Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7sth_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 6.A N ASN 25.A O no hydrogen 3.146 N/A MET 11.A N HIS 32.A O no hydrogen 2.966 N/A ILE 13.A N GLN 34.A O no hydrogen 2.980 N/A ASN 15.A N LEU 37.A O no hydrogen 2.911 N/A ARG 19.A NH2 ASP 12.A O no hydrogen 2.820 N/A LEU 20.A N LEU 17.A O no hydrogen 3.230 N/A HIS 21.A ND1 THR 18.A O no hydrogen 2.715 N/A CYS 26.A SG LEU 23.A O no hydrogen 3.915 N/A SER 27.A OG PRO 4.A O no hydrogen 2.764 N/A ILE 29.A N MET 56.A O no hydrogen 3.354 N/A GLU 30.A N VAL 7.A O no hydrogen 3.262 N/A LEU 33.A N TYR 60.A O no hydrogen 3.131 N/A GLN 34.A N MET 11.A O no hydrogen 3.372 N/A GLN 34.A NE2 TYR 60.A OH no hydrogen 2.876 N/A ILE 35.A N LEU 62.A O no hydrogen 2.820 N/A LEU 36.A N ILE 13.A O no hydrogen 3.522 N/A LEU 37.A N PHE 64.A O no hydrogen 2.947 N/A MET 38.A N ARG 65.A O no hydrogen 2.950 N/A THR 41.A N PHE 39.A O no hydrogen 2.905 N/A THR 41.A OG1 MET 38.A O no hydrogen 3.325 N/A THR 41.A OG1 TYR 67.A O no hydrogen 2.321 N/A ARG 42.A N ASP 45.A OD2 no hydrogen 2.485 N/A ARG 42.A NE GLU 44.A OE2 no hydrogen 2.545 N/A GLU 44.A N GLU 44.A OE1 no hydrogen 2.919 N/A ASP 45.A N ARG 42.A O no hydrogen 2.889 N/A PHE 46.A N PRO 43.A O no hydrogen 3.358 N/A LEU 49.A N PHE 46.A O no hydrogen 3.345 N/A SER 50.A OG ASP 74.A O no hydrogen 2.536 N/A PHE 51.A N LEU 75.A O no hydrogen 3.098 N/A ILE 55.A N SER 27.A O no hydrogen 2.597 N/A ILE 57.A N VAL 81.A O no hydrogen 2.931 N/A THR 58.A N ILE 29.A O no hydrogen 3.307 N/A THR 58.A OG1 ILE 29.A O no hydrogen 3.038 N/A THR 58.A OG1 GLY 31.A O no hydrogen 2.898 N/A THR 58.A OG1 ASP 59.A OD1 no hydrogen 3.285 N/A ASP 59.A N GLY 31.A O no hydrogen 2.931 N/A LEU 61.A N ALA 92.A O no hydrogen 3.354 N/A LEU 62.A N LEU 33.A O no hydrogen 2.908 N/A LEU 63.A N VAL 94.A O no hydrogen 3.029 N/A PHE 64.A N ILE 35.A O no hydrogen 3.234 N/A ARG 65.A N PHE 96.A O no hydrogen 3.373 N/A TYR 67.A N MET 38.A O no hydrogen 2.958 N/A SER 71.A OG GLU 70.A O no hydrogen 2.674 N/A SER 71.A OG GLU 103.A O no hydrogen 3.195 N/A LEU 72.A N LEU 104.A O no hydrogen 2.840 N/A PHE 76.A N LEU 72.A O no hydrogen 3.067 N/A ASN 78.A ND2 PRO 52.A O no hydrogen 2.383 N/A THR 80.A N ILE 55.A O no hydrogen 2.658 N/A THR 80.A OG1 ASN 108.A O no hydrogen 3.076 N/A ILE 82.A N ASN 111.A O no hydrogen 3.157 N/A ARG 83.A N ILE 57.A O no hydrogen 2.993 N/A ARG 83.A NH1 CYS 223.A O no hydrogen 3.560 N/A ARG 83.A NH2 ARG 224.A O no hydrogen 2.749 N/A SER 85.A N THR 58.A O no hydrogen 3.056 N/A ARG 86.A NE ASP 59.A OD2 no hydrogen 3.239 N/A ARG 86.A NH2 GLN 244.A OE1 no hydrogen 3.183 N/A PHE 88.A N TYR 91.A O no hydrogen 3.033 N/A TYR 91.A N PHE 88.A O no hydrogen 3.257 N/A ALA 92.A N SER 116.A O no hydrogen 2.649 N/A LEU 93.A N SER 116.A O no hydrogen 3.428 N/A VAL 94.A N LEU 61.A O no hydrogen 3.086 N/A ILE 95.A N ARG 118.A O no hydrogen 3.083 N/A PHE 