Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7wk5_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 9.A N LYS 56.A O no hydrogen 3.228 N/A GLN 10.A NE2 LEU 11.A O no hydrogen 2.990 N/A LEU 11.A N PHE 58.A O no hydrogen 2.723 N/A ALA 14.A N PRO 12.A O no hydrogen 3.064 N/A THR 16.A N VAL 49.A O no hydrogen 2.918 N/A SER 18.A OG ARG 21.A O no hydrogen 3.271 N/A ARG 21.A NE PRO 182.A O no hydrogen 3.307 N/A ARG 21.A NH1 GLU 160.A OE2 no hydrogen 3.317 N/A ARG 21.A NH2 GLN 183.A O no hydrogen 2.575 N/A TYR 24.A OH LEU 41.A O no hydrogen 2.365 N/A TYR 25.A N LEU 188.A O no hydrogen 3.345 N/A ARG 31.A NH1 ASP 27.A OD1 no hydrogen 3.204 N/A ARG 31.A NH1 ASP 27.A OD2 no hydrogen 3.319 N/A ARG 31.A NH2 ASP 27.A OD2 no hydrogen 2.916 N/A SER 32.A OG ASN 238.A O no hydrogen 3.424 N/A SER 32.A OG GLU 239.A O no hydrogen 3.035 N/A SER 33.A N ASN 238.A O no hydrogen 2.908 N/A SER 33.A OG ASN 238.A O no hydrogen 3.304 N/A HIS 36.A N LEU 235.A O no hydrogen 3.040 N/A THR 38.A N PHE 233.A O no hydrogen 3.468 N/A GLN 39.A NE2 PRO 230.A O no hydrogen 2.878 N/A LEU 41.A N ASP 40.A OD1 no hydrogen 2.940 N/A PHE 42.A N GLN 229.A O no hydrogen 3.307 N/A SER 47.A OG PRO 44.A O no hydrogen 2.549 N/A VAL 49.A N THR 16.A O no hydrogen 2.880 N/A THR 50.A N VAL 225.A O no hydrogen 3.167 N/A TRP 51.A N ALA 14.A O no hydrogen 2.804 N/A PHE 52.A N TYR 223.A O no hydrogen 3.235 N/A VAL 54.A N ALA 221.A O no hydrogen 2.793 N/A ILE 55.A N ARG 57.A O no hydrogen 3.103 N/A PHE 58.A N THR 9.A O no hydrogen 2.876 N/A PHE 58.A N LYS 56.A O no hydrogen 3.084 N/A ASN 60.A N GLN 10.A OE1 no hydrogen 3.100 N/A ASN 60.A ND2 THR 205.A O no hydrogen 2.598 N/A LEU 63.A N PHE 203.A O no hydrogen 3.191 N/A PHE 65.A N THR 201.A O no hydrogen 2.560 N/A VAL 69.A N PHE 163.A O no hydrogen 3.410 N/A TYR 70.A OH GLY 22.A O no hydrogen 2.946 N/A PHE 71.A N PHE 161.A O no hydrogen 2.939 N/A ALA 72.A N TYR 224.A O no hydrogen 3.223 N/A SER 73.A N ARG 159.A O no hydrogen 3.140 N/A SER 73.A OG GLU 75.A OE1 no hydrogen 3.427 N/A ILE 74.A N ALA 222.A O no hydrogen 2.762 N/A LYS 76.A NZ ASN 154.A O no hydrogen 2.625 N/A ARG 81.A NE ASN 100.A O no hydrogen 3.223 N/A ARG 81.A NH2 ASN 100.A O no hydrogen 3.069 N/A TRP 83.A N ILE 98.A O no hydrogen 3.311 N/A ILE 84.A N GLN 204.A O no hydrogen 3.189 N/A PHE 85.A N LEU 96.A O no hydrogen 2.940 N/A THR 87.A OG1 ASN 199.A O no hydrogen 2.384 N/A THR 88.A OG1 ASP 90.A OD1 no hydrogen 2.390 N/A THR 88.A OG1 ASP 90.A OD2 no hydrogen 3.381 N/A SER 91.A N GLN 113.A OE1 no hydrogen 2.939 N/A SER 91.A OG GLU 111.A O no hydrogen 3.360 N/A LYS 92.A NZ THR 88.A OG1 no hydrogen 2.822 N/A GLN 94.A NE2 ASN 134.A O no hydrogen 3.426 N/A SER 95.A N CYS 110.A O no hydrogen 2.761 N/A SER 95.A OG CYS 110.A O no hydrogen 2.985 N/A SER 95.A OG PHE 112.A O no hydrogen 3.443 N/A LEU 96.A N PHE 85.A O no hydrogen 2.764 N/A LEU 97.A N LYS 108.A O no hydrogen 2.855 N/A ILE 98.A N TRP 83.A O no hydrogen 3.351 N/A VAL 99.A N VAL 106.A O no hydrogen 2.855 N/A ASN 100.A N ARG 81.A O no hydrogen 3.125 N/A ASN 101.A N ASN 101.A OD1 no hydrogen 2.571 N/A ASN 101.A N ASN 104.A O no hydrogen 3.355 N/A THR 103.A OG1 ASN 104.A OD1 no hydrogen 2.894 N/A VAL 106.A N VAL 99.A O no hydrogen 2.601 N/A ILE 107.A N TYR 139.A O no hydrogen 3.210 N/A LYS 108.A N LEU 97.A O no hydrogen 3.085 N/A VAL 109.A N PHE 137.A O no hydrogen 2.965 N/A GLU 111.A N ASN 133.A O no hydrogen 3.334 N/A PHE 112.A N SER 95.A OG no hydrogen 2.686 N/A GLN 113.A N SER 131.A O no hydrogen 3.371 N/A GLN 113.A NE2 PHE 114.A O no hydrogen 3.383 N/A CYS 115.A SG VAL 128.A O no hydrogen 3.606 N/A LEU 120.A N LEU 207.A O no hydrogen 3.106 N/A SER 