Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2waq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 16.A N SER 12.A O no hydrogen 3.354 N/A ARG 17.A N PRO 13.A O no hydrogen 3.362 N/A LYS 18.A N ASP 14.A O no hydrogen 3.233 N/A SER 20.A N LYS 18.A O no hydrogen 2.558 N/A SER 20.A OG LYS 18.A O no hydrogen 3.217 N/A CYS 44.A SG HIS 57.A NE2 no hydrogen 3.521 N/A ASN 49.A ND2 GLY 48.A O no hydrogen 3.058 N/A CYS 54.A SG ASN 49.A OD1 no hydrogen 3.671 N/A GLY 59.A N VAL 182.A O no hydrogen 2.853 N/A ILE 61.A N LEU 180.A O no hydrogen 2.904 N/A LEU 63.A N THR 178.A O no hydrogen 2.839 N/A VAL 67.A N LEU 177.A O no hydrogen 3.236 N/A PHE 72.A N HIS 69.A O no hydrogen 2.876 N/A VAL 73.A N VAL 70.A O no hydrogen 3.245 N/A HIS 75.A N PHE 72.A O no hydrogen 2.740 N/A HIS 75.A ND1 TYR 165.A OH no hydrogen 2.988 N/A VAL 76.A N PHE 72.A O no hydrogen 2.766 N/A TYR 77.A N VAL 73.A O no hydrogen 3.403 N/A PHE 79.A N HIS 75.A O no hydrogen 3.338 N/A LEU 80.A N VAL 76.A O no hydrogen 3.354 N/A LYS 81.A N TYR 77.A O no hydrogen 3.198 N/A LYS 81.A N GLU 78.A O no hydrogen 3.183 N/A ALA 82.A N PHE 79.A O no hydrogen 3.094 N/A THR 83.A OG1 PHE 79.A O no hydrogen 2.691 N/A CYS 84.A N GLY 88.A O no hydrogen 3.287 N/A CYS 84.A SG VAL 131.A O no hydrogen 3.301 N/A CYS 87.A SG VAL 131.A O no hydrogen 3.698 N/A VAL 90.A N GLY 88.A O no hydrogen 2.549 N/A GLU 98.A N GLU 94.A O no hydrogen 2.966 N/A LYS 99.A N GLU 96.A O no hydrogen 3.178 N/A ARG 102.A NH1 SER 158.A O no hydrogen 3.131 N/A ILE 103.A N LYS 99.A O no hydrogen 2.785 N/A TYR 104.A N TYR 100.A O no hydrogen 3.122 N/A ASN 105.A ND2 TYR 104.A O no hydrogen 2.704 N/A ALA 115.A N TRP 111.A O no hydrogen 2.953 N/A ARG 116.A N PRO 112.A O no hydrogen 2.864 N/A ARG 117.A N ALA 114.A O no hydrogen 2.970 N/A LEU 118.A N ALA 114.A O no hydrogen 2.702 N/A THR 119.A OG1 GLU 98.A OE1 no hydrogen 3.421 N/A THR 119.A OG1 ALA 115.A O no hydrogen 2.671 N/A LYS 123.A N THR 119.A O no hydrogen 3.345 N/A LYS 124.A N GLU 120.A O no hydrogen 3.086 N/A THR 125.A N VAL 122.A O no hydrogen 3.159 N/A THR 125.A OG1 TYR 121.A O no hydrogen 2.733 N/A CYS 132.A SG LYS 128.A O no hydrogen 3.037 N/A ASP 147.A N THR 144.A O no hydrogen 2.808 N/A ILE 148.A N THR 144.A O no hydrogen 3.059 N/A ARG 149.A N PRO 145.A O no hydrogen 3.153 N/A ARG 151.A N ILE 148.A O no hydrogen 3.144 N/A LEU 152.A N ARG 149.A O no hydrogen 3.120 N/A LYS 154.A NZ ARG 86.A O no hydrogen 3.287 N/A SER 158.A OG ASP 159.A OD1 no hydrogen 3.166 N/A ILE 162.A N SER 158.A O no hydrogen 3.334 N/A GLY 164.A N VAL 160.A O no hydrogen 3.113 N/A TYR 165.A N VAL 160.A O no hydrogen 2.990 N/A TYR 165.A OH HIS 75.A ND1 no hydrogen 2.988 N/A THR 168.A N ASP 166.A OD1 no hydrogen 2.764 N/A THR 169.A N ASP 166.A OD1 no hydrogen 2.993 N/A SER 170.A OG ASP 166.A O no hydrogen 3.484 N/A ARG 171.A NE GLU 173.A OE1 no hydrogen 2.784 N/A ARG 171.A NE GLU 173.A OE2 no hydrogen 3.053 N/A ARG 171.A NH2 VAL 155.A O no hydrogen 2.688 N/A ARG 171.A NH2 GLU 173.A OE2 no hydrogen 2.802 