96.A N LEU 63.A O no hydrogen 2.869 N/A GLU 97.A N GLU 120.A O no hydrogen 3.288 N/A MET 98.A N ASN 122.A OD1 no hydrogen 2.791 N/A LYS 102.A N GLU 70.A O no hydrogen 2.847 N/A GLU 103.A N GLU 70.A O no hydrogen 3.481 N/A ASN 108.A ND2 PRO 77.A O no hydrogen 2.256 N/A MET 110.A N THR 80.A O no hydrogen 3.078 N/A ASN 111.A N THR 80.A O no hydrogen 3.433 N/A ILE 112.A N ILE 136.A O no hydrogen 3.433 N/A THR 113.A N ILE 82.A O no hydrogen 3.027 N/A ARG 114.A N ARG 83.A O no hydrogen 3.074 N/A ARG 114.A NE GLU 345.A OE2 no hydrogen 2.382 N/A ARG 114.A NH1 SER 85.A O no hydrogen 2.605 N/A ARG 114.A NH2 GLN 320.A OE1 no hydrogen 2.438 N/A SER 116.A OG ASP 142.A O no hydrogen 3.351 N/A SER 116.A OG ASP 142.A OD2 no hydrogen 2.499 N/A VAL 117.A N ASN 143.A OD1 no hydrogen 2.981 N/A ARG 118.A N LEU 93.A O no hydrogen 3.081 N/A ARG 118.A NE GLU 120.A OE1 no hydrogen 2.644 N/A ARG 118.A NH2 GLU 120.A OE1 no hydrogen 2.843 N/A ILE 119.A N TYR 144.A O no hydrogen 3.024 N/A GLU 120.A N ILE 95.A O no hydrogen 3.133 N/A ASN 122.A N LEU 147.A O no hydrogen 3.267 N/A ASN 122.A ND2 ILE 95.A O no hydrogen 3.683 N/A CYS 126.A N LYS 102.A O no hydrogen 2.491 N/A THR 130.A OG1 CYS 177.A O no hydrogen 2.483 N/A ASP 132.A N GLN 184.A OE1 no hydrogen 2.797 N/A ARG 135.A N ASP 132.A O no hydrogen 3.234 N/A ILE 136.A N TRP 133.A O no hydrogen 2.890 N/A LEU 137.A N TRP 133.A O no hydrogen 2.826 N/A GLU 141.A N GLU 141.A OE1 no hydrogen 2.426 N/A ASN 143.A N VAL 140.A O no hydrogen 3.223 N/A TYR 144.A N VAL 117.A O no hydrogen 3.144 N/A VAL 146.A N ILE 119.A O no hydrogen 3.352 N/A ASN 148.A ND2 ILE 119.A O no hydrogen 3.640 N/A GLU 153.A N LYS 149.A O no hydrogen 2.800 N/A CYS 155.A SG ASP 150.A OD1 no hydrogen 3.534 N/A CYS 164.A N PRO 160.A O no hydrogen 2.982 N/A CYS 164.A SG PRO 160.A O no hydrogen 3.172 N/A THR 167.A N VAL 174.A O no hydrogen 3.340 N/A ARG 176.A N PRO 165.A O no hydrogen 2.850 N/A CYS 177.A SG THR 179.A O no hydrogen 3.297 N/A TRP 178.A N HIS 182.A O no hydrogen 2.865 N/A CYS 183.A SG PRO 160.A O no hydrogen 3.906 N/A GLN 184.A N ARG 176.A O no hydrogen 2.705 N/A GLN 184.A NE2 ASP 132.A O no hydrogen 3.071 N/A LYS 185.A NZ CYS 196.A O no hydrogen 2.419 N/A LYS 185.A NZ THR 197.A O no hydrogen 3.376 N/A CYS 191.A SG GLY 195.A O no hydrogen 3.925 N/A HIS 194.A ND1 LYS 205.A O no hydrogen 2.569 N/A THR 197.A N LEU 201.A O no hydrogen 3.207 N/A THR 197.A OG1 SER 212.A O no hydrogen 3.528 N/A ALA 198.A N THR 197.A OG1 no hydrogen 2.613 N/A GLU 199.A N GLU 199.A OE1 no hydrogen 2.763 N/A GLY 200.A N THR 197.A O no hydrogen 3.184 N/A CYS 203.A N GLY 195.A O no hydrogen 3.049 N/A CYS 203.A SG GLY 195.A O no hydrogen 3.297 N/A CYS 207.A N HIS 204.A O no hydrogen 3.295 N/A CYS 207.A SG ASN 210.A O no hydrogen 3.497 N/A ASN 210.A N LEU 208.A O no hydrogen 3.116 N/A CYS 211.A N ASN 210.A OD1 no hydrogen 2.641 N/A CYS 211.A SG GLU 213.A O no hydrogen 3.547 