124.A N ASP 121.A O no hydrogen 3.004 N/A ARG 127.A NH1 PHE 126.A O no hydrogen 2.515 N/A CYS 135.A SG VAL 109.A O no hydrogen 3.267 N/A THR 136.A N VAL 109.A O no hydrogen 2.968 N/A THR 136.A OG1 GLN 94.A OE1 no hydrogen 3.500 N/A THR 136.A OG1 VAL 109.A O no hydrogen 2.785 N/A TYR 139.A N ILE 107.A O no hydrogen 2.870 N/A SER 141.A OG GLN 142.A O no hydrogen 3.116 N/A ASN 157.A ND2 GLU 75.A O no hydrogen 2.475 N/A LEU 158.A N THR 177.A O no hydrogen 2.788 N/A ARG 159.A N SER 73.A O no hydrogen 2.989 N/A ARG 159.A NE HIS 176.A NE2 no hydrogen 3.226 N/A GLU 160.A N LYS 175.A O no hydrogen 3.388 N/A PHE 161.A N PHE 71.A O no hydrogen 3.020 N/A VAL 162.A N TYR 173.A O no hydrogen 3.332 N/A PHE 163.A N VAL 69.A O no hydrogen 3.394 N/A LYS 164.A NZ TYR 24.A OH no hydrogen 3.067 N/A ILE 166.A N TYR 169.A O no hydrogen 3.094 N/A TYR 169.A N ILE 166.A O no hydrogen 2.939 N/A PHE 170.A N LEU 194.A O no hydrogen 2.884 N/A ILE 172.A N VAL 192.A O no hydrogen 3.168 N/A TYR 173.A OH TYR 25.A O no hydrogen 3.254 N/A SER 174.A N GLU 189.A O no hydrogen 3.002 N/A THR 177.A N LEU 158.A O no hydrogen 3.264 N/A THR 177.A OG1 PRO 178.A O no hydrogen 3.319 N/A GLN 183.A NE2 LEU 181.A O no hydrogen 3.223 N/A SER 186.A OG GLU 160.A OE2 no hydrogen 3.415 N/A LEU 188.A N VAL 23.A O no hydrogen 3.204 N/A GLU 189.A N SER 174.A O no hydrogen 3.169 N/A LEU 191.A N ILE 172.A O no hydrogen 3.068 N/A LEU 194.A N PHE 170.A O no hydrogen 3.057 N/A GLY 197.A N GLY 168.A O no hydrogen 3.013 N/A THR 201.A N GLY 86.A O no hydrogen 3.006 N/A ARG 202.A N GLY 86.A O no hydrogen 3.189 N/A ARG 202.A NE THR 87.A O no hydrogen 3.603 N/A PHE 203.A N LEU 63.A O no hydrogen 3.123 N/A GLN 204.A NE2 ASN 60.A O no hydrogen 3.363 N/A THR 205.A N ASN 60.A OD1 no hydrogen 3.125 N/A THR 205.A OG1 ASN 60.A OD1 no hydrogen 3.066 N/A THR 205.A OG1 TYR 223.A OH no hydrogen 2.780 N/A LEU 206.A N GLY 82.A O no hydrogen 3.086 N/A ALA 208.A N ILE 79.A O no hydrogen 2.898 N/A LEU 209.A N LEU 120.A O no hydrogen 2.657 N/A HIS 210.A N THR 217.A O no hydrogen 2.903 N/A THR 217.A N HIS 210.A O no hydrogen 2.812 N/A THR 217.A OG1 ALA 218.A O no hydrogen 3.329 N/A ALA 221.A N VAL 54.A O no hydrogen 3.036 N/A ALA 222.A N ILE 74.A O no hydrogen 3.091 N/A TYR 223.A N PHE 52.A O no hydrogen 3.363 N/A TYR 223.A OH ASP 59.A O no hydrogen 2.957 N/A TYR 224.A N ALA 72.A O no hydrogen 3.114 N/A TYR 224.A OH ASP 180.A O no hydrogen 2.750 N/A GLN 229.A N PHE 42.A O no hydrogen 2.941 N/A ARG 231.A NE GLN 229.A OE1 no hydrogen 3.031 N/A ARG 231.A NH2 GLN 229.A OE1 no hydrogen 2.628 N/A PHE 233.A N THR 38.A O no hydrogen 2.986 N/A LEU 234.A N VAL 247.A O no hydrogen 3.177 N/A LEU 235.A N HIS 36.A O no hydrogen 2.918 N/A TYR 237.A N VAL 34.A O no hydrogen 3.176 N/A THR 242.A N ASN 238.A OD1 no hydrogen 2.540 N/A THR 242.A OG1 ASN 238.A OD1 no hydrogen 3.180 N/A THR 244.A N LYS 236.A O no hydrogen 3.332 N/A THR 244.A OG1 LYS 236.A O no hydrogen 3.231 N/A ALA 246.A N ASP 245.A OD1 no hydrogen 2.982 N/A CYS 249.A SG THR 232.A O no hydrogen 3.323 N/A ALA 250.A N ASP 248.A OD1 no hydrogen 3.476 N/A ASP 252.A N SER 255.A OG no hydrogen 3.050 N/A LEU 254.A N ASP 252.A OD1 no hydrogen 3.048 N/A SER 255.A OG ASP 248.A O no hydrogen 2.721 N/A SER 255.A OG ASP 252.A O no hydrogen 2.735 N/A GLU 256.A N ASP 252.A O no hydrogen 2.827 N/A THR 257.A OG1 LEU 254.A O no hydrogen 2.595 N/A CYS 259.A SG SER 255.A O no hydrogen 3.328 N/A LYS 262.A NZ LEU 35.A O no hydrogen 2.483 N/A SER 263.A N LYS 258.A O no hydrogen 3.497 N/A SER 263.A OG THR 265.A O no hydrogen 2.865 N/A THR 265.A N SER 263.A OG no hydrogen 3.042 N/A LYS 268.A NZ ASP 602.A OD2 no hydrogen 2.688 N/A