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 2.676 N/A TRP 174.A N ARG 171.A O no hydrogen 3.011 N/A MET 175.A N PRO 172.A O no hydrogen 3.384 N/A LEU 177.A N VAL 67.A O no hydrogen 2.925 N/A LEU 180.A N ILE 61.A O no hydrogen 2.945 N/A VAL 182.A N GLY 59.A O no hydrogen 2.532 N/A ILE 185.A N LEU 35.A O no hydrogen 3.180 N/A ILE 187.A N PRO 184.A O no hydrogen 3.119 N/A ARG 188.A N ILE 185.A O no hydrogen 3.313 N/A SER 190.A OG ASP 195.A OD1 no hydrogen 3.355 N/A SER 190.A OG ASP 195.A OD2 no hydrogen 3.191 N/A ILE 191.A N GLU 194.A O no hydrogen 2.695 N/A LYS 200.A NZ TYR 238.A O no hydrogen 3.252 N/A LEU 201.A N LEU 197.A O no hydrogen 3.210 N/A VAL 202.A N THR 198.A O no hydrogen 2.829 N/A ASP 203.A N HIS 199.A O no hydrogen 3.073 N/A ILE 204.A N LEU 201.A O no hydrogen 3.207 N/A ARG 206.A N VAL 202.A O no hydrogen 2.944 N/A ASN 208.A N ILE 204.A O no hydrogen 2.785 N/A ASN 208.A ND2 GLU 62.A O no hydrogen 3.102 N/A GLU 209.A N ARG 206.A O no hydrogen 3.260 N/A ARG 210.A N ARG 206.A O no hydrogen 3.302 N/A LEU 211.A N ILE 207.A O no hydrogen 3.198 N/A GLU 213.A N GLU 209.A O no hydrogen 2.780 N/A SER 214.A N ARG 210.A O no hydrogen 3.144 N/A SER 214.A OG ARG 210.A O no hydrogen 3.118 N/A SER 214.A OG LEU 211.A O no hydrogen 3.309 N/A ILE 224.A N PRO 220.A O no hydrogen 3.363 N/A GLU 225.A N GLN 221.A O no hydrogen 3.147 N/A ASP 226.A N LEU 222.A O no hydrogen 3.212 N/A TRP 228.A N ILE 224.A O no hydrogen 3.263 N/A ASP 229.A N GLU 225.A O no hydrogen 2.895 N/A LEU 230.A N LEU 227.A O no hydrogen 3.033 N/A LEU 231.A N LEU 227.A O no hydrogen 3.137 N/A GLN 232.A N TRP 228.A O no hydrogen 3.353 N/A GLN 232.A NE2 TRP 228.A O no hydrogen 3.554 N/A TYR 233.A N LEU 230.A O no hydrogen 3.156 N/A HIS 234.A N LEU 230.A O no hydrogen 2.681 N/A VAL 235.A N LEU 231.A O no hydrogen 3.302 N/A THR 237.A N HIS 234.A O no hydrogen 3.165 N/A THR 237.A OG1 TYR 233.A O no hydrogen 2.710 N/A TYR 238.A N HIS 234.A O no hydrogen 2.815 N/A PHE 239.A N VAL 235.A O no hydrogen 3.328 N/A ASN 241.A ND2 PRO 248.A O no hydrogen 2.698 N/A LEU 246.A N PRO 244.A O no hydrogen 2.663 N/A THR 259.A N GLN 262.A OE1 no hydrogen 3.249 N/A THR 259.A OG1 PHE 239.A O no hydrogen 3.398 N/A THR 259.A OG1 GLN 262.A OE1 no hydrogen 2.973 N/A ALA 261.A N PHE 239.A O no hydrogen 2.980 N/A GLN 262.A N THR 259.A O no hydrogen 2.841 N/A GLN 262.A NE2 GLU 242.A OE1 no hydrogen 3.069 N/A ARG 263.A N THR 259.A O no hydrogen 2.772 N/A ARG 263.A N LEU 260.A O no hydrogen 3.276 N/A ARG 263.A NH1 ILE 187.A O no hydrogen 3.033 N/A ARG 263.A NH2 ILE 187.A O no hydrogen 3.094 N/A LYS 265.A N ALA 261.A O no hydrogen 3.232 N/A GLY 269.A N GLY 266.A O no hydrogen 3.332 N/A ARG 270.A NH1 ASN 274.A OD1 no hydrogen 3.163 N/A PHE 271.A N GLY 269.A O no hydrogen 2.864 N/A ASN 274.A N ARG 270.A O no hydrogen 3.142 N/A SER 276.A N PHE 271.A O no hydrogen 3.279 N/A SER 283.A OG VAL 280.A O no hydrogen 2.808 N/A SER 284.A N LEU 426.A O no hydrogen 3.023 N/A ARG 285.A NE ASN 425.A OD1 no hydrogen 3.290 N/A THR 286.A N MET 424.A O no