N/A SER 212.A N LYS 219.A O no hydrogen 2.922 N/A THR 218.A OG1 ASP 216.A OD1 no hydrogen 3.299 N/A THR 218.A OG1 ASP 216.A OD2 no hydrogen 3.506 N/A LYS 219.A N ASP 216.A O no hydrogen 3.396 N/A CYS 220.A SG ASP 216.A O no hydrogen 3.601 N/A VAL 221.A N ASN 210.A O no hydrogen 3.399 N/A LEU 228.A N GLN 231.A O no hydrogen 2.892 N/A GLN 231.A N LEU 228.A O no hydrogen 2.993 N/A VAL 233.A N PHE 226.A O no hydrogen 3.393 N/A THR 235.A OG1 HIS 242.A NE2 no hydrogen 2.998 N/A CYS 236.A N HIS 242.A NE2 no hydrogen 3.294 N/A TYR 240.A N PRO 237.A O no hydrogen 2.793 N/A TYR 241.A N VAL 249.A O no hydrogen 2.864 N/A HIS 242.A N ASN 274.A O no hydrogen 3.207 N/A HIS 242.A ND1 ASN 274.A O no hydrogen 2.589 N/A HIS 242.A NE2 THR 235.A OG1 no hydrogen 2.998 N/A PHE 243.A N ARG 247.A O no hydrogen 2.864 N/A TRP 246.A N PHE 243.A O no hydrogen 3.222 N/A ARG 247.A N PHE 243.A O no hydrogen 3.261 N/A ARG 247.A NH2 GLU 30.A OE1 no hydrogen 3.314 N/A CYS 248.A N TYR 227.A O no hydrogen 3.134 N/A CYS 248.A SG TYR 227.A O no hydrogen 3.991 N/A VAL 249.A N TYR 241.A O no hydrogen 3.103 N/A PHE 253.A N ASN 250.A O no hydrogen 3.189 N/A CYS 254.A SG VAL 270.A O no hydrogen 3.581 N/A GLN 255.A N PHE 251.A O no hydrogen 2.928 N/A ASP 256.A N SER 252.A O no hydrogen 2.858 N/A LEU 257.A N PHE 253.A O no hydrogen 2.937 N/A HIS 258.A N CYS 254.A O no hydrogen 2.951 N/A PHE 259.A N GLN 255.A O no hydrogen 2.893 N/A LYS 260.A N ASP 256.A O no hydrogen 2.880 N/A CYS 261.A N LEU 257.A O no hydrogen 2.947 N/A ARG 262.A N HIS 258.A O no hydrogen 2.921 N/A ASN 263.A N PHE 259.A O no hydrogen 3.034 N/A SER 264.A N CYS 261.A O no hydrogen 3.287 N/A ARG 265.A N SER 264.A OG no hydrogen 2.610 N/A CYS 266.A SG CYS 261.A O no hydrogen 3.152 N/A VAL 270.A N ILE 277.A O no hydrogen 3.154 N/A ILE 271.A N LEU 291.A O no hydrogen 3.225 N/A HIS 272.A N LYS 275.A O no hydrogen 2.838 N/A LYS 275.A N HIS 272.A O no hydrogen 2.998 N/A CYS 276.A N HIS 242.A O no hydrogen 2.973 N/A CYS 276.A SG VAL 270.A O no hydrogen 3.767 N/A CYS 280.A SG GLU 279.A OE2 no hydrogen 3.408 N/A SER 282.A OG THR 326.A OG1 no hydrogen 2.843 N/A GLY 283.A N CYS 300.A O no hydrogen 3.007 N/A THR 285.A N THR 294.A O no hydrogen 2.995 N/A SER 289.A OG ASN 290.A OD1 no hydrogen 3.036 N/A CYS 293.A N ILE 271.A O no hydrogen 3.100 N/A THR 294.A N THR 285.A O no hydrogen 3.117 N/A CYS 296.A N GLY 283.A O no hydrogen 2.782 N/A CYS 300.A N GLY 298.A O no hydrogen 3.022 N/A CYS 300.A SG GLY 298.A O no hydrogen 3.750 N/A LYS 302.A N SER 282.A OG no hydrogen 2.633 N/A LYS 302.A N THR 326.A OG1 no hydrogen 2.808 N/A CYS 304.A N VAL 327.A O no hydrogen 3.143 N/A CYS 304.A SG LYS 302.A O no hydrogen 3.217 N/A GLY 309.A N ILE 306.A O no hydrogen 3.126 N/A LYS 311.A N SER 331.A O no hydrogen 3.028 N/A LYS 311.A NZ GLU 321.A OE1 no hydrogen 3.005 N/A ILE 313.A N ILE 333.A O no hydrogen 2.967 N/A ASP 314.A N SER 318.A OG no hydrogen 