TYR 271.A OH GLU 267.A O no hydrogen 3.207 N/A THR 273.A N VAL 553.A O no hydrogen 3.141 N/A THR 273.A OG1 VAL 553.A O no hydrogen 2.897 N/A SER 274.A OG ASN 275.A O no hydrogen 3.402 N/A ASN 275.A N SER 274.A OG no hydrogen 2.459 N/A PHE 276.A N GLY 551.A O no hydrogen 2.684 N/A GLN 279.A NE2 ARG 277.A O no hydrogen 2.979 N/A ILE 284.A N ASN 498.A O no hydrogen 3.442 N/A VAL 285.A N THR 489.A OG1 no hydrogen 2.861 N/A ARG 286.A N ASN 500.A O no hydrogen 2.791 N/A ARG 286.A NH1 THR 489.A O no hydrogen 2.936 N/A ARG 286.A NH2 ASP 536.A OD2 no hydrogen 3.157 N/A THR 291.A OG1 ASN 292.A OD1 no hydrogen 3.324 N/A PHE 296.A N CYS 294.A O no hydrogen 2.784 N/A PHE 300.A N PHE 296.A O no hydrogen 3.400 N/A ASN 301.A N ASP 297.A O no hydrogen 3.005 N/A ALA 306.A N SER 357.A O no hydrogen 2.953 N/A SER 307.A OG LEU 410.A O no hydrogen 2.962 N/A LYS 314.A N ALA 355.A O no hydrogen 3.083 N/A ILE 316.A N VAL 353.A O no hydrogen 2.857 N/A SER 317.A OG ASN 352.A OD1 no hydrogen 3.229 N/A CYS 319.A SG SER 317.A O no hydrogen 3.682 N/A ALA 321.A N CYS 483.A O no hydrogen 3.050 N/A SER 324.A OG ASP 322.A OD1 no hydrogen 2.873 N/A TYR 327.A N TYR 323.A O no hydrogen 3.006 N/A ASN 328.A N TYR 323.A O no hydrogen 3.254 N/A ALA 330.A N LEU 326.A O no hydrogen 3.370 N/A PHE 333.A N ALA 393.A O no hydrogen 3.223 N/A THR 334.A N ALA 393.A O no hydrogen 3.375 N/A CYS 337.A SG VAL 340.A O no hydrogen 3.665 N/A VAL 340.A N TYR 338.A O no hydrogen 2.946 N/A LYS 344.A N SER 341.A O no hydrogen 3.199 N/A ASP 347.A N LYS 344.A O no hydrogen 3.379 N/A THR 351.A N GLU 474.A O no hydrogen 2.912 N/A THR 351.A OG1 LEU 476.A O no hydrogen 3.565 N/A THR 351.A OG1 ALA 478.A O no hydrogen 3.086 N/A ASN 352.A N GLU 474.A O no hydrogen 3.038 N/A VAL 353.A N ILE 316.A O no hydrogen 3.341 N/A TYR 354.A N SER 472.A O no hydrogen 2.992 N/A ALA 355.A N LYS 314.A O no hydrogen 3.137 N/A ILE 360.A N TYR 466.A O no hydrogen 3.069 N/A ARG 361.A NE GLU 364.A OE2 no hydrogen 2.717 N/A ARG 361.A NH2 GLU 364.A OE2 no hydrogen 2.952 N/A GLY 362.A N GLY 462.A O no hydrogen 2.948 N/A GLN 372.A NE2 THR 373.A O no hydrogen 2.844 N/A THR 373.A OG1 ASP 378.A OD2 no hydrogen 2.502 N/A GLY 374.A N ASP 378.A OD2 no hydrogen 3.284 N/A ASN 375.A N GLN 367.A OE1 no hydrogen 2.753 N/A ILE 376.A N GLN 367.A OE1 no hydrogen 3.036 N/A ALA 377.A N GLN 367.A OE1 no hydrogen 3.283 N/A TYR 379.A N ILE 376.A O no hydrogen 3.326 N/A ASN 380.A N ILE 376.A O no hydrogen 3.087 N/A ASN 380.A ND2 ARG 412.A O no hydrogen 2.705 N/A TYR 381.A N ILE 376.A O no hydrogen 3.517 N/A ASP 386.A N ASP 386.A OD1 no hydrogen 2.517 N/A THR 388.A OG1 PHE 473.A O no hydrogen 2.769 N/A CYS 390.A N LEU 471.A O no hydrogen 3.287 N/A CYS 390.A SG VAL 340.A O no hydrogen 3.314 N/A CYS 390.A SG GLY 389.A O no hydrogen 3.407 N/A TRP 394.A N ARG 467.A O no hydrogen 3.064 N/A ASN 395.A ND2 GLN 464.A OE1 no hydrogen 2.482 N/A SER 396.A N PRO 465.A O no hydrogen 2.860 N/A SER 396.A OG TRP 394.A O no hydrogen 3.357 N/A SER 396.A OG ASP 400.A OD2 no hydrogen 3.415 N/A ASP 400.A N SER 396.A O no hydrogen 3.338 N/A SER 404.A OG SER 404.A O no hydrogen 2.339 N/A ASN 406.A ND2 ASP 400.A O no hydrogen 3.285 N/A ASN 408.A ND2 ASN 406.A OD1 no hydrogen 3.164 N/A LEU 410.A N SER 307.A OG no hydrogen 3.020 N/A TYR 411.A N ARG 451.A O no hydrogen 3.135 N/A ARG 412.A N ASN 380.A OD1 no hydrogen 2.951 N/A ARG 415.A NE ASP 425.A OD2 no hydrogen 3.237 N/A ARG 415.A NH1 SER 417.A O no hydrogen 2.924 N/A ARG 415.A NH1 SER 417.A OG no hydrogen 3.092 N/A ARG 415.A NH2 ASP 425.A OD2 no hydrogen 2.453 N/A LYS 420.A N GLU 423.A OE1 no hydrogen 2.838 N/A ARG 424.A NE TRP 311.A O no hydrogen 2.885 