hydrogen 3.145 N/A GLU 359.A N MET 356.A O no hydrogen 2.641 N/A LEU 360.A N MET 356.A O no hydrogen 3.030 N/A PHE 361.A N ALA 357.A O no hydrogen 3.298 N/A ILE 365.A N PHE 361.A O no hydrogen 3.072 N/A TYR 366.A N LYS 362.A O no hydrogen 3.020 N/A GLY 367.A N PHE 364.A O no hydrogen 2.866 N/A LEU 369.A N ILE 365.A O no hydrogen 3.175 N/A LEU 371.A N GLY 367.A O no hydrogen 2.860 N/A LEU 371.A N LYS 368.A O no hydrogen 2.872 N/A ARG 372.A N LYS 368.A O no hydrogen 2.754 N/A ALA 375.A N LEU 369.A O no hydrogen 2.575 N/A ALA 380.A N THR 377.A O no hydrogen 3.065 N/A ALA 381.A N ILE 378.A O no hydrogen 2.992 N/A LYS 382.A N ILE 378.A O no hydrogen 3.069 N/A LYS 383.A NZ LYS 379.A O no hydrogen 2.411 N/A MET 384.A N ALA 381.A O no hydrogen 3.204 N/A VAL 385.A N ALA 381.A O no hydrogen 3.262 N/A GLU 388.A N VAL 385.A O no hydrogen 3.314 N/A VAL 392.A N GLU 389.A O no hydrogen 3.207 N/A ASP 394.A N VAL 391.A O no hydrogen 3.014 N/A ILE 395.A N VAL 391.A O no hydrogen 3.169 N/A LEU 396.A N VAL 392.A O no hydrogen 2.704 N/A GLU 398.A N ILE 395.A O no hydrogen 3.118 N/A VAL 399.A N ILE 395.A O no hydrogen 3.239 N/A VAL 405.A N PHE 421.A O no hydrogen 3.000 N/A LEU 407.A N GLN 419.A O no hydrogen 3.276 N/A ASN 408.A N ALA 451.A O no hydrogen 3.330 N/A ARG 409.A NH1 TYR 441.A O no hydrogen 3.377 N/A THR 412.A OG1 ASN 408.A OD1 no hydrogen 2.880 N/A THR 412.A OG1 ARG 409.A O no hydrogen 2.931 N/A THR 412.A OG1 ALA 410.A O no hydrogen 3.415 N/A GLY 417.A N HIS 414.A O no hydrogen 2.791 N/A GLN 419.A N LEU 407.A O no hydrogen 3.405 N/A GLN 419.A NE2 LEU 416.A O no hydrogen 3.212 N/A ALA 420.A N MET 468.A O no hydrogen 3.185 N/A PHE 421.A N VAL 405.A O no hydrogen 2.934 N/A GLU 422.A N HIS 348.A O no hydrogen 3.238 N/A VAL 424.A N CYS 350.A O no hydrogen 3.095 N/A ILE 426.A N LEU 352.A O no hydrogen 3.401 N/A GLY 428.A N GLU 427.A OE2 no hydrogen 2.333 N/A LEU 433.A N VAL 341.A O no hydrogen 3.434 N/A VAL 437.A N HIS 434.A O no hydrogen 3.163 N/A CYS 438.A N PRO 435.A O no hydrogen 3.347 N/A CYS 438.A SG PRO 435.A O no hydrogen 3.072 N/A ALA 440.A N VAL 437.A O no hydrogen 2.935 N/A ALA 443.A N CYS 438.A O no hydrogen 2.897 N/A ASP 444.A N ASP 444.A OD1 no hydrogen 2.411 N/A MET 450.A N SER 337.A O no hydrogen 3.268 N/A VAL 452.A N GLY 335.A O no hydrogen 3.187 N/A HIS 453.A N LEU 406.A O no hydrogen 2.988 N/A THR 457.A OG1 GLU 459.A OE1 no hydrogen 2.846 N/A GLU 459.A N THR 457.A OG1 no hydrogen 3.005 N/A GLU 459.A N GLU 459.A OE1 no hydrogen 2.878 N/A GLN 461.A NE2 PRO 455.A O no hydrogen 3.203 N/A GLU 463.A N GLU 459.A O no hydrogen 3.420 N/A ARG 465.A N LEU 462.A O no hydrogen 2.814 N/A ARG 465.A NH2 GLU 402.A O no hydrogen 3.502 N/A ARG 465.A NH2 GLU 422.A OE2 no hydrogen 