hydrogen 3.357 N/A ILE 288.A N ASP 422.A O no hydrogen 3.222 N/A SER 289.A N PHE 405.A O no hydrogen 2.954 N/A SER 289.A OG THR 404.A OG1 no hydrogen 3.068 N/A SER 295.A N GLU 298.A OE1 no hydrogen 2.781 N/A SER 295.A OG ASP 591.A OD1 no hydrogen 3.556 N/A SER 295.A OG ASP 591.A OD2 no hydrogen 2.723 N/A ILE 296.A N ASP 591.A OD1 no hydrogen 3.136 N/A ASP 297.A N SER 295.A OG no hydrogen 3.417 N/A GLU 298.A N SER 295.A O no hydrogen 3.057 N/A VAL 299.A N ARG 396.A O no hydrogen 2.668 N/A GLY 300.A N ARG 406.A O no hydrogen 3.236 N/A VAL 301.A N ARG 398.A O no hydrogen 2.904 N/A ALA 306.A N PRO 302.A O no hydrogen 3.042 N/A ARG 307.A N GLU 303.A O no hydrogen 2.824 N/A ARG 307.A NH2 GLU 303.A OE1 no hydrogen 3.462 N/A THR 308.A N ILE 304.A O no hydrogen 3.194 N/A THR 308.A N ILE 305.A O no hydrogen 3.178 N/A THR 308.A OG1 ILE 304.A O no hydrogen 2.944 N/A LEU 309.A N ILE 305.A O no hydrogen 2.858 N/A THR 310.A OG1 GLU 370.A OE2 no hydrogen 2.832 N/A VAL 311.A N ARG 371.A O no hydrogen 3.051 N/A GLU 313.A N VAL 369.A O no hydrogen 3.223 N/A ILE 315.A N TYR 367.A O no hydrogen 3.168 N/A THR 316.A N ASN 319.A OD1 no hydrogen 3.013 N/A THR 316.A OG1 ASN 319.A OD1 no hydrogen 2.650 N/A ASN 319.A N THR 316.A O no hydrogen 3.220 N/A LYS 322.A NZ GLU 313.A OE2 no hydrogen 3.421 N/A LEU 323.A N ASN 319.A O no hydrogen 3.226 N/A ARG 324.A N ILE 320.A O no hydrogen 2.873 N/A ARG 324.A NH2 LEU 363.A O no hydrogen 3.417 N/A VAL 327.A N LEU 323.A O no hydrogen 2.857 N/A ILE 328.A N ARG 324.A O no hydrogen 3.198 N/A ASN 329.A N GLN 325.A O no hydrogen 3.001 N/A ASN 329.A ND2 PRO 335.A O no hydrogen 2.694 N/A GLY 330.A N PHE 326.A O no hydrogen 3.295 N/A TRP 334.A NE1 LEU 373.A O no hydrogen 3.186 N/A GLY 336.A N HIS 372.A ND1 no hydrogen 3.076 N/A ALA 337.A N GLY 330.A O no hydrogen 3.229 N/A ASN 338.A N GLU 370.A O no hydrogen 3.153 N/A ASN 338.A ND2 ARG 307.A O no hydrogen 2.788 N/A VAL 340.A N ILE 348.A O no hydrogen 3.449 N/A ILE 341.A N VAL 368.A O no hydrogen 2.749 N/A ARG 342.A N ARG 346.A O no hydrogen 3.039 N/A ARG 342.A NE TYR 367.A OH no hydrogen 3.442 N/A ARG 342.A NH2 TYR 367.A OH no hydrogen 3.080 N/A GLY 345.A N ARG 342.A O no hydrogen 2.992 N/A ILE 348.A N VAL 340.A O no hydrogen 3.377 N/A LEU 350.A N ASN 338.A O no hydrogen 2.991 N/A ARG 351.A N ASP 349.A OD2 no hydrogen 3.397 N/A ARG 351.A NH1 ASP 332.A OD2 no hydrogen 2.727 N/A TYR 352.A N ASP 349.A O no hydrogen 3.375 N/A ARG 356.A NH2 ILE 328.A O no hydrogen 2.938 N/A SER 361.A N GLU 358.A O no hydrogen 3.194 N/A SER 361.A OG GLU 358.A O no hydrogen 3.257 N/A THR 362.A N LEU 359.A O no hydrogen 3.318 N/A THR 362.A OG1 GLU 358.A O no hydrogen 2.709 N/A LEU 363.A N LEU 359.A O no hydrogen 3.260 N/A TYR 367.A N ALA 364.A O no hydrogen 3.296 N/A VAL 368.A N ILE 341.A O no hydrogen 2.779 N/A VAL 369.A N GLU 313.A O no hydrogen 3.065 N/A GLU 370.A N TYR 339.A O no hydrogen 2.787 N/A ARG 371.A N VAL 311.A O no hydrogen 3.093 N/A ARG 371.A NE THR 374.A OG1 no hydrogen 3.240 N/A ARG 371.A NH2 ASP 377.A OD2 no hydrogen 