N/A ARG 424.A NH2 ASN 312.A O no hydrogen 3.268 N/A SER 427.A OG ASP 425.A OD1 no hydrogen 3.393 N/A GLN 432.A NE2 GLY 434.A O no hydrogen 3.184 N/A LYS 436.A NZ PRO 437.A O no hydrogen 2.471 N/A CYS 438.A SG TYR 431.A O no hydrogen 3.395 N/A ASN 439.A ND2 ASN 439.A O no hydrogen 3.030 N/A VAL 441.A N CYS 438.A O no hydrogen 3.402 N/A GLY 443.A N CYS 446.A O no hydrogen 2.740 N/A CYS 446.A N GLY 443.A O no hydrogen 3.077 N/A CYS 446.A SG TYR 431.A O no hydrogen 3.286 N/A CYS 446.A SG VAL 441.A O no hydrogen 3.280 N/A SER 452.A OG ASN 406.A O no hydrogen 3.283 N/A SER 452.A OG TYR 409.A O no hydrogen 2.802 N/A TYR 453.A N SER 452.A OG no hydrogen 2.460 N/A TYR 466.A N ILE 360.A O no hydrogen 3.078 N/A ARG 467.A N TRP 394.A O no hydrogen 2.757 N/A ARG 467.A NH1 ALA 302.A O no hydrogen 2.488 N/A ARG 467.A NH2 ALA 302.A O no hydrogen 3.265 N/A VAL 468.A N PHE 358.A O no hydrogen 2.934 N/A VAL 469.A N ILE 392.A O no hydrogen 3.057 N/A LEU 471.A N CYS 390.A O no hydrogen 3.110 N/A SER 472.A N TYR 354.A O no hydrogen 2.868 N/A SER 472.A OG TYR 354.A O no hydrogen 2.438 N/A LEU 476.A N THR 351.A OG1 no hydrogen 2.923 N/A THR 481.A OG1 THR 351.A O no hydrogen 3.033 N/A SER 488.A OG PHE 287.A O no hydrogen 3.538 N/A THR 489.A N VAL 285.A O no hydrogen 3.016 N/A THR 489.A OG1 VAL 285.A O no hydrogen 2.490 N/A ASN 494.A N LEU 510.A O no hydrogen 2.937 N/A CYS 496.A SG VAL 278.A O no hydrogen 3.442 N/A VAL 497.A N GLY 508.A O no hydrogen 3.160 N/A ASN 498.A N GLU 282.A O no hydrogen 3.184 N/A PHE 499.A N GLY 506.A O no hydrogen 2.584 N/A ASN 500.A N ILE 284.A O no hydrogen 2.936 N/A PHE 501.A N LEU 504.A O no hydrogen 2.990 N/A GLY 506.A N PHE 499.A O no hydrogen 3.365 N/A THR 507.A OG1 ASN 498.A OD1 no hydrogen 2.457 N/A GLY 508.A N VAL 497.A O no hydrogen 3.009 N/A VAL 509.A N THR 546.A O no hydrogen 2.559 N/A THR 511.A N ASP 544.A O no hydrogen 3.018 N/A THR 511.A OG1 ASP 544.A O no hydrogen 2.729 N/A THR 511.A OG1 THR 546.A OG1 no hydrogen 3.106 N/A LYS 515.A NZ ASP 532.A OD2 no hydrogen 3.108 N/A GLN 521.A N LEU 518.A O no hydrogen 3.345 N/A ASP 526.A N THR 530.A O no hydrogen 3.288 N/A THR 530.A N ASP 526.A OD1 no hydrogen 2.757 N/A THR 530.A OG1 ASP 526.A OD1 no hydrogen 2.696 N/A ASP 532.A N GLY 524.A O no hydrogen 3.414 N/A VAL 534.A N LEU 543.A O no hydrogen 3.328 N/A ARG 535.A N GLN 522.A O no hydrogen 3.454 N/A ARG 535.A NE GLN 521.A O no hydrogen 2.546 N/A ASP 536.A N GLU 541.A O no hydrogen 3.126 N/A GLN 538.A N ASP 536.A OD2 no hydrogen 3.003 N/A GLN 538.A NE2 PHE 287.A O no hydrogen 3.500 N/A THR 539.A N ASP 536.A OD2 no hydrogen 2.636 N/A THR 539.A OG1 ASP 536.A OD2 no hydrogen 2.859 N/A LEU 543.A N VAL 534.A O no hydrogen 3.064 N/A ASP 544.A N THR 511.A O no hydrogen 2.970 N/A ILE 545.A N ASP 532.A O no hydrogen 2.922 N/A THR 546.A N VAL 509.A O no hydrogen 2.697 N/A THR 546.A OG1 THR 511.A OG1 no hydrogen 3.106 N/A GLY 551.A N PHE 276.A O no hydrogen 3.150 N/A VAL 553.A N SER 274.A O no hydrogen 2.815 N/A SER 554.A N LEU 569.A O no hydrogen 2.786 N/A SER 554.A OG TYR 271.A O no hydrogen 3.421 N/A VAL 555.A N TYR 271.A O no hydrogen 3.081 N/A ILE 556.A N ALA 567.A O no hydrogen 2.821 N/A THR 557.A OG1 PRO 558.A O no hydrogen 3.166 N/A THR 557.A OG1 GLN 565.A O no hydrogen 3.153 N/A THR 560.A N VAL 266.A O no hydrogen 3.322 N/A THR 562.A N GLY 559.A O no hydrogen 3.328 N/A SER 563.A N GLY 559.A O no hydrogen 3.305 N/A SER 563.A OG TYR 613.A OH no hydrogen 2.935 N/A ASN 564.A N SER 563.A OG no hydrogen 2.475 N/A GLN 565.A N SER 563.A OG no hydrogen 3.373 N/A ALA 567.A N ILE 556.A O no hydrogen 2.823 N/A VAL 568.A N ILE 590.A O no hydrogen 3.015 N/A LEU 569.A N SER 