2.836 N/A ALA 466.A N LEU 462.A O no hydrogen 2.590 N/A MET 468.A N GLU 463.A O no hydrogen 3.239 N/A SER 470.A OG GLN 419.A OE1 no hydrogen 3.052 N/A ASN 472.A N MET 469.A O no hydrogen 3.467 N/A SER 476.A N GLU 481.A O no hydrogen 3.462 N/A SER 476.A OG ASN 479.A O no hydrogen 3.038 N/A SER 476.A OG GLU 481.A O no hydrogen 3.322 N/A ASN 479.A N SER 476.A O no hydrogen 3.426 N/A ILE 483.A N ILE 474.A O no hydrogen 3.262 N/A SER 487.A OG VAL 485.A O no hydrogen 3.222 N/A LEU 492.A N ASP 489.A O no hydrogen 3.176 N/A GLY 493.A N ASP 489.A O no hydrogen 3.075 N/A LEU 494.A N VAL 490.A O no hydrogen 2.949 N/A TYR 495.A N VAL 491.A O no hydrogen 3.363 N/A TYR 496.A N LEU 492.A O no hydrogen 3.205 N/A MET 497.A N GLY 493.A O no hydrogen 3.044 N/A THR 498.A N LEU 494.A O no hydrogen 3.003 N/A THR 498.A OG1 THR 498.A O no hydrogen 2.457 N/A THR 498.A OG1 GLN 578.A O no hydrogen 3.295 N/A CYS 501.A N HIS 529.A O no hydrogen 3.402 N/A ASN 503.A ND2 ASN 692.A O no hydrogen 3.567 N/A LYS 505.A NZ GLY 524.A O no hydrogen 3.382 N/A GLY 508.A N ARG 531.A O no hydrogen 2.999 N/A LEU 511.A N LYS 533.A O no hydrogen 2.663 N/A THR 512.A OG1 THR 512.A O no hydrogen 2.114 N/A ALA 517.A N GLY 513.A O no hydrogen 3.154 N/A GLU 518.A N PRO 514.A O no hydrogen 3.256 N/A LEU 520.A N GLU 516.A O no hydrogen 3.040 N/A TYR 521.A N GLU 518.A O no hydrogen 2.718 N/A ARG 522.A N GLU 518.A O no hydrogen 2.990 N/A SER 523.A N ARG 519.A O no hydrogen 3.081 N/A SER 527.A N LYS 505.A O no hydrogen 3.312 N/A HIS 529.A ND1 HIS 529.A O no hydrogen 2.844 N/A ARG 531.A NH2 CYS 501.A O no hydrogen 3.363 N/A VAL 532.A N THR 556.A O no hydrogen 2.890 N/A LYS 533.A N MET 509.A O no hydrogen 3.251 N/A VAL 534.A N LYS 554.A O no hydrogen 3.233 N/A GLY 545.A N ALA 543.A O no hydrogen 2.647 N/A VAL 548.A N GLU 540.A O no hydrogen 3.301 N/A LYS 550.A NZ GLU 540.A OE1 no hydrogen 2.971 N/A LYS 554.A NZ SER 552.A OG no hydrogen 3.133 N/A THR 556.A N VAL 532.A O no hydrogen 3.036 N/A THR 556.A OG1 TYR 573.A OH no hydrogen 3.055 N/A THR 556.A OG1 ASN 577.A OD1 no hydrogen 3.508 N/A THR 557.A N THR 556.A OG1 no hydrogen 2.628 N/A VAL 558.A N ALA 530.A O no hydrogen 3.264 N/A GLY 559.A N THR 557.A OG1 no hydrogen 2.521 N/A ARG 560.A N THR 557.A OG1 no hydrogen 3.159 N/A ARG 560.A NE THR 498.A OG1 no hydrogen 3.336 N/A ILE 562.A N VAL 558.A O no hydrogen 3.428 N/A LEU 563.A N GLY 559.A O no hydrogen 3.236 N/A TRP 564.A N ALA 561.A O no hydrogen 2.750 N/A TYR 573.A N GLU 538.A OE1 no hydrogen 3.273 N/A TYR 573.A OH THR 556.A OG1 no hydrogen 3.055 N/A ILE 575.A N PRO 572.A O no hydrogen 3.113 N/A SER 586.A N LYS 582.A O no hydrogen 3.472 N/A MET 588.A N ALA 584.A O no hydrogen 3.142 N/A LEU 589.A N ILE 585.A O no hydrogen 