2.762 N/A HIS 372.A N GLY 336.A O no hydrogen 2.925 N/A HIS 372.A ND1 TRP 334.A O no hydrogen 2.515 N/A HIS 372.A NE2 ASN 338.A OD1 no hydrogen 2.588 N/A LEU 373.A N ALA 306.A O no hydrogen 3.215 N/A THR 374.A N ASP 377.A OD2 no hydrogen 2.843 N/A GLY 376.A N VAL 397.A O no hydrogen 2.890 N/A ASP 377.A N THR 374.A O no hydrogen 3.230 N/A VAL 379.A N HIS 395.A O no hydrogen 2.802 N/A LEU 380.A N HIS 427.A O no hydrogen 2.978 N/A PHE 381.A N MET 393.A O no hydrogen 3.102 N/A ASN 382.A N ASN 425.A O no hydrogen 2.814 N/A ASN 382.A ND2 SER 386.A OG no hydrogen 3.338 N/A ASN 382.A ND2 SER 391.A O no hydrogen 3.328 N/A ARG 383.A NE TYR 415.A O no hydrogen 2.567 N/A SER 386.A OG ARG 383.A O no hydrogen 3.434 N/A HIS 388.A N SER 391.A OG no hydrogen 3.419 N/A SER 391.A N HIS 388.A O no hydrogen 3.418 N/A SER 391.A OG HIS 388.A O no hydrogen 3.255 N/A SER 391.A OG PRO 414.A O no hydrogen 3.490 N/A MET 392.A N ARG 389.A O no hydrogen 3.107 N/A ALA 394.A N MET 442.A O no hydrogen 2.716 N/A HIS 395.A N VAL 379.A O no hydrogen 2.786 N/A HIS 395.A ND1 GLU 298.A O no hydrogen 2.744 N/A ARG 396.A N ASP 297.A O no hydrogen 2.781 N/A ARG 396.A NE GLY 376.A O no hydrogen 2.824 N/A VAL 397.A N ASP 377.A O no hydrogen 2.842 N/A ARG 398.A N VAL 299.A O no hydrogen 2.756 N/A ARG 398.A NH1 GLU 298.A OE2 no hydrogen 3.169 N/A VAL 399.A N ASP 375.A OD2 no hydrogen 2.825 N/A LEU 400.A N VAL 301.A O no hydrogen 3.054 N/A THR 404.A OG1 SER 289.A OG no hydrogen 3.068 N/A PHE 405.A N VAL 287.A O no hydrogen 3.068 N/A ARG 406.A N GLY 300.A O no hydrogen 2.947 N/A ARG 406.A NE THR 404.A O no hydrogen 2.811 N/A ARG 406.A NH1 LYS 401.A O no hydrogen 3.529 N/A ARG 406.A NH2 LYS 401.A O no hydrogen 3.075 N/A ARG 406.A NH2 THR 404.A O no hydrogen 3.065 N/A LEU 407.A N SER 289.A O no hydrogen 3.394 N/A ASN 408.A ND2 ILE 294.A O no hydrogen 3.227 N/A LEU 410.A N ASN 408.A OD1 no hydrogen 2.952 N/A VAL 411.A N ASN 408.A O no hydrogen 2.931 N/A CYS 412.A SG ASN 408.A O no hydrogen 3.941 N/A CYS 412.A SG LEU 409.A O no hydrogen 3.547 N/A CYS 412.A SG ALA 417.A O no hydrogen 3.663 N/A TYR 415.A OH HIS 395.A NE2 no hydrogen 3.211 N/A ASN 416.A N PRO 413.A O no hydrogen 3.283 N/A ALA 417.A N CYS 412.A O no hydrogen 3.348 N/A MET 424.A N THR 286.A O no hydrogen 3.061 N/A ASN 425.A N ASN 382.A O no hydrogen 2.601 N/A LEU 426.A N SER 284.A O no hydrogen 2.763 N/A HIS 427.A N LEU 380.A O no hydrogen 2.906 N/A VAL 428.A N PHE 282.A O no hydrogen 3.055 N/A GLN 430.A NE2 THR 310.A O no hydrogen 3.367 N/A GLN 430.A NE2 VAL 428.A O no hydrogen 2.708 N/A ILE 435.A N SER 431.A O no hydrogen 3.059 N/A ALA 436.A N GLU 432.A O no hydrogen 3.177 N/A GLU 437.A N GLU 433.A O no hydrogen 2.720 N/A ALA 438.A N ALA 434.A O no hydrogen 2.999 N/A LYS 439.A N ALA 436.A O no hydrogen 3.116 N/A GLU 440.A N ALA 436.A O no hydrogen 3.376 N/A HIS 445.A N ASP 297.A OD1 no hydrogen 3.043 N/A LYS 446.A N LEU 443.A O no hydrogen 3.148 N/A LYS 446.A NZ LYS 439.A O no hydrogen 2.917 N/A LYS 446.A NZ GLU 440.A O no hydrogen 3.153 N/A