554.A O no hydrogen 2.541 N/A GLN 571.A N GLY 552.A O no hydrogen 3.168 N/A GLY 572.A N ALA 586.A O no hydrogen 2.550 N/A VAL 573.A N TYR 570.A O no hydrogen 3.467 N/A THR 576.A OG1 GLU 577.A OE2 no hydrogen 3.239 N/A GLU 577.A N ASN 574.A O no hydrogen 3.029 N/A PHE 582.A N LEU 589.A O no hydrogen 3.290 N/A GLN 583.A NE2 THR 584.A O no hydrogen 2.728 N/A THR 584.A OG1 GLY 587.A O no hydrogen 2.383 N/A GLY 587.A N THR 584.A OG1 no hydrogen 3.012 N/A CYS 588.A SG VAL 573.A O no hydrogen 3.614 N/A LEU 589.A N PHE 582.A O no hydrogen 2.842 N/A ILE 590.A N VAL 568.A O no hydrogen 3.081 N/A GLY 591.A N ASN 580.A O no hydrogen 3.196 N/A GLU 593.A N ILE 619.A O no hydrogen 3.263 N/A VAL 595.A N ALA 621.A O no hydrogen 3.343 N/A ASN 597.A ND2 TYR 599.A OH no hydrogen 3.094 N/A ILE 603.A N ALA 611.A O no hydrogen 3.096 N/A ILE 605.A N ILE 609.A O no hydrogen 3.215 N/A GLY 606.A N ILE 609.A O no hydrogen 3.151 N/A ILE 609.A N GLY 606.A O no hydrogen 3.179 N/A CYS 610.A N TYR 622.A O no hydrogen 2.980 N/A CYS 610.A SG ILE 603.A O no hydrogen 3.299 N/A CYS 610.A SG ALA 611.A O no hydrogen 3.805 N/A SER 612.A N ILE 620.A O no hydrogen 3.272 N/A GLN 614.A N SER 618.A O no hydrogen 3.381 N/A GLN 614.A NE2 SER 612.A OG no hydrogen 3.358 N/A SER 616.A OG SER 616.A O no hydrogen 2.536 N/A SER 618.A N GLN 614.A O no hydrogen 3.231 N/A ILE 620.A N SER 612.A O no hydrogen 3.100 N/A ALA 621.A N GLU 593.A O no hydrogen 3.333 N/A MET 624.A N GLY 608.A O no hydrogen 3.080 N/A ASN 637.A N SER 635.A OG no hydrogen 3.324 N/A SER 638.A N SER 635.A OG no hydrogen 3.203 N/A SER 638.A OG SER 635.A OG no hydrogen 3.356 N/A ILE 639.A N PHE 976.A O no hydrogen 2.766 N/A ILE 641.A N LYS 974.A O no hydrogen 3.124 N/A THR 643.A N GLN 972.A O no hydrogen 2.708 N/A THR 643.A OG1 GLN 972.A O no hydrogen 3.166 N/A ASN 644.A N GLN 972.A O no hydrogen 3.263 N/A ASN 644.A ND2 GLN 972.A OE1 no hydrogen 3.449 N/A PHE 645.A N ASN 644.A OD1 no hydrogen 2.792 N/A THR 646.A N VAL 969.A O no hydrogen 2.708 N/A THR 650.A N HIS 965.A O no hydrogen 2.661 N/A THR 650.A OG1 HIS 965.A O no hydrogen 2.992 N/A GLU 652.A N PHE 963.A O no hydrogen 3.235 N/A VAL 656.A N HIS 959.A O no hydrogen 3.430 N/A SER 657.A OG MET 658.A O no hydrogen 2.941 N/A LYS 660.A NZ ASP 702.A OD1 no hydrogen 3.229 N/A LYS 660.A NZ ASP 702.A OD2 no hydrogen 2.742 N/A LYS 660.A NZ PRO 763.A O no hydrogen 3.510 N/A THR 661.A OG1 TYR 908.A OH no hydrogen 2.723 N/A SER 662.A N THR 760.A O no hydrogen 3.221 N/A ASP 664.A N ASP 664.A OD1 no hydrogen 2.494 N/A THR 666.A OG1 ASP 664.A OD2 no hydrogen 3.216 N/A TYR 668.A OH LEU 863.A O no hydrogen 2.725 N/A ASP 672.A N CYS 670.A O no hydrogen 3.028 N/A SER 673.A OG GLU 675.A OE2 no hydrogen 3.482 N/A CYS 676.A N SER 673.A OG no hydrogen 3.288 N/A SER 677.A OG THR 674.A O no hydrogen 3.021 N/A LEU 679.A N GLU 675.A O no hydrogen 3.291 N/A SER 685.A OG SER 685.A O no hydrogen 2.403 N/A GLN 689.A NE2 SER 685.A OG no hydrogen 3.409 N/A ARG 692.A N THR 688.A O no hydrogen 3.210 N/A ALA 693.A N GLN 689.A O no hydrogen 3.313 N/A LEU 694.A N LEU 690.A O no hydrogen 3.092 N/A THR 695.A N LYS 691.A O no hydrogen 3.343 N/A ILE 697.A N ALA 693.A O no hydrogen 3.166 N/A VAL 699.A N THR 695.A O no hydrogen 3.262 N/A GLN 701.A N ILE 697.A O no hydrogen 3.450 N/A LYS 703.A N VAL 699.A O no hydrogen 3.061 N/A ASN 704.A N GLU 700.A O no hydrogen 2.855 N/A THR 705.A N GLN 701.A O no hydrogen 3.293 N/A THR 705.A OG1 GLN 701.A O no hydrogen 3.536 N/A THR 705.A OG1 ASP 702.A O no hydrogen 2.703 N/A GLU 707.A N LYS 703.A O no hydrogen 3.030 N/A PHE 709.A N THR 705.A O no hydrogen 3.059 N/A GLN 711.A N PHE 709.A O no hydrogen 3.015 