3.186 N/A THR 591.A N LYS 587.A O no hydrogen 2.876 N/A THR 591.A OG1 LYS 587.A O no hydrogen 3.449 N/A CYS 592.A SG THR 601.A OG1 no hydrogen 3.096 N/A TYR 593.A N ASN 590.A O no hydrogen 2.863 N/A ARG 594.A N ASN 590.A O no hydrogen 3.115 N/A ILE 595.A N THR 591.A O no hydrogen 3.257 N/A GLY 597.A N TYR 593.A O no hydrogen 3.144 N/A VAL 602.A N LEU 598.A O no hydrogen 3.417 N/A ALA 605.A N THR 601.A O no hydrogen 2.860 N/A TYR 610.A N ASP 606.A O no hydrogen 2.942 N/A TYR 610.A OH LEU 345.A O no hydrogen 3.006 N/A THR 611.A N ILE 608.A O no hydrogen 2.960 N/A THR 611.A OG1 GLN 607.A O no hydrogen 2.814 N/A GLY 612.A N ILE 608.A O no hydrogen 2.614 N/A PHE 613.A N MET 609.A O no hydrogen 3.286 N/A TYR 615.A N THR 611.A O no hydrogen 3.159 N/A ALA 616.A N GLY 612.A O no hydrogen 3.238 N/A ALA 617.A N ALA 614.A O no hydrogen 3.217 N/A SER 619.A N ALA 616.A O no hydrogen 3.176 N/A SER 622.A OG VAL 623.A O no hydrogen 3.295 N/A GLY 624.A N ASP 627.A OD2 no hydrogen 2.199 N/A LYS 634.A NZ THR 744.A O no hydrogen 3.244 N/A ILE 637.A N LYS 633.A O no hydrogen 3.273 N/A ILE 638.A N LYS 634.A O no hydrogen 3.125 N/A ILE 638.A N HIS 635.A O no hydrogen 2.847 N/A SER 639.A N HIS 635.A O no hydrogen 2.737 N/A SER 639.A OG HIS 635.A O no hydrogen 3.523 N/A GLU 640.A N GLU 636.A O no hydrogen 3.118 N/A GLU 642.A N ILE 638.A O no hydrogen 2.943 N/A ALA 643.A N SER 639.A O no hydrogen 2.764 N/A GLU 644.A N GLU 640.A O no hydrogen 2.565 N/A GLU 647.A N ALA 643.A O no hydrogen 3.174 N/A ILE 648.A N VAL 645.A O no hydrogen 3.240 N/A GLN 649.A N VAL 645.A O no hydrogen 3.292 N/A PHE 652.A N ILE 648.A O no hydrogen 3.347 N/A PHE 652.A N GLN 649.A O no hydrogen 3.235 N/A GLN 653.A N GLN 649.A O no hydrogen 2.906 N/A SER 654.A N GLU 650.A O no hydrogen 2.898 N/A GLY 655.A N PHE 652.A O no hydrogen 3.316 N/A VAL 657.A N GLN 651.A O no hydrogen 3.103 N/A GLY 660.A N THR 658.A OG1 no hydrogen 3.363 N/A ARG 662.A N ALA 659.A O no hydrogen 2.500 N/A ARG 662.A NE GLN 649.A OE1 no hydrogen 2.774 N/A TYR 663.A N ALA 659.A O no hydrogen 2.599 N/A TYR 663.A OH ILE 738.A O no hydrogen 2.467 N/A ASN 664.A N GLY 660.A O no hydrogen 3.489 N/A VAL 666.A N ARG 662.A O no hydrogen 3.186 N/A VAL 666.A N TYR 663.A O no hydrogen 2.838 N/A ILE 667.A N TYR 663.A O no hydrogen 3.039 N/A ASP 668.A N ASN 664.A O no hydrogen 3.378 N/A TRP 670.A N VAL 666.A O no hydrogen 3.433 N/A ALA 671.A N ILE 667.A O no hydrogen 3.169 N/A ALA 673.A N ILE 669.A O no hydrogen 3.322 N/A ASN 674.A N TRP 670.A O no hydrogen 2.480 N/A ASP 675.A N ALA 671.A O no hydrogen 3.264 N/A ARG 676.A N ALA 672.A O no hydrogen 3.129 N/A LYS 679.A N ASP 675.A O no hydrogen 3.358 N/A MET 681.A N SER 678.A O no hydrogen 3.065 N/A MET 682.A N SER 678.A