ASN 447.A N VAL 444.A O no hydrogen 2.930 N/A ASN 447.A ND2 ILE 441.A O no hydrogen 3.089 N/A ASN 447.A ND2 LEU 443.A O no hydrogen 2.768 N/A THR 450.A N GLY 455.A O no hydrogen 2.787 N/A THR 450.A OG1 GLY 455.A O no hydrogen 3.351 N/A ILE 457.A N ILE 448.A O no hydrogen 3.095 N/A SER 466.A N GLN 462.A O no hydrogen 3.177 N/A GLY 467.A N ASP 463.A O no hydrogen 3.224 N/A ALA 468.A N TYR 464.A O no hydrogen 2.747 N/A TYR 469.A N ILE 465.A O no hydrogen 3.004 N/A LEU 470.A N SER 466.A O no hydrogen 3.153 N/A LEU 471.A N GLY 467.A O no hydrogen 3.041 N/A THR 472.A N ALA 468.A O no hydrogen 3.446 N/A THR 472.A OG1 ALA 468.A O no hydrogen 2.738 N/A LYS 474.A NZ PRO 543.A O no hydrogen 2.689 N/A THR 476.A OG1 LEU 470.A O no hydrogen 2.843 N/A THR 476.A OG1 THR 475.A O no hydrogen 2.838 N/A LEU 478.A N TYR 508.A O no hydrogen 2.542 N/A THR 479.A N GLU 482.A OE1 no hydrogen 2.926 N/A ALA 483.A N THR 479.A O no hydrogen 2.759 N/A GLN 485.A N GLU 481.A O no hydrogen 3.342 N/A ILE 486.A N ALA 483.A O no hydrogen 2.913 N/A LEU 487.A N ALA 483.A O no hydrogen 3.329 N/A GLY 488.A N GLN 484.A O no hydrogen 3.244 N/A VAL 489.A N ILE 486.A O no hydrogen 3.181 N/A ALA 490.A N LEU 487.A O no hydrogen 3.180 N/A ASP 491.A N ASN 592.A OD1 no hydrogen 2.906 N/A ALA 500.A N GLN 512.A OE1 no hydrogen 3.273 N/A ILE 501.A N TYR 507.A O no hydrogen 3.237 N/A ARG 505.A NH1 TYR 507.A OH no hydrogen 3.365 N/A TYR 507.A N ILE 501.A O no hydrogen 3.033 N/A TYR 508.A N LEU 478.A O no hydrogen 2.922 N/A GLY 510.A N THR 476.A O no hydrogen 3.397 N/A LYS 511.A NZ THR 472.A O no hydrogen 3.478 N/A LYS 511.A NZ ASP 545.A OD1 no hydrogen 3.275 N/A LYS 511.A NZ ASP 545.A OD2 no hydrogen 3.295 N/A GLN 512.A N THR 509.A O no hydrogen 2.899 N/A GLN 512.A NE2 GLU 498.A O no hydrogen 3.114 N/A VAL 513.A N THR 509.A O no hydrogen 3.480 N/A SER 515.A N LYS 511.A O no hydrogen 2.990 N/A SER 515.A OG GLY 553.A O no hydrogen 2.754 N/A ALA 516.A N GLN 512.A O no hydrogen 3.315 N/A ALA 516.A N VAL 513.A O no hydrogen 3.284 N/A LEU 518.A N SER 515.A O no hydrogen 3.484 N/A LYS 520.A NZ SER 515.A O no hydrogen 2.811 N/A LYS 520.A NZ GLY 553.A O no hydrogen 3.232 N/A PHE 522.A N PRO 519.A O no hydrogen 2.981 N/A ASN 523.A ND2 GLU 835.A O no hydrogen 3.504 N/A ASN 523.A ND2 VAL 837.A O no hydrogen 3.496 N/A PHE 524.A N ILE 550.A O no hydrogen 2.921 N/A GLY 526.A N VAL 548.A O no hydrogen 3.130 N/A GLN 527.A NE2 SER 531.A OG no hydrogen 2.743 N/A ALA 528.A N SER 546.A O no hydrogen 3.186 N/A SER 531.A N ALA 528.A O no hydrogen 3.010 N/A SER 532.A N VAL 530.A O no hydrogen 2.760 N/A ARG 535.A N SER 532.A O no hydrogen 3.149 N/A LEU 536.A N GLY 533.A O no hydrogen 3.437 N/A CYS 537.A N SER 531.A OG no hydrogen 2.843 N/A CYS 537.A SG HIS 544.A O no hydrogen 3.472 N/A ASP 541.A N ASN 539.A OD1 no hydrogen 3.234 N/A CYS 542.A SG LEU 536.A O no hydrogen 3.739 N/A SER 546.A OG ARG 535.A O no hydrogen 3.279 N/A VAL 548.A N GLY 526.A O no hydrogen 2.695 N/A VAL 549.A N GLU 557.A O no hydrogen 2.736 N/A ILE 550.A N PHE 524.A