3.227 N/A SER 315.A N SER 318.A OG no hydrogen 3.193 N/A SER 315.A OG ASP 314.A OD1 no hydrogen 3.271 N/A SER 315.A OG SER 318.A OG no hydrogen 3.319 N/A THR 317.A OG1 LEU 87.A O no hydrogen 3.108 N/A SER 318.A OG ASP 314.A OD1 no hydrogen 3.148 N/A SER 318.A OG SER 315.A O no hydrogen 2.949 N/A SER 318.A OG SER 315.A OG no hydrogen 3.319 N/A ALA 319.A N SER 315.A O no hydrogen 3.114 N/A GLN 320.A N VAL 316.A O no hydrogen 2.881 N/A GLN 320.A NE2 SER 85.A O no hydrogen 2.823 N/A LEU 322.A N ALA 319.A O no hydrogen 2.827 N/A ARG 323.A N GLN 320.A O no hydrogen 3.133 N/A CYS 325.A N LEU 322.A O no hydrogen 3.126 N/A THR 326.A OG1 SER 282.A OG no hydrogen 2.843 N/A ILE 328.A N GLU 355.A O no hydrogen 3.056 N/A SER 331.A OG GLY 309.A O no hydrogen 3.283 N/A LEU 332.A N PHE 359.A O no hydrogen 3.389 N/A ILE 333.A N LYS 311.A O no hydrogen 2.751 N/A ILE 334.A N LYS 361.A O no hydrogen 2.683 N/A ASN 335.A N ILE 313.A O no hydrogen 2.857 N/A LEU 346.A N LEU 342.A O no hydrogen 3.039 N/A GLU 347.A N ALA 343.A O no hydrogen 2.884 N/A ALA 348.A N ALA 344.A O no hydrogen 2.917 N/A ASN 349.A N GLU 345.A O no hydrogen 2.920 N/A LEU 350.A N LEU 346.A O no hydrogen 2.787 N/A GLU 354.A N THR 326.A O no hydrogen 2.425 N/A ILE 356.A N LEU 379.A O no hydrogen 3.271 N/A SER 357.A N ILE 328.A O no hydrogen 2.955 N/A SER 357.A OG ILE 328.A O no hydrogen 3.172 N/A SER 357.A OG ASN 329.A OD1 no hydrogen 3.376 N/A SER 357.A OG GLY 330.A O no hydrogen 3.377 N/A PHE 359.A N SER 331.A OG no hydrogen 3.278 N/A LYS 361.A N LEU 332.A O no hydrogen 3.070 N/A ILE 362.A N TYR 393.A O no hydrogen 2.685 N/A ARG 363.A N ILE 334.A O no hydrogen 3.213 N/A ARG 364.A N LEU 395.A O no hydrogen 2.838 N/A SER 365.A N ASN 397.A OD1 no hydrogen 3.347 N/A SER 370.A OG GLN 402.A O no hydrogen 3.162 N/A SER 372.A N SER 370.A OG no hydrogen 3.138 N/A PHE 374.A N LEU 371.A O no hydrogen 3.374 N/A ARG 375.A NE GLU 347.A OE2 no hydrogen 3.187 N/A LYS 376.A NZ GLU 354.A OE2 no hydrogen 3.294 N/A HIS 378.A N GLU 354.A O no hydrogen 3.123 N/A ILE 380.A N THR 412.A O no hydrogen 2.827 N/A ARG 381.A N ILE 356.A O no hydrogen 3.137 N/A GLU 383.A N SER 357.A O no hydrogen 2.968 N/A GLU 386.A N TYR 390.A O no hydrogen 2.985 N/A TYR 390.A N GLU 386.A O no hydrogen 3.249 N/A TYR 390.A OH ASP 448.A OD1 no hydrogen 2.577 N/A SER 391.A N LYS 417.A O no hydrogen 2.996 N/A TYR 393.A N LEU 360.A O no hydrogen 3.141 N/A ALA 394.A N PHE 419.A O no hydrogen 3.278 N/A LEU 395.A N ILE 362.A O no hydrogen 2.997 N/A ASP 396.A N HIS 421.A O no hydrogen 3.086 N/A ASN 397.A ND2 ILE 362.A O no hydrogen 3.620 N/A ASN 397.A ND2 ASN 423.A OD1 no hydrogen 3.648 N/A ASN 399.A ND2 TYR 366.A O no hydrogen 3.147 N/A ARG 401.A N VAL 369.A O no hydrogen 2.927 N/A SER 407.A OG ASP 405.A OD1 no hydrogen 2.887 N/A LYS 408.A N ASP 405.A O no hydrogen 3.065 N/A LYS 408.A NZ ASP 405.A OD2 no hydrogen 2.512 N/A LYS 408.A NZ SER 407.A