O no hydrogen 2.924 N/A ASN 684.A N MET 681.A O no hydrogen 2.616 N/A LEU 685.A N MET 681.A O no hydrogen 3.061 N/A GLN 686.A N MET 682.A O no hydrogen 3.005 N/A ARG 693.A N GLN 696.A O no hydrogen 3.080 N/A ARG 693.A NE GLN 696.A O no hydrogen 3.289 N/A ARG 693.A NH1 GLU 698.A OE1 no hydrogen 2.296 N/A GLU 698.A N ILE 691.A O no hydrogen 3.075 N/A GLN 700.A NE2 VAL 701.A O no hydrogen 3.440 N/A ASN 704.A ND2 ASP 627.A O no hydrogen 2.746 N/A SER 705.A OG SER 622.A O no hydrogen 2.812 N/A TYR 707.A N ASN 704.A O no hydrogen 2.482 N/A MET 708.A N ASN 704.A O no hydrogen 2.999 N/A ALA 710.A N TYR 707.A O no hydrogen 2.943 N/A ASP 711.A N TYR 707.A O no hydrogen 2.894 N/A SER 712.A N MET 708.A O no hydrogen 3.147 N/A SER 712.A OG MET 708.A O no hydrogen 2.740 N/A ARG 715.A N MET 709.A O no hydrogen 3.263 N/A ALA 718.A N SER 717.A OG no hydrogen 2.531 N/A GLN 720.A N SER 717.A O no hydrogen 2.833 N/A ILE 721.A N SER 717.A O no hydrogen 3.107 N/A ARG 722.A N ALA 718.A O no hydrogen 3.296 N/A ARG 722.A NE SER 678.A OG no hydrogen 2.324 N/A GLN 723.A N GLN 720.A O no hydrogen 3.161 N/A LEU 724.A N ILE 721.A O no hydrogen 3.197 N/A ALA 725.A N ILE 721.A O no hydrogen 3.257 N/A LYS 733.A N SER 737.A O no hydrogen 3.083 N/A LYS 733.A NZ SER 737.A OG no hydrogen 2.301 N/A GLY 736.A N LYS 733.A O no hydrogen 3.069 N/A ILE 739.A N MET 731.A O no hydrogen 3.013 N/A THR 744.A OG1 THR 744.A O no hydrogen 2.128 N/A ASN 746.A ND2 ALA 725.A O no hydrogen 2.272 N/A ASN 746.A ND2 GLY 726.A O no hydrogen 2.972 N/A PHE 747.A N GLN 723.A O no hydrogen 3.112 N/A ARG 748.A NE MET 628.A O no hydrogen 3.497 N/A GLU 749.A N ASN 746.A OD1 no hydrogen 3.350 N/A ASN 752.A N GLN 755.A OE1 no hydrogen 3.274 N/A GLN 755.A N ASN 752.A O no hydrogen 3.069 N/A GLN 755.A N ASN 752.A OD1 no hydrogen 3.350 N/A TYR 756.A N ASN 752.A O no hydrogen 3.079 N/A TYR 756.A N VAL 753.A O no hydrogen 2.996 N/A PHE 757.A N VAL 753.A O no hydrogen 2.901 N/A SER 759.A N GLN 755.A O no hydrogen 3.351 N/A THR 760.A N TYR 756.A O no hydrogen 2.786 N/A THR 760.A OG1 TYR 756.A O no hydrogen 2.919 N/A ARG 764.A N HIS 761.A O no hydrogen 2.521 N/A LYS 765.A N HIS 761.A O no hydrogen 3.269 N/A GLY 766.A N GLY 762.A O no hydrogen 3.164 N/A LEU 767.A N ARG 764.A O no hydrogen 3.155 N/A ALA 768.A N ARG 764.A O no hydrogen 2.863 N/A THR 770.A N GLY 766.A O no hydrogen 3.506 N/A THR 770.A OG1 GLY 766.A O no hydrogen 3.311 N/A ALA 771.A N LEU 767.A O no hydrogen 3.120 N/A LEU 772.A N ASP 769.A O no hydrogen 2.694 N/A LYS 773.A N ASP 769.A O no hydrogen 2.458 N/A LYS 773.A NZ THR 915.A O no hydrogen 3.565 N/A THR 774.A OG1 ALA 771.A O no hydrogen 3.435 N/A ASN 776.A N LEU 772.A O no hydrogen 2.951 N/A SER 777.A N LYS 773.A O no