N/A GLN 711.A NE2 VAL 708.A O no hydrogen 3.618 N/A LYS 713.A NZ TYR 774.A OH no hydrogen 2.807 N/A ASN 728.A N ASN 829.A OD1 no hydrogen 2.955 N/A SER 730.A OG ASN 728.A OD1 no hydrogen 2.995 N/A ASP 735.A N ARG 742.A O no hydrogen 3.338 N/A SER 737.A OG ASP 735.A OD2 no hydrogen 2.772 N/A LYS 738.A NZ ASP 747.A OD2 no hydrogen 2.476 N/A ARG 742.A N SER 740.A O no hydrogen 2.955 N/A SER 743.A N GLU 746.A OE1 no hydrogen 3.238 N/A SER 743.A OG ILE 732.A O no hydrogen 2.711 N/A SER 743.A OG GLU 746.A OE1 no hydrogen 3.369 N/A PHE 744.A N GLN 731.A O no hydrogen 3.032 N/A ASP 747.A N SER 743.A O no hydrogen 2.859 N/A LEU 748.A N ILE 745.A O no hydrogen 2.878 N/A LEU 749.A N ILE 745.A O no hydrogen 2.936 N/A PHE 750.A N GLU 746.A O no hydrogen 3.370 N/A LYS 752.A N LEU 748.A O no hydrogen 3.434 N/A LYS 752.A NZ SER 840.A O no hydrogen 3.303 N/A THR 760.A N SER 662.A O no hydrogen 3.085 N/A THR 760.A OG1 SER 662.A O no hydrogen 2.830 N/A LEU 762.A N LYS 660.A O no hydrogen 2.907 N/A THR 767.A OG1 GLU 769.A OE2 no hydrogen 3.325 N/A GLU 769.A N GLU 769.A OE2 no hydrogen 3.010 N/A MET 770.A N THR 767.A OG1 no hydrogen 3.276 N/A ILE 771.A N THR 767.A O no hydrogen 2.899 N/A ALA 772.A N ASP 768.A O no hydrogen 3.331 N/A GLN 773.A N GLU 769.A O no hydrogen 3.046 N/A TYR 774.A N MET 770.A O no hydrogen 3.193 N/A THR 775.A N ILE 771.A O no hydrogen 2.739 N/A THR 775.A OG1 ILE 771.A O no hydrogen 2.422 N/A SER 776.A N ALA 772.A O no hydrogen 2.897 N/A SER 776.A OG ALA 772.A O no hydrogen 2.638 N/A SER 776.A OG GLN 773.A O no hydrogen 3.426 N/A ALA 777.A N GLN 773.A O no hydrogen 3.282 N/A LEU 778.A N TYR 774.A O no hydrogen 3.289 N/A LEU 779.A N THR 775.A O no hydrogen 2.926 N/A ALA 780.A N SER 776.A O no hydrogen 2.986 N/A GLY 781.A N ALA 777.A O no hydrogen 3.258 N/A THR 782.A OG1 LEU 778.A O no hydrogen 2.553 N/A THR 784.A N ALA 780.A O no hydrogen 3.197 N/A THR 784.A OG1 ALA 780.A O no hydrogen 2.361 N/A SER 785.A N GLY 781.A O no hydrogen 3.178 N/A SER 785.A OG GLY 781.A O no hydrogen 2.373 N/A GLY 786.A N GLY 781.A O no hydrogen 2.761 N/A THR 788.A OG1 SER 785.A O no hydrogen 3.214 N/A ALA 791.A N THR 788.A O no hydrogen 3.356 N/A ILE 797.A N THR 784.A O no hydrogen 3.316 N/A GLN 802.A N PRO 798.A O no hydrogen 3.229 N/A GLN 802.A NE2 ILE 783.A O no hydrogen 3.435 N/A GLN 802.A NE2 ILE 797.A O no hydrogen 3.406 N/A ARG 806.A N GLN 802.A O no hydrogen 3.404 N/A PHE 807.A N MET 803.A O no hydrogen 3.202 N/A ASN 808.A N ALA 804.A O no hydrogen 3.232 N/A GLY 809.A N TYR 805.A O no hydrogen 3.069 N/A ILE 810.A N PHE 807.A O no hydrogen 3.408 N/A VAL 812.A N PHE 807.A O no hydrogen 2.831 N/A LEU 817.A N GLN 814.A O no hydrogen 3.426 N/A ASN 820.A ND2 VAL 816.A O no hydrogen 3.408 N/A ILE 824.A N ASN 820.A O no hydrogen 3.093 N/A ALA 825.A N GLN 821.A O no hydrogen 3.497 N/A ASN 826.A N LYS 822.A O no hydrogen 3.390 N/A GLN 827.A N LEU 823.A O no hydrogen 3.340 N/A PHE 828.A N ILE 824.A O no hydrogen 3.017 N/A ASN 829.A N ALA 825.A O no hydrogen 3.218 N/A ASN 829.A ND2 GLY 726.A O no hydrogen 2.902 N/A SER 830.A N ASN 826.A O no hydrogen 3.318 N/A SER 830.A OG ASN 826.A O no hydrogen 2.602 N/A SER 830.A OG GLN 827.A O no hydrogen 3.189 N/A ALA 831.A N GLN 827.A O no hydrogen 3.361 N/A ILE 832.A N PHE 828.A O no hydrogen 2.975 N/A GLY 833.A N ASN 829.A O no hydrogen 3.342 N/A LYS 834.A N SER 830.A O no hydrogen 3.101 N/A ILE 835.A N ALA 831.A O no hydrogen 3.320 N/A ILE 835.A N ILE 832.A O no hydrogen 3.202 N/A GLN 836.A N ILE 832.A O no hydrogen 3.429 N/A GLN 836.A NE2 PHE 744.A O no hydrogen 3.330 N/A ASP 837.A N GLY 833.A O no hydrogen 3.210 N/A SER 838.A N LYS 834.A O no