OG no hydrogen 2.414 N/A HIS 409.A N ASP 405.A O no hydrogen 3.028 N/A THR 414.A N ILE 380.A O no hydrogen 3.081 N/A LYS 417.A N ASN 389.A O no hydrogen 3.222 N/A LYS 417.A NZ ASP 448.A OD2 no hydrogen 3.146 N/A PHE 420.A N ASP 448.A O no hydrogen 3.286 N/A HIS 421.A N ALA 394.A O no hydrogen 3.201 N/A TYR 422.A N THR 453.A OG1 no hydrogen 3.014 N/A LEU 426.A N ASN 423.A O no hydrogen 2.898 N/A CYS 427.A SG ALA 458.A O no hydrogen 3.906 N/A GLU 430.A N CYS 427.A O no hydrogen 3.187 N/A HIS 432.A N LEU 428.A O no hydrogen 2.917 N/A HIS 432.A ND1 LEU 428.A O no hydrogen 2.360 N/A LYS 433.A N SER 429.A O no hydrogen 2.873 N/A MET 434.A N GLU 430.A O no hydrogen 2.929 N/A GLU 435.A N ILE 431.A O no hydrogen 2.899 N/A GLU 436.A N HIS 432.A O no hydrogen 2.918 N/A VAL 437.A N LYS 433.A O no hydrogen 2.905 N/A SER 438.A N MET 434.A O no hydrogen 2.875 N/A SER 438.A OG MET 434.A O no hydrogen 2.868 N/A SER 438.A OG THR 440.A OG1 no hydrogen 3.259 N/A THR 440.A OG1 SER 438.A OG no hydrogen 3.259 N/A LYS 441.A NZ GLU 436.A OE2 no hydrogen 3.441 N/A GLN 444.A NE2 THR 440.A O no hydrogen 2.306 N/A ASP 448.A N GLU 445.A O no hydrogen 3.281 N/A ALA 450.A N PHE 420.A O no hydrogen 3.286 N/A ASN 454.A ND2 ALA 450.A O no hydrogen 2.526 N/A GLY 455.A N ASN 423.A O no hydrogen 3.177 N/A GLN 457.A N PRO 424.A O no hydrogen 3.304 N/A ALA 458.A N GLY 455.A O no hydrogen 2.986 N/A CYS 460.A SG ALA 458.A O no hydrogen 3.467 N/A GLU 461.A N GLU 461.A OE1 no hydrogen 2.863 N/A ASN 462.A ND2 CYS 460.A O no hydrogen 3.274 N/A LEU 464.A N GLU 463.A OE2 no hydrogen 2.461 N/A LEU 465.A N LYS 558.A O no hydrogen 2.850 N/A SER 468.A N ARG 480.A O no hydrogen 2.542 N/A SER 468.A OG ARG 480.A O no hydrogen 2.734 N/A SER 468.A OG HIS 524.A ND1 no hydrogen 3.426 N/A PHE 469.A N ARG 480.A O no hydrogen 2.998 N/A ARG 471.A N LEU 478.A O no hydrogen 3.120 N/A SER 473.A OG LYS 476.A O no hydrogen 2.266 N/A LYS 476.A N SER 473.A OG no hydrogen 3.050 N/A LEU 478.A N ARG 471.A O no hydrogen 3.155 N/A LEU 479.A N TRP 527.A O no hydrogen 2.953 N/A GLU 482.A N LYS 466.A O no hydrogen 3.004 N/A ARG 490.A NE ASP 488.A OD1 no hydrogen 3.379 N/A ARG 490.A NH1 GLU 655.A OE1 no hydrogen 2.654 N/A ARG 490.A NH1 ASP 656.A OD1 no hydrogen 3.469 N/A ARG 490.A NH2 ASP 488.A OD1 no hydrogen 3.116 N/A ARG 490.A NH2 ASP 488.A OD2 no hydrogen 3.377 N/A ARG 490.A NH2 ASP 656.A OD1 no hydrogen 3.476 N/A ASP 491.A N ASP 488.A O no hydrogen 2.958 N/A LEU 493.A N LEU 545.A O no hydrogen 2.966 N/A PHE 495.A N ILE 517.A O no hydrogen 3.099 N/A MET 496.A N LYS 543.A O no hydrogen 2.947 N/A LEU 497.A N VAL 515.A O no hydrogen 2.965 N/A PHE 498.A N PHE 541.A O no hydrogen 3.258 N/A TYR 499.A N THR 513.A O no hydrogen 2.997 N/A LYS 500.A N ALA 539.A O no hydrogen 3.305 N/A GLU 501.A N GLU 501.A OE1 no hydrogen 2.454 N/A ALA 502.A N GLN 537.A O no hydrogen 2.717 N/A THR 508.A OG1 GLU 509.A O no hydrogen 3.373 N/A