hydrogen 3.046 N/A GLY 778.A N THR 774.A O no hydrogen 2.991 N/A TYR 779.A N ASN 776.A O no hydrogen 3.346 N/A ARG 782.A NH1 GLN 322.A O no hydrogen 2.823 N/A ARG 783.A NH1 TYR 779.A OH no hydrogen 3.377 N/A LEU 784.A N LEU 780.A O no hydrogen 3.488 N/A ASP 786.A N ARG 783.A O no hydrogen 3.042 N/A VAL 787.A N ARG 783.A O no hydrogen 3.120 N/A ALA 788.A N LEU 784.A O no hydrogen 3.192 N/A GLN 789.A NE2 GLN 789.A O no hydrogen 2.585 N/A VAL 793.A N GLU 897.A O no hydrogen 3.290 N/A THR 794.A N VAL 878.A O no hydrogen 3.183 N/A THR 794.A OG1 THR 794.A O no hydrogen 2.437 N/A CYS 798.A SG THR 800.A OG1 no hydrogen 3.476 N/A ILE 804.A N VAL 866.A O no hydrogen 2.779 N/A MET 806.A N VAL 864.A O no hydrogen 2.997 N/A GLU 811.A N ASP 814.A O no hydrogen 2.471 N/A ASP 814.A N GLU 811.A O no hydrogen 2.768 N/A ARG 820.A NE ASP 854.A OD1 no hydrogen 3.210 N/A ARG 820.A NH2 GLU 850.A OE1 no hydrogen 3.132 N/A VAL 823.A N ARG 820.A O no hydrogen 3.099 N/A GLY 825.A N LEU 848.A O no hydrogen 2.733 N/A ARG 826.A NH2 GLU 1223.A OE1 no hydrogen 3.387 N/A ALA 829.A N LYS 865.A O no hydrogen 2.732 N/A LYS 834.A N ASP 839.A O no hydrogen 2.801 N/A ARG 844.A NH2 HIS 801.A ND1 no hydrogen 3.002 N/A THR 846.A N THR 828.A OG1 no hydrogen 3.259 N/A LEU 848.A N ARG 826.A O no hydrogen 2.944 N/A CYS 853.A N HIS 849.A O no hydrogen 3.274 N/A CYS 853.A SG LEU 848.A O no hydrogen 3.966 N/A CYS 853.A SG HIS 849.A O no hydrogen 3.691 N/A LEU 855.A N GLN 851.A O no hydrogen 2.771 N/A LEU 856.A N TRP 852.A O no hydrogen 3.234 N/A GLU 858.A N ASP 854.A O no hydrogen 2.633 N/A ASN 859.A N LEU 855.A O no hydrogen 3.256 N/A SER 860.A N ASN 859.A OD1 no hydrogen 2.968 N/A SER 860.A OG PHE 961.A O no hydrogen 2.583 N/A VAL 866.A N ILE 804.A O no hydrogen 2.803 N/A SER 871.A N SER 868.A O no hydrogen 3.285 N/A SER 871.A OG GLU 802.A O no hydrogen 2.942 N/A SER 871.A OG SER 868.A O no hydrogen 3.059 N/A CYS 872.A SG THR 874.A OG1 no hydrogen 3.055 N/A THR 874.A OG1 GLU 795.A OE1 no hydrogen 2.907 N/A GLY 884.A N ALA 880.A O no hydrogen 3.386 N/A GLY 896.A N VAL 793.A O no hydrogen 3.021 N/A GLU 897.A N ASN 894.A O no hydrogen 3.308 N/A ILE 899.A N GLU 897.A O no hydrogen 3.201 N/A ALA 903.A N GLY 900.A O no hydrogen 3.390 N/A ALA 904.A N GLY 900.A O no hydrogen 3.389 N/A GLY 908.A N GLN 905.A O no hydrogen 3.381 N/A GLU 909.A N GLN 905.A O no hydrogen 2.994 N/A LEU 914.A N GLY 911.A O no hydrogen 3.214 N/A LYS 928.A NZ VAL 984.A O no hydrogen 3.059 N/A LYS 932.A N LYS 956.A O no hydrogen 3.256 N/A SER 934.A N GLU 954.A OE2 no hydrogen 2.591 N/A SER 938.A OG VAL 947.A O no hydrogen 2.312 N/A ASN 941.A N LYS 945.A O no hydrogen 2.663 N/A ASN 941.A ND2 SER 943.A OG no hydrogen 2.267 N/A SER 942.A OG SER 1090.A