hydrogen 3.265 N/A SER 838.A OG LYS 834.A O no hydrogen 2.759 N/A SER 838.A OG ILE 835.A O no hydrogen 2.856 N/A LEU 839.A N ILE 835.A O no hydrogen 2.883 N/A SER 840.A N GLN 836.A O no hydrogen 3.354 N/A SER 840.A OG GLN 836.A O no hydrogen 2.528 N/A SER 840.A OG ASP 837.A O no hydrogen 3.338 N/A SER 841.A OG ASP 837.A O no hydrogen 2.481 N/A SER 841.A OG SER 838.A O no hydrogen 3.374 N/A THR 842.A N SER 838.A O no hydrogen 2.939 N/A LEU 849.A N LEU 846.A O no hydrogen 3.297 N/A GLN 850.A N GLY 847.A O no hydrogen 3.275 N/A GLN 850.A NE2 ALA 843.A O no hydrogen 3.213 N/A ASN 854.A N GLN 850.A O no hydrogen 3.179 N/A HIS 855.A N ASP 851.A O no hydrogen 3.347 N/A ALA 857.A N VAL 853.A O no hydrogen 3.189 N/A GLN 858.A N ASN 854.A O no hydrogen 2.904 N/A ALA 859.A N HIS 855.A O no hydrogen 3.189 N/A ASN 861.A N ALA 857.A O no hydrogen 3.431 N/A THR 862.A OG1 GLN 858.A O no hydrogen 3.106 N/A THR 862.A OG1 ALA 859.A O no hydrogen 3.102 N/A LEU 863.A N LEU 860.A O no hydrogen 3.237 N/A LYS 865.A N ASN 861.A O no hydrogen 3.055 N/A LYS 865.A NZ ASN 861.A O no hydrogen 2.917 N/A GLN 866.A N THR 862.A O no hydrogen 3.315 N/A LEU 867.A N VAL 864.A O no hydrogen 3.162 N/A SER 868.A OG LYS 865.A O no hydrogen 2.551 N/A SER 869.A OG GLN 866.A O no hydrogen 3.056 N/A SER 869.A OG GLN 866.A OE1 no hydrogen 3.535 N/A ALA 873.A N LYS 870.A O no hydrogen 3.270 N/A SER 875.A OG VAL 877.A O no hydrogen 3.530 N/A SER 876.A OG LEU 867.A O no hydrogen 2.376 N/A SER 876.A OG SER 869.A O no hydrogen 2.610 N/A VAL 877.A N SER 875.A OG no hydrogen 2.929 N/A SER 883.A N ASN 879.A O no hydrogen 3.112 N/A SER 883.A OG ASN 879.A O no hydrogen 2.368 N/A LEU 885.A N ILE 881.A O no hydrogen 3.291 N/A GLU 889.A N ASP 886.A O no hydrogen 2.841 N/A ALA 890.A N ASP 886.A O no hydrogen 2.603 N/A GLN 893.A N ALA 890.A O no hydrogen 3.040 N/A ILE 894.A N ALA 890.A O no hydrogen 3.312 N/A ASP 895.A N GLU 891.A O no hydrogen 3.248 N/A ARG 896.A NH1 GLY 872.A O no hydrogen 2.979 N/A LEU 897.A N GLN 893.A O no hydrogen 3.284 N/A ILE 898.A N ILE 894.A O no hydrogen 2.743 N/A THR 899.A OG1 ASP 895.A O no hydrogen 2.370 N/A GLY 900.A N ARG 896.A O no hydrogen 3.336 N/A ARG 901.A N LEU 897.A O no hydrogen 3.119 N/A ARG 901.A NH1 ILE 669.A O no hydrogen 2.600 N/A GLN 903.A N THR 899.A O no hydrogen 3.043 N/A SER 904.A N GLY 900.A O no hydrogen 3.398 N/A SER 904.A OG GLY 900.A O no hydrogen 2.911 N/A SER 904.A OG ARG 901.A O no hydrogen 3.169 N/A LEU 905.A N ARG 901.A O no hydrogen 3.260 N/A GLN 906.A N LEU 902.A O no hydrogen 2.576 N/A THR 907.A N GLN 903.A O no hydrogen 2.770 N/A THR 907.A OG1 GLN 903.A O no hydrogen 2.354 N/A TYR 908.A N SER 904.A O no hydrogen 3.142 N/A TYR 908.A OH THR 661.A OG1 no hydrogen 2.723 N/A THR 910.A N THR 907.A O no hydrogen 3.313 N/A THR 910.A OG1 GLN 906.A O no hydrogen 2.959 N/A THR 910.A OG1 THR 907.A O no hydrogen 2.864 N/A GLN 911.A N THR 907.A O no hydrogen 3.122 N/A GLN 911.A NE2 THR 907.A O no hydrogen 3.639 N/A GLN 911.A NE2 THR 910.A OG1 no hydrogen 3.124 N/A GLN 912.A N TYR 908.A O no hydrogen 3.278 N/A GLN 912.A NE2 ASN 856.A OD1 no hydrogen 2.622 N/A LEU 913.A N VAL 909.A O no hydrogen 3.209 N/A ILE 914.A N THR 910.A O no hydrogen 3.485 N/A ARG 915.A N GLN 911.A O no hydrogen 3.252 N/A ALA 916.A N GLN 912.A O no hydrogen 2.731 N/A ALA 917.A N LEU 913.A O no hydrogen 2.916 N/A GLU 918.A N ILE 914.A O no hydrogen 2.980 N/A ILE 919.A N ARG 915.A O no hydrogen 2.927 N/A ARG 920.A N ALA 916.A O no hydrogen 3.045 N/A ALA 921.A N ALA 917.A O no hydrogen 3.377 N/A SER 922.A N GLU 918.A O no hydrogen 3.369 N/A SER 922.A OG PRO 655.A O no hydrogen 3.278 N/A SER 922.A OG GLU 918.A