O no hydrogen 2.907 N/A LYS 551.A N ILE 554.A O no hydrogen 2.933 N/A LYS 551.A NZ VAL 838.A O no hydrogen 3.150 N/A ASN 552.A N ASN 523.A OD1 no hydrogen 2.593 N/A GLY 553.A N PHE 522.A O no hydrogen 2.876 N/A ILE 554.A N LYS 551.A O no hydrogen 2.793 N/A LEU 555.A N SER 515.A OG no hydrogen 3.203 N/A GLU 557.A N VAL 549.A O no hydrogen 3.197 N/A GLY 558.A N ASP 545.A OD1 no hydrogen 3.260 N/A PHE 560.A N THR 472.A OG1 no hydrogen 2.788 N/A LYS 563.A N ILE 565.A O no hydrogen 3.264 N/A ALA 564.A N ASP 561.A O no hydrogen 3.048 N/A ILE 565.A N ASP 561.A O no hydrogen 2.699 N/A GLU 571.A N HIS 575.A ND1 no hydrogen 2.923 N/A SER 572.A OG GLN 569.A O no hydrogen 3.072 N/A LEU 574.A N ALA 564.A O no hydrogen 3.222 N/A HIS 575.A N SER 572.A OG no hydrogen 2.991 N/A TRP 576.A N SER 572.A O no hydrogen 3.200 N/A LEU 577.A N ILE 573.A O no hydrogen 2.969 N/A ILE 578.A N LEU 574.A O no hydrogen 3.294 N/A LYS 579.A N HIS 575.A O no hydrogen 2.973 N/A GLU 580.A N TRP 576.A O no hydrogen 2.781 N/A TYR 581.A OH ASP 521.A OD1 no hydrogen 3.044 N/A TYR 585.A N SER 582.A O no hydrogen 3.049 N/A TYR 585.A OH PHE 517.A O no hydrogen 3.345 N/A GLY 586.A N SER 582.A O no hydrogen 3.264 N/A TRP 588.A NE1 ASP 491.A O no hydrogen 3.141 N/A LEU 589.A N TYR 585.A O no hydrogen 2.818 N/A MET 590.A N GLY 586.A O no hydrogen 3.368 N/A ASP 591.A N TRP 588.A O no hydrogen 3.025 N/A ASN 592.A N LEU 589.A O no hydrogen 3.310 N/A ASN 592.A ND2 TRP 588.A O no hydrogen 2.995 N/A LEU 593.A N LEU 589.A O no hydrogen 3.059 N/A ARG 595.A NH1 PRO 292.A O no hydrogen 2.959 N/A PHE 597.A N LEU 593.A O no hydrogen 3.221 N/A ILE 598.A N PHE 594.A O no hydrogen 3.218 N/A ARG 599.A N ARG 595.A O no hydrogen 3.440 N/A PHE 600.A N VAL 596.A O no hydrogen 3.389 N/A VAL 601.A N ILE 598.A O no hydrogen 3.004 N/A GLU 602.A N ILE 598.A O no hydrogen 3.378 N/A LEU 603.A N PHE 600.A O no hydrogen 3.013 N/A GLN 604.A N PHE 600.A O no hydrogen 2.651 N/A GLY 605.A N VAL 601.A O no hydrogen 2.747 N/A THR 607.A OG1 MET 608.A O no hydrogen 3.558 N/A MET 608.A N THR 607.A OG1 no hydrogen 2.454 N/A ASP 612.A N ARG 609.A O no hydrogen 2.903 N/A VAL 613.A N LEU 610.A O no hydrogen 3.015 N/A SER 614.A N LEU 610.A O no hydrogen 2.949 N/A VAL 619.A N ASP 617.A O no hydrogen 2.583 N/A LYS 620.A NZ THR 750.A OG1 no hydrogen 3.352 N/A LYS 621.A N ASP 618.A O no hydrogen 3.145 N/A GLU 622.A N VAL 619.A O no hydrogen 3.120 N/A TYR 624.A N LYS 620.A O no hydrogen 3.020 N/A ASN 625.A N LYS 621.A O no hydrogen 3.084 N/A GLU 626.A N ILE 623.A O no hydrogen 2.939 N/A ILE 627.A N ILE 623.A O no hydrogen 2.750 N/A ARG 629.A NH1 GLU 626.A OE2 no hydrogen 2.961 N/A ALA 630.A N GLU 626.A O no hydrogen 2.929 N/A LYS 631.A N ILE 627.A O no hydrogen 2.883 N/A VAL 632.A N ASP 628.A O no hydrogen 3.203 N/A GLU 633.A N ALA 630.A O no hydrogen 3.103 N/A VAL 634.A N LYS 631.A O no hydrogen 2.891 N/A ASP 635.A N LYS 631.A O no hydrogen 2.691 N/A LEU 637.A N VAL 634.A O no hydrogen 3.029 N/A ILE 638.A N VAL 634.A O no hydrogen 2.857 N/A ILE 638.A