O no hydrogen 2.852 N/A GLY 944.A N ASN 941.A O no hydrogen 3.307 N/A VAL 947.A N VAL 939.A O no hydrogen 2.219 N/A THR 949.A OG1 LYS 937.A O no hydrogen 3.081 N/A ARG 951.A N SER 950.A OG no hydrogen 2.497 N/A LEU 957.A N GLU 966.A O no hydrogen 3.123 N/A ILE 958.A N SER 930.A O no hydrogen 2.766 N/A ASP 959.A N ASP 959.A OD1 no hydrogen 2.204 N/A LYS 965.A N LEU 957.A O no hydrogen 3.187 N/A SER 967.A N GLY 812.A O no hydrogen 3.180 N/A ALA 977.A N VAL 990.A O no hydrogen 2.211 N/A LYS 978.A NZ GLN 983.A O no hydrogen 2.868 N/A GLY 987.A N VAL 925.A O no hydrogen 2.891 N/A ASN 992.A N VAL 975.A O no hydrogen 2.387 N/A ASP 994.A N GLY 973.A O no hydrogen 2.892 N/A THR 997.A OG1 HIS 996.A O no hydrogen 2.623 N/A THR 1002.A N ASP 1092.A O no hydrogen 2.511 N/A THR 1002.A OG1 ASP 1092.A O no hydrogen 3.073 N/A SER 1005.A N SER 1090.A OG no hydrogen 2.807 N/A SER 1005.A OG ILE 1088.A O no hydrogen 2.324 N/A GLY 1006.A N SER 1005.A OG no hydrogen 2.480 N/A ARG 1009.A N LYS 1052.A O no hydrogen 3.278 N/A THR 1011.A OG1 ALA 1050.A O no hydrogen 2.339 N/A ASP 1015.A N ASP 1015.A OD1 no hydrogen 2.465 N/A GLY 1016.A N ILE 1019.A O no hydrogen 2.452 N/A THR 1018.A N ILE 1014.A O no hydrogen 3.154 N/A THR 1018.A OG1 ASP 1012.A O no hydrogen 2.599 N/A THR 1018.A OG1 ILE 1014.A O no hydrogen 3.362 N/A ARG 1021.A NH2 GLN 1022.A O no hydrogen 3.345 N/A GLN 1022.A NE2 THR 1020.A O no hydrogen 3.691 N/A GLN 1022.A NE2 SER 1031.A O no hydrogen 3.388 N/A GLY 1028.A N GLU 1025.A O no hydrogen 3.159 N/A SER 1030.A OG VAL 1080.A O no hydrogen 2.453 N/A SER 1031.A OG SER 1031.A O no hydrogen 2.411 N/A LEU 1032.A N SER 1030.A OG no hydrogen 2.951 N/A VAL 1034.A N ALA 1078.A O no hydrogen 2.952 N/A SER 1037.A OG LYS 1161.A O no hydrogen 2.283 N/A SER 1037.A OG ARG 1163.A O no hydrogen 3.216 N/A GLU 1039.A N ASP 1036.A O no hydrogen 2.918 N/A ARG 1040.A NH1 LEU 1047.A O no hydrogen 3.558 N/A ARG 1040.A NH2 LEU 1035.A O no hydrogen 2.447 N/A ARG 1048.A N ASP 1012.A OD2 no hydrogen 3.420 N/A ARG 1048.A NE GLU 1141.A OE2 no hydrogen 2.985 N/A ARG 1048.A NH2 GLU 1141.A OE2 no hydrogen 2.974 N/A ALA 1050.A N THR 1011.A O no hydrogen 3.324 N/A LYS 1052.A N ARG 1009.A O no hydrogen 3.096 N/A LYS 1052.A NZ ASP 1060.A OD2 no hydrogen 3.129 N/A ILE 1053.A N ALA 1070.A O no hydrogen 3.066 N/A ASP 1055.A N ASN 1059.A O no hydrogen 2.720 N/A GLY 1058.A N ASP 1055.A OD1 no hydrogen 3.178 N/A ASN 1059.A N ASP 1055.A OD1 no hydrogen 2.486 N/A ASP 1060.A N ASP 1060.A OD1 no hydrogen 2.426 N/A VAL 1061.A N ILE 1053.A O no hydrogen 3.061 N/A ILE 1063.A N MET 1068.A O no hydrogen 2.855 N/A THR 1066.A N ILE 1063.A O no hydrogen 3.272 N/A THR 1066.A OG1 ILE 1063.A O no hydrogen 2.898 N/A ALA 1070.A N VAL 1061.A