O no hydrogen 3.004 N/A ALA 923.A N ILE 919.A O no hydrogen 3.294 N/A ASN 924.A N ARG 920.A O no hydrogen 3.094 N/A LEU 925.A N ALA 921.A O no hydrogen 3.066 N/A ALA 926.A N SER 922.A O no hydrogen 2.708 N/A ALA 927.A N ALA 923.A O no hydrogen 2.760 N/A THR 928.A N ASN 924.A O no hydrogen 3.097 N/A THR 928.A OG1 ASN 924.A O no hydrogen 2.525 N/A LYS 929.A N LEU 925.A O no hydrogen 3.053 N/A LYS 929.A NZ GLU 652.A OE1 no hydrogen 2.488 N/A MET 930.A N ALA 926.A O no hydrogen 2.658 N/A SER 931.A N THR 928.A O no hydrogen 3.172 N/A SER 931.A OG ALA 927.A O no hydrogen 2.683 N/A SER 931.A OG THR 928.A O no hydrogen 2.966 N/A GLU 932.A N THR 928.A O no hydrogen 2.851 N/A CYS 933.A N LYS 929.A O no hydrogen 3.302 N/A CYS 933.A SG LYS 929.A O no hydrogen 3.444 N/A GLN 937.A NE2 ARG 806.A O no hydrogen 2.548 N/A SER 938.A N HIS 949.A ND1 no hydrogen 3.501 N/A ARG 940.A N SER 938.A OG no hydrogen 3.202 N/A SER 952.A OG HIS 949.A NE2 no hydrogen 3.205 N/A SER 952.A OG HIS 965.A ND1 no hydrogen 2.563 N/A PHE 953.A N LEU 964.A O no hydrogen 3.427 N/A GLN 955.A N VAL 962.A O no hydrogen 2.727 N/A GLN 955.A NE2 ILE 732.A O no hydrogen 3.159 N/A GLN 955.A NE2 PRO 954.A O no hydrogen 3.514 N/A SER 956.A N GLU 746.A OE2 no hydrogen 2.919 N/A VAL 961.A N LEU 654.A O no hydrogen 3.072 N/A VAL 962.A N GLN 955.A O no hydrogen 3.008 N/A PHE 963.A N GLU 652.A O no hydrogen 2.953 N/A LEU 964.A N PHE 953.A O no hydrogen 3.173 N/A HIS 965.A N THR 650.A O no hydrogen 2.999 N/A HIS 965.A ND1 SER 952.A OG no hydrogen 2.563 N/A THR 967.A N SER 648.A O no hydrogen 3.155 N/A TYR 968.A N TYR 948.A O no hydrogen 2.945 N/A VAL 969.A N THR 646.A O no hydrogen 3.152 N/A ALA 971.A N ASN 644.A O no hydrogen 2.870 N/A GLN 972.A N ASN 644.A O no hydrogen 3.189 N/A LYS 974.A N ILE 641.A O no hydrogen 3.106 N/A PHE 976.A N ILE 639.A O no hydrogen 2.781 N/A THR 977.A N SER 998.A O no hydrogen 3.453 N/A THR 977.A OG1 SER 998.A O no hydrogen 3.442 N/A THR 977.A OG1 SER 998.A OG no hydrogen 2.517 N/A THR 978.A N ASN 637.A O no hydrogen 2.646 N/A THR 978.A OG1 PHE 996.A O no hydrogen 2.666 N/A ILE 982.A N HIS 989.A O no hydrogen 3.119 N/A CYS 983.A N VAL 1034.A O no hydrogen 2.936 N/A LYS 987.A NZ ASP 985.A OD1 no hydrogen 3.237 N/A ALA 988.A N GLY 1025.A O no hydrogen 3.015 N/A PHE 990.A N PHE 1022.A O no hydrogen 3.058 N/A ARG 992.A N ASN 1020.A O no hydrogen 3.217 N/A ARG 992.A NE ASP 1019.A O no hydrogen 2.952 N/A ARG 992.A NH2 ASP 1019.A O no hydrogen 2.865 N/A ARG 992.A NH2 ASN 1020.A OD1 no hydrogen 3.517 N/A VAL 995.A N THR 1006.A O no hydrogen 2.812 N/A VAL 997.A N PHE 1004.A O no hydrogen 2.758 N/A SER 998.A OG THR 977.A O no hydrogen 2.679 N/A SER 998.A OG THR 977.A OG1 no hydrogen 2.517 N/A ASN 999.A N HIS 1002.A O no hydrogen 3.412 N/A HIS 1002.A N ASN 999.A OD1 no hydrogen 3.395 N/A PHE 1004.A N VAL 997.A O no hydrogen 2.807 N/A VAL 1005.A N GLN 1014.A O no hydrogen 3.233 N/A THR 1006.A N VAL 995.A O no hydrogen 3.059 N/A THR 1006.A OG1 PHE 1010.A O no hydrogen 3.078 N/A THR 1006.A OG1 GLU 1012.A O no hydrogen 3.282 N/A GLN 1007.A NE2 GLU 993.A O no hydrogen 3.522 N/A ASN 1009.A ND2 TYR 948.A OH no hydrogen 3.242 N/A GLU 1012.A N THR 1006.A OG1 no hydrogen 2.742 N/A THR 1017.A OG1 ASP 1019.A OD1 no hydrogen 2.392 N/A THR 1021.A OG1 THR 1017.A O no hydrogen 2.586 N/A PHE 1022.A N PHE 990.A O no hydrogen 3.150 N/A SER 1024.A N ALA 988.A O no hydrogen 3.348 N/A ASN 1026.A N ASN 1026.A OD1 no hydrogen 2.650 N/A ASN 1036.A N CYS 983.A O no hydrogen 3.115 N/A THR 1037.A N ASN 1036.A OD1 no hydrogen 2.788 N/A TYR 1039.A N ILE 1016.A O no hydrogen 3.073 N/A GLN 1043.A NE2 ASP 1040.A O no hydrogen 3.301 N/A