VAL 515.A N LEU 497.A O no hydrogen 3.030 N/A ILE 517.A N PHE 495.A O no hydrogen 2.841 N/A TRP 527.A N LEU 479.A O no hydrogen 3.157 N/A MET 529.A N ILE 477.A O no hydrogen 2.859 N/A TRP 535.A N ASP 567.A O no hydrogen 2.824 N/A THR 536.A OG1 LYS 533.A O no hydrogen 2.935 N/A THR 536.A OG1 PRO 534.A O no hydrogen 3.289 N/A GLN 537.A NE2 GLN 505.A OE1 no hydrogen 2.457 N/A TYR 538.A N VAL 564.A O no hydrogen 2.766 N/A ALA 539.A N LYS 500.A O no hydrogen 2.915 N/A ILE 540.A N ILE 562.A O no hydrogen 2.719 N/A PHE 541.A N PHE 498.A O no hydrogen 3.383 N/A VAL 542.A N SER 559.A OG no hydrogen 2.400 N/A LYS 543.A N MET 496.A O no hydrogen 3.069 N/A THR 544.A N ALA 557.A O no hydrogen 2.997 N/A LEU 545.A N GLY 494.A O no hydrogen 3.048 N/A THR 547.A N ASP 491.A O no hydrogen 2.897 N/A THR 547.A OG1 ASP 491.A O no hydrogen 3.268 N/A ARG 552.A NE ARG 553.A O no hydrogen 2.693 N/A ARG 552.A NH2 ARG 553.A O no hydrogen 3.363 N/A ARG 552.A NH2 THR 554.A O no hydrogen 3.563 N/A LYS 558.A N GLU 463.A O no hydrogen 2.960 N/A SER 559.A N VAL 542.A O no hydrogen 2.650 N/A SER 559.A OG VAL 542.A O no hydrogen 3.149 N/A ILE 562.A N ILE 540.A O no hydrogen 2.778 N/A VAL 564.A N TYR 538.A O no hydrogen 2.950 N/A THR 566.A N THR 536.A O no hydrogen 3.143 N/A THR 566.A OG1 SER 473.A O no hydrogen 3.033 N/A THR 566.A OG1 PHE 474.A O no hydrogen 2.811 N/A THR 566.A OG1 ASP 567.A OD1 no hydrogen 3.531 N/A THR 569.A OG1 ASN 570.A OD1 no hydrogen 3.347 N/A ASN 570.A N THR 569.A OG1 no hydrogen 2.556 N/A SER 572.A N ASP 596.A O no hydrogen 2.999 N/A SER 572.A OG VAL 573.A O no hydrogen 3.233 N/A ILE 578.A N LYS 590.A O no hydrogen 2.622 N/A VAL 580.A N ILE 588.A O no hydrogen 2.650 N/A SER 581.A OG ARG 716.A O no hydrogen 3.144 N/A ASN 582.A N GLN 586.A O no hydrogen 3.205 N/A SER 583.A N GLN 586.A O no hydrogen 3.258 N/A SER 585.A OG SER 585.A O no hydrogen 2.517 N/A SER 585.A OG LEU 685.A O no hydrogen 2.807 N/A GLN 586.A N SER 583.A O no hydrogen 3.383 N/A GLN 586.A NE2 SER 683.A OG no hydrogen 2.440 N/A ILE 587.A N ILE 682.A O no hydrogen 3.389 N/A ILE 588.A N VAL 580.A O no hydrogen 2.426 N/A LEU 589.A N LEU 680.A O no hydrogen 2.704 N/A LYS 590.A N ILE 578.A O no hydrogen 2.401 N/A LYS 592.A N LEU 575.A O no hydrogen 3.302 N/A SER 595.A OG ASP 596.A OD2 no hydrogen 3.054 N/A ASN 598.A ND2 ASN 570.A O no hydrogen 3.205 N/A THR 602.A OG1 HIS 603.A ND1 no hydrogen 2.581 N/A THR 602.A OG1 CYS 698.A O no hydrogen 3.009 N/A HIS 603.A N CYS 698.A O no hydrogen 3.158 N/A HIS 603.A ND1 THR 602.A OG1 no hydrogen 2.581 N/A TYR 604.A N VAL 674.A O no hydrogen 3.291 N/A LEU 605.A N GLN 696.A O no hydrogen 2.675 N/A TYR 607.A N GLU 694.A O no hydrogen 2.853 N/A TRP 608.A N PRO 670.A O no hydrogen 3.050 N/A GLN 611.A N GLY 690.A O no hydrogen 2.371 N/A SER 615.A OG GLU 619.A OE1 no hydrogen 2.629 N/A LEU 617.A N ASP 614.A O no hydrogen 3.285 N/A GLU 619.A N GLU 616.A O no