O no hydrogen 2.247 N/A TYR 1072.A OH GLU 1003.A OE1 no hydrogen 2.323 N/A VAL 1080.A N LEU 1032.A O no hydrogen 2.708 N/A GLN 1081.A N GLN 1081.A OE1 no hydrogen 2.685 N/A THR 1093.A OG1 ASP 1092.A OD1 no hydrogen 3.556 N/A LEU 1094.A N VAL 1000.A O no hydrogen 2.292 N/A ALA 1115.A N LEU 1111.A O no hydrogen 3.224 N/A ASP 1116.A N PRO 1112.A O no hydrogen 2.532 N/A PHE 1118.A N VAL 1114.A O no hydrogen 3.484 N/A GLU 1119.A N ALA 1115.A O no hydrogen 3.390 N/A LYS 1124.A N ARG 1122.A O no hydrogen 2.987 N/A SER 1133.A OG VAL 1173.A O no hydrogen 3.160 N/A ILE 1135.A N THR 1151.A O no hydrogen 3.113 N/A VAL 1136.A N GLU 1171.A O no hydrogen 3.330 N/A THR 1142.A OG1 GLU 1141.A OE1 no hydrogen 3.487 N/A ARG 1147.A NE LYS 1140.A O no hydrogen 3.500 N/A VAL 1149.A N SER 1137.A O no hydrogen 2.678 N/A ILE 1150.A N TYR 1155.A O no hydrogen 2.524 N/A TYR 1155.A N ILE 1150.A O no hydrogen 2.457 N/A TYR 1155.A OH GLU 1157.A OE1 no hydrogen 2.213 N/A ILE 1159.A N ARG 1146.A O no hydrogen 3.426 N/A ASN 1166.A N ILE 1179.A O no hydrogen 3.266 N/A ARG 1175.A NE GLU 1131.A O no hydrogen 3.191 N/A ARG 1175.A NH2 GLU 1131.A O no hydrogen 3.555 N/A GLY 1176.A N ALA 1130.A O no hydrogen 2.617 N/A VAL 1178.A N ASP 1177.A OD1 no hydrogen 2.870 N/A SER 1180.A OG ASP 1181.A O no hydrogen 3.478 N/A ASP 1181.A N SER 1180.A OG no hydrogen 2.493 N/A HIS 1187.A NE2 ALA 1120.A O no hydrogen 3.196 N/A LEU 1190.A N PRO 1186.A O no hydrogen 3.252 N/A ARG 1191.A N HIS 1187.A O no hydrogen 3.246 N/A ARG 1191.A NH2 ASP 1188.A OD1 no hydrogen 2.812 N/A LEU 1192.A N ILE 1189.A O no hydrogen 3.405 N/A ARG 1193.A N ILE 1189.A O no hydrogen 2.967 N/A ALA 1197.A N GLY 1194.A O no hydrogen 3.110 N/A VAL 1198.A N GLY 1194.A O no hydrogen 3.400 N/A THR 1199.A N VAL 1195.A O no hydrogen 3.267 N/A THR 1199.A OG1 VAL 1195.A O no hydrogen 3.304 N/A ARG 1200.A N HIS 1196.A O no hydrogen 3.258 N/A ILE 1202.A N VAL 1198.A O no hydrogen 3.166 N/A VAL 1203.A N THR 1199.A O no hydrogen 2.861 N/A GLU 1205.A N TYR 1201.A O no hydrogen 3.191 N/A GLU 1205.A N ILE 1202.A O no hydrogen 3.256 N/A VAL 1206.A N ILE 1202.A O no hydrogen 3.064 N/A ASP 1208.A N GLU 1205.A O no hydrogen 2.457 N/A GLN 1213.A N TYR 1210.A O no hydrogen 2.563 N/A GLN 1213.A NE2 MET 916.A O no hydrogen 2.694 N/A GLY 1214.A N ARG 1211.A O no hydrogen 3.381 N/A VAL 1215.A N TYR 1210.A O no hydrogen 3.513 N/A ASN 1218.A N ALA 478.A O no hydrogen 3.373 N/A LYS 1220.A N ASN 1218.A OD1 no hydrogen 2.966 N/A HIS 1221.A N ASN 1218.A O no hydrogen 3.166 N/A GLU 1223.A N LYS 1220.A O no hydrogen 3.418 N/A ARG 1227.A N GLU 1223.A O no hydrogen 3.100 N/A ARG 1227.A NE VAL 869.A O no hydrogen 2.976 N/A ARG 1227.A NH2 CYS 872.A O no hydrogen 3.530 N/A LEU 1230.A N