N ASP 635.A O no hydrogen 3.166 N/A GLN 639.A N ASP 635.A O no hydrogen 3.374 N/A LYS 640.A N ASN 636.A O no hydrogen 3.250 N/A TYR 641.A N LEU 637.A O no hydrogen 3.482 N/A LYS 642.A N ILE 638.A O no hydrogen 2.987 N/A ASN 643.A N LYS 640.A O no hydrogen 3.215 N/A GLY 651.A N ILE 649.A O no hydrogen 2.607 N/A ARG 652.A NE GLY 651.A O no hydrogen 3.230 N/A THR 653.A OG1 GLU 656.A OE1 no hydrogen 3.416 N/A SER 657.A N THR 653.A O no hydrogen 3.111 N/A SER 657.A OG LEU 654.A O no hydrogen 2.694 N/A ASN 660.A N GLU 656.A O no hydrogen 2.735 N/A TYR 661.A N SER 657.A O no hydrogen 3.133 N/A TYR 661.A OH GLU 647.A O no hydrogen 2.677 N/A ILE 662.A N LEU 658.A O no hydrogen 3.373 N/A LEU 663.A N GLU 659.A O no hydrogen 2.841 N/A ASP 664.A N ASN 660.A O no hydrogen 3.204 N/A THR 665.A N TYR 661.A O no hydrogen 2.791 N/A THR 665.A OG1 TYR 661.A O no hydrogen 2.721 N/A LEU 666.A N ILE 662.A O no hydrogen 3.117 N/A LYS 668.A N ASP 664.A O no hydrogen 2.788 N/A LEU 669.A N THR 665.A O no hydrogen 2.972 N/A ARG 670.A N ASP 667.A O no hydrogen 3.302 N/A SER 671.A OG LYS 668.A O no hydrogen 3.289 N/A THR 672.A OG1 LYS 668.A O no hydrogen 2.701 N/A GLY 674.A N ARG 670.A O no hydrogen 2.884 N/A ASP 675.A N SER 671.A O no hydrogen 2.732 N/A ILE 676.A N THR 672.A O no hydrogen 3.376 N/A ALA 677.A N ALA 673.A O no hydrogen 3.388 N/A SER 678.A N ASP 675.A O no hydrogen 3.381 N/A SER 678.A OG GLY 674.A O no hydrogen 3.230 N/A TYR 680.A N ILE 676.A O no hydrogen 3.301 N/A PHE 684.A N ASP 682.A OD1 no hydrogen 3.166 N/A TYR 688.A N ASN 685.A O no hydrogen 2.974 N/A VAL 689.A N ASN 685.A O no hydrogen 2.811 N/A MET 690.A N PHE 686.A O no hydrogen 2.788 N/A THR 693.A OG1 VAL 689.A O no hydrogen 2.906 N/A THR 693.A OG1 THR 693.A O no hydrogen 2.424 N/A ILE 702.A N VAL 699.A O no hydrogen 2.929 N/A GLN 704.A NE2 LEU 709.A O no hydrogen 3.329 N/A MET 705.A N ASN 701.A O no hydrogen 3.290 N/A ALA 706.A N ILE 702.A O no hydrogen 2.740 N/A ALA 707.A N THR 703.A O no hydrogen 2.666 N/A MET 708.A N THR 703.A O no hydrogen 3.076 N/A GLY 710.A N ILE 744.A O no hydrogen 3.344 N/A GLN 711.A NE2 GLN 712.A O no hydrogen 2.736 N/A GLN 711.A NE2 ARG 741.A O no hydrogen 3.349 N/A GLN 712.A N GLY 742.A O no hydrogen 3.394 N/A VAL 714.A N GLU 717.A O no hydrogen 3.173 N/A ARG 718.A NE GLU 659.A OE1 no hydrogen 2.811 N/A ARG 718.A NH1 GLN 711.A OE1 no hydrogen 3.565 N/A ARG 718.A NH2 GLU 659.A OE2 no hydrogen 2.818 N/A ARG 718.A NH2 ILE 736.A O no hydrogen 3.018 N/A TYR 723.A N ARG 726.A O no hydrogen 2.761 N/A ARG 726.A NE PHE 731.A O no hydrogen 2.817 N/A ARG 726.A NH2 PHE 731.A O no hydrogen 3.414 N/A THR 727.A OG1 ILE 719.A O no hydrogen 3.434 N/A THR 727.A OG1 ALA 740.A O no hydrogen 3.570 N/A SER 737.A N ASP 735.A OD2 no hydrogen 3.171 N/A SER 737.A OG ASP 735.A OD2 no hydrogen 2.634 N/A SER 737.A OG GLU 739.A OE1 no hydrogen 3.386 N/A GLU 739.A N GLU 739.A OE1 no hydrogen 2.664 N/A ALA 740.A N SER 737.A O no hydrogen 2.881 N/A ARG 741.A N PRO 738.A O no hydrogen 3.426 N/A ARG 741.A NE ASP 735.A