hydrogen 3.382 N/A CYS 623.A N ASP 621.A OD1 no hydrogen 3.353 N/A LEU 629.A N LEU 627.A O no hydrogen 2.597 N/A CYS 634.A SG SER 633.A OG no hydrogen 3.074 N/A LYS 636.A NZ LYS 636.A O no hydrogen 2.727 N/A THR 637.A OG1 SER 639.A OG no hydrogen 2.693 N/A SER 639.A OG THR 637.A OG1 no hydrogen 2.693 N/A GLN 640.A N THR 637.A OG1 no hydrogen 3.262 N/A ILE 641.A N THR 637.A O no hydrogen 3.220 N/A LEU 642.A N ASP 638.A O no hydrogen 2.730 N/A LYS 643.A N SER 639.A O no hydrogen 2.770 N/A GLU 644.A N GLN 640.A O no hydrogen 2.934 N/A LEU 645.A N ILE 641.A O no hydrogen 2.954 N/A GLU 646.A N LEU 642.A O no hydrogen 2.898 N/A GLU 647.A N LYS 643.A O no hydrogen 2.879 N/A SER 648.A N GLU 644.A O no hydrogen 3.002 N/A SER 649.A N LEU 645.A O no hydrogen 2.942 N/A PHE 650.A N GLU 646.A O no hydrogen 2.855 N/A ARG 651.A N GLU 647.A O no hydrogen 2.992 N/A LYS 652.A N SER 648.A O no hydrogen 3.008 N/A LYS 652.A NZ ASP 491.A OD1 no hydrogen 2.559 N/A THR 653.A N SER 649.A O no hydrogen 2.859 N/A THR 653.A OG1 SER 649.A O no hydrogen 2.528 N/A PHE 654.A N PHE 650.A O no hydrogen 2.957 N/A GLU 655.A N ARG 651.A O no hydrogen 3.019 N/A ASP 656.A N LYS 652.A O no hydrogen 2.940 N/A TYR 657.A N THR 653.A O no hydrogen 2.922 N/A LEU 658.A N PHE 654.A O no hydrogen 2.923 N/A HIS 659.A N GLU 655.A O no hydrogen 2.974 N/A ASN 660.A N ASP 656.A O no hydrogen 2.907 N/A VAL 661.A N TYR 657.A O no hydrogen 2.929 N/A VAL 662.A N LEU 658.A O no hydrogen 2.950 N/A PHE 663.A N HIS 659.A O no hydrogen 3.449 N/A VAL 674.A N TYR 604.A O no hydrogen 3.142 N/A LEU 680.A N LEU 589.A O no hydrogen 3.343 N/A ILE 682.A N ILE 587.A O no hydrogen 2.940 N/A LEU 685.A N SER 585.A OG no hydrogen 2.769 N/A ARG 686.A N TYR 691.A OH no hydrogen 3.104 N/A HIS 687.A NE2 PRO 750.A O no hydrogen 2.699 N/A PHE 688.A N THR 717.A OG1 no hydrogen 2.796 N/A THR 689.A OG1 ARG 686.A O no hydrogen 2.484 N/A TYR 691.A N ALA 715.A O no hydrogen 3.301 N/A ARG 692.A N GLU 609.A O no hydrogen 3.254 N/A ILE 693.A N VAL 713.A O no hydrogen 2.699 N/A GLU 694.A N TYR 607.A O no hydrogen 3.069 N/A LEU 695.A N ALA 711.A O no hydrogen 3.374 N/A GLN 696.A N LEU 605.A O no hydrogen 2.541 N/A CYS 698.A N HIS 603.A O no hydrogen 3.206 N/A CYS 698.A SG HIS 603.A NE2 no hydrogen 4.032 N/A CYS 698.A SG GLN 700.A O no hydrogen 3.632 N/A ASN 699.A ND2 THR 569.A O no hydrogen 3.007 N/A ASN 699.A ND2 PRO 597.A O no hydrogen 3.516 N/A GLN 700.A NE2 ASP 704.A O no hydrogen 2.249 N/A ARG 706.A NE GLN 700.A OE1 no hydrogen 2.614 N/A ARG 706.A NH2 GLN 700.A OE1 no hydrogen 3.331 N/A SER 708.A OG PRO 571.A O no hydrogen 2.879 N/A SER 708.A OG VAL 709.A O no hydrogen 3.547 N/A ALA 711.A N LEU 695.A O no hydrogen 3.157 N/A ALA 715.A N TYR 691.A O no hydrogen 3.006 N/A THR 717.A OG1 SER 584.A O no hydrogen 3.463 N/A THR 717.A OG1 MET 718.A O no hydrogen 3.407 N/A GLU 720.A N ASN 751.A OD1 no hydrogen 3.095 N/A THR 731.A N MET 