ARG 1227.A O no hydrogen 3.461 N/A LYS 1232.A NZ ALA 1282.A O no hydrogen 2.433 N/A ALA 1233.A N GLU 1247.A O no hydrogen 2.965 N/A THR 1234.A N SER 1270.A O no hydrogen 3.102 N/A THR 1234.A OG1 SER 1270.A O no hydrogen 3.324 N/A THR 1234.A OG1 SER 1270.A OG no hydrogen 2.916 N/A VAL 1236.A N THR 1268.A O no hydrogen 2.240 N/A ASN 1237.A N THR 1268.A O no hydrogen 3.226 N/A ASN 1237.A N THR 1268.A OG1 no hydrogen 2.761 N/A GLU 1247.A N ALA 1233.A O no hydrogen 2.940 N/A VAL 1249.A N ARG 1231.A O no hydrogen 2.921 N/A TYR 1251.A N GLN 1248.A O no hydrogen 3.019 N/A SER 1252.A N GLN 1248.A O no hydrogen 3.380 N/A ARG 1253.A N VAL 1249.A O no hydrogen 3.106 N/A VAL 1254.A N TYR 1251.A O no hydrogen 2.963 N/A LYS 1255.A N TYR 1251.A O no hydrogen 3.117 N/A ILE 1256.A N SER 1252.A O no hydrogen 3.358 N/A ASN 1258.A N LYS 1255.A O no hydrogen 2.537 N/A ARG 1259.A N LYS 1255.A O no hydrogen 2.273 N/A GLU 1262.A N ASN 1258.A O no hydrogen 3.006 N/A GLU 1262.A N ARG 1259.A O no hydrogen 2.990 N/A SER 1270.A OG THR 1234.A O no hydrogen 2.993 N/A SER 1270.A OG THR 1234.A OG1 no hydrogen 2.916 N/A ASP 1272.A N LYS 1232.A O no hydrogen 3.027 N/A LEU 1273.A N ASP 1272.A OD1 no hydrogen 3.037 N/A LEU 1274.A N MET 1229.A O no hydrogen 3.416 N/A THR 1277.A OG1 GLU 1119.A OE1 no hydrogen 3.524 N/A THR 1277.A OG1 GLU 1119.A OE2 no hydrogen 3.488 N/A ALA 1279.A N GLY 1275.A O no hydrogen 2.894 N/A SER 1280.A OG ASP 786.A O no hydrogen 2.912 N/A SER 1285.A OG ASP 1309.A OD2 no hydrogen 3.019 N/A SER 1291.A N ILE 1287.A O no hydrogen 3.098 N/A GLN 1293.A N ALA 1289.A O no hydrogen 3.217 N/A THR 1295.A OG1 ALA 1290.A O no hydrogen 2.621 N/A VAL 1298.A N THR 1295.A O no hydrogen 3.240 N/A LEU 1299.A N THR 1295.A O no hydrogen 3.323 N/A THR 1300.A OG1 THR 1296.A O no hydrogen 3.441 N/A ALA 1303.A N LEU 1299.A O no hydrogen 2.885 N/A VAL 1304.A N THR 1300.A O no hydrogen 3.320 N/A GLY 1306.A N ALA 1302.A O no hydrogen 3.006 N/A LYS 1307.A N ALA 1302.A O no hydrogen 3.480 N/A ASP 1309.A N ILE 7.A O no hydrogen 3.163 N/A LEU 1311.A N ASP 1309.A OD1 no hydrogen 3.206 N/A LYS 1315.A NZ ASP 786.A OD1 no hydrogen 2.783 N/A LYS 1315.A NZ ASP 786.A OD2 no hydrogen 3.331 N/A ASN 1317.A N LEU 1314.A O no hydrogen 2.816 N/A ASN 1317.A ND2 GLY 1313.A O no hydrogen 3.653 N/A VAL 1318.A N LEU 1314.A O no hydrogen 2.895 N/A TYR 1330.A N GLY 1327.A O no hydrogen 3.082 N/A GLN 1334.A N TYR 1330.A O no hydrogen 3.335 N/A GLN 1334.A N ALA 1331.A O no hydrogen 2.853 N/A ASP 1335.A N TYR 1332.A O no hydrogen 3.230 N/A MET 1337.A N HIS 1333.A O no hydrogen 3.491 N/A ARG 1339.A N ARG 1336.A O no hydrogen 3.376 N/A ARG 1339.A NE ASP 1335.A O no hydrogen 3.566 N/A ARG 1339.A NH2 ASP 1335.A OD2 no hydrogen 3.390 N/A