O no hydrogen 3.077 N/A ARG 741.A NH2 ASP 735.A O no hydrogen 3.282 N/A PHE 743.A N PRO 738.A O no hydrogen 3.147 N/A ILE 744.A N GLY 710.A O no hydrogen 3.038 N/A SER 746.A OG GLY 751.A O no hydrogen 2.969 N/A SER 746.A OG GLU 756.A OE1 no hydrogen 2.608 N/A SER 747.A OG MET 705.A O no hydrogen 3.377 N/A SER 747.A OG ALA 706.A O no hydrogen 3.249 N/A PHE 748.A N GLN 704.A O no hydrogen 3.487 N/A ARG 749.A N SER 747.A OG no hydrogen 3.126 N/A THR 750.A N SER 747.A OG no hydrogen 3.390 N/A GLY 751.A N SER 747.A O no hydrogen 2.920 N/A LYS 753.A N GLU 756.A OE1 no hydrogen 2.789 N/A LEU 757.A N LYS 753.A O no hydrogen 2.723 N/A PHE 758.A N THR 755.A O no hydrogen 3.080 N/A PHE 759.A N THR 755.A O no hydrogen 3.328 N/A HIS 760.A N GLU 756.A O no hydrogen 3.141 N/A ALA 762.A N PHE 758.A O no hydrogen 3.122 N/A GLY 763.A N PHE 759.A O no hydrogen 3.303 N/A GLY 764.A N HIS 760.A O no hydrogen 2.807 N/A ARG 765.A N ALA 761.A O no hydrogen 2.759 N/A GLU 766.A N GLY 763.A O no hydrogen 3.090 N/A VAL 769.A N ARG 765.A O no hydrogen 3.319 N/A ASP 770.A N GLU 766.A O no hydrogen 3.035 N/A THR 771.A N GLY 767.A O no hydrogen 2.763 N/A THR 771.A OG1 GLY 767.A O no hydrogen 2.635 N/A VAL 773.A N VAL 769.A O no hydrogen 3.143 N/A SER 776.A OG ALA 772.A O no hydrogen 3.282 N/A GLN 777.A N ARG 774.A O no hydrogen 2.986 N/A SER 778.A N ARG 774.A O no hydrogen 2.834 N/A GLY 779.A N THR 775.A O no hydrogen 3.052 N/A MET 781.A N GLN 777.A O no hydrogen 3.060 N/A MET 781.A N SER 778.A O no hydrogen 3.105 N/A GLN 782.A N GLY 779.A O no hydrogen 3.279 N/A GLN 782.A NE2 GLN 782.A O no hydrogen 3.491 N/A ARG 783.A N GLY 779.A O no hydrogen 3.277 N/A ASN 787.A ND2 ARG 783.A O no hydrogen 3.429 N/A LEU 789.A N LEU 785.A O no hydrogen 2.934 N/A SER 790.A OG ASN 787.A O no hydrogen 3.286 N/A ARG 793.A N ARG 801.A O no hydrogen 3.032 N/A ARG 793.A NH2 GLU 795.A OE1 no hydrogen 3.551 N/A GLU 795.A N THR 799.A O no hydrogen 2.956 N/A GLY 798.A N GLU 795.A O no hydrogen 3.264 N/A THR 799.A OG1 ASP 797.A OD1 no hydrogen 2.562 N/A VAL 800.A N GLN 809.A O no hydrogen 3.019 N/A ARG 801.A N ARG 793.A O no hydrogen 3.134 N/A SER 802.A N GLU 806.A O no hydrogen 3.111 N/A SER 802.A OG GLU 806.A OE1 no hydrogen 2.760 N/A TYR 804.A N SER 802.A OG no hydrogen 3.347 N/A GLY 805.A N SER 802.A O no hydrogen 3.070 N/A ILE 808.A N VAL 800.A O no hydrogen 2.818 N/A GLN 809.A N VAL 800.A O no hydrogen 3.326 N/A ASP 815.A N GLY 813.A O no hydrogen 2.661 N/A TYR 821.A N PHE 818.A O no hydrogen 2.820 N/A SER 822.A N PRO 819.A O no hydrogen 3.337 N/A SER 822.A OG PRO 819.A O no hydrogen 2.979 N/A ASN 831.A N VAL 828.A O no hydrogen 2.822 N/A ARG 832.A NH1 VAL 828.A O no hydrogen 2.347 N/A ARG 832.A NH2 VAL 828.A O no hydrogen 3.275 N/A GLU 835.A N ARG 832.A O no hydrogen 3.065 N/A ARG 836.A N ARG 832.A O no hydrogen 3.105 N/A ARG 836.A NH1 ASP 521.A OD2 no hydrogen 3.098 N/A ARG 836.A NH2 ASP 521.A OD2 no hydrogen 3.256 N/A VAL 837.A N ILE 833.A O no hydrogen 2.869 N/A GLY 839.A N VAL 837.A O no hydrogen 2.633 N/A