743.A O no hydrogen 2.509 N/A GLU 733.A N HIS 741.A O no hydrogen 2.682 N/A PHE 735.A N VAL 739.A O no hydrogen 3.034 N/A ASN 738.A N PHE 735.A O no hydrogen 3.243 N/A ASN 738.A ND2 THR 818.A O no hydrogen 2.718 N/A VAL 740.A N LEU 786.A O no hydrogen 3.160 N/A HIS 741.A N GLU 733.A O no hydrogen 3.097 N/A LEU 742.A N CYS 784.A O no hydrogen 2.788 N/A MET 743.A N THR 731.A O no hydrogen 2.511 N/A GLN 745.A NE2 GLU 746.A O no hydrogen 3.105 N/A ASN 751.A N ASP 724.A OD1 no hydrogen 2.739 N/A ASN 751.A ND2 ASP 724.A OD2 no hydrogen 3.018 N/A GLY 752.A N PRO 750.A O no hydrogen 2.890 N/A VAL 755.A N THR 801.A O no hydrogen 2.739 N/A TYR 757.A N VAL 773.A O no hydrogen 2.555 N/A VAL 759.A N LEU 771.A O no hydrogen 2.765 N/A SER 760.A N ARG 797.A O no hydrogen 3.493 N/A SER 760.A OG SER 760.A O no hydrogen 2.513 N/A SER 760.A OG GLU 768.A OE2 no hydrogen 3.256 N/A TYR 761.A N LEU 769.A O no hydrogen 3.101 N/A ARG 763.A NE ASP 766.A OD2 no hydrogen 2.308 N/A ARG 763.A NH1 PRO 791.A O no hydrogen 2.305 N/A ARG 763.A NH2 ASP 766.A OD2 no hydrogen 2.939 N/A TYR 764.A N ASN 793.A O no hydrogen 3.164 N/A ASP 766.A N ARG 763.A O no hydrogen 2.870 N/A LEU 769.A N TYR 761.A O no hydrogen 3.245 N/A LEU 771.A N VAL 759.A O no hydrogen 2.756 N/A VAL 773.A N TYR 757.A O no hydrogen 2.670 N/A SER 774.A OG ASP 621.A OD1 no hydrogen 3.438 N/A ARG 775.A NE PHE 618.A O no hydrogen 3.601 N/A ARG 775.A NH1 ILE 754.A O no hydrogen 2.322 N/A HIS 777.A N SER 774.A OG no hydrogen 3.147 N/A HIS 777.A NE2 GLU 781.A OE1 no hydrogen 2.445 N/A PHE 778.A N SER 774.A O no hydrogen 2.869 N/A ALA 779.A N ARG 775.A O no hydrogen 2.890 N/A LEU 780.A N LYS 776.A O no hydrogen 2.909 N/A GLU 781.A N HIS 777.A O no hydrogen 2.898 N/A ARG 782.A NH1 ALA 779.A O no hydrogen 3.194 N/A CYS 784.A N LEU 742.A O no hydrogen 3.240 N/A CYS 784.A SG ARG 785.A O no hydrogen 3.726 N/A LEU 786.A N VAL 740.A O no hydrogen 2.499 N/A SER 790.A OG TYR 794.A OH no hydrogen 2.334 N/A TYR 794.A N PHE 815.A O no hydrogen 3.005 N/A TYR 794.A OH SER 790.A O no hydrogen 2.664 N/A SER 795.A N ARG 762.A O no hydrogen 3.188 N/A SER 795.A OG ARG 762.A O no hydrogen 3.325 N/A VAL 796.A N THR 813.A O no hydrogen 2.972 N/A VAL 798.A N THR 810.A OG1 no hydrogen 2.971 N/A ARG 799.A NE GLY 807.A O no hydrogen 3.119 N/A THR 801.A N LEU 756.A O no hydrogen 2.839 N/A THR 801.A OG1 LEU 756.A O no hydrogen 3.341 N/A SER 802.A N GLY 805.A O no hydrogen 3.401 N/A SER 802.A OG ASP 724.A OD2 no hydrogen 2.566 N/A ALA 804.A N SER 802.A OG no hydrogen 3.164 N/A SER 808.A OG TRP 809.A O no hydrogen 3.216 N/A THR 810.A N VAL 798.A O no hydrogen 2.856 N/A THR 810.A OG1 VAL 798.A O no hydrogen 2.428 N/A THR 813.A N VAL 796.A O no hydrogen 2.849 N/A PHE 815.A N TYR 794.A O no hydrogen 3.163 N/A VAL 817.A N GLY 792.A O no hydrogen 3.282 N/A THR 818.A N ASN 738.A OD1 no hydrogen 3.177 N/A TYR 820.A OH GLU 736.A O no hydrogen 2.236 N/A