Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8tyl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N VAL 36.A O no hydrogen 2.895 N/A SER 5.A N SER 34.A O no hydrogen 2.899 N/A SER 5.A OG PRO 31.A O no hydrogen 3.432 N/A SER 5.A OG SER 34.A O no hydrogen 3.557 N/A SER 5.A OG SER 34.A OG no hydrogen 2.617 N/A PHE 6.A N ASN 4.A OD1 no hydrogen 3.007 N/A ARG 8.A N SER 5.A O no hydrogen 3.348 N/A ARG 8.A NH1 SER 116.A OG no hydrogen 2.958 N/A ARG 8.A NH2 PRO 112.A O no hydrogen 3.522 N/A TYR 11.A OH LEU 28.A O no hydrogen 2.405 N/A TYR 12.A N LEU 118.A O no hydrogen 3.250 N/A ARG 18.A NH1 ASP 14.A OD1 no hydrogen 3.312 N/A ARG 18.A NH1 ASP 14.A OD2 no hydrogen 2.423 N/A SER 19.A OG ASN 155.A O no hydrogen 3.121 N/A SER 19.A OG GLU 156.A O no hydrogen 2.922 N/A SER 20.A N ASN 155.A O no hydrogen 3.144 N/A HIS 23.A N LEU 152.A O no hydrogen 3.097 N/A THR 25.A N PHE 150.A O no hydrogen 2.954 N/A LEU 28.A N ASP 27.A OD1 no hydrogen 2.890 N/A PHE 29.A N GLN 146.A O no hydrogen 3.306 N/A PHE 33.A N PHE 6.A O no hydrogen 2.788 N/A SER 34.A N SER 5.A OG no hydrogen 2.990 N/A SER 34.A OG SER 5.A OG no hydrogen 2.617 N/A SER 34.A OG PRO 31.A O no hydrogen 3.284 N/A VAL 36.A N THR 3.A O no hydrogen 2.908 N/A THR 37.A N VAL 142.A O no hydrogen 3.209 N/A TRP 38.A N ALA 1.A O no hydrogen 2.887 N/A PHE 43.A N THR 131.A O no hydrogen 2.690 N/A VAL 47.A N PHE 89.A O no hydrogen 3.052 N/A TYR 48.A N GLY 143.A O no hydrogen 3.052 N/A SER 51.A N ARG 85.A O no hydrogen 2.835 N/A SER 51.A OG PHE 49.A O no hydrogen 3.344 N/A THR 52.A OG1 ASN 83.A O no hydrogen 3.148 N/A TRP 55.A N ILE 63.A O no hydrogen 2.878 N/A PHE 57.A N LEU 61.A O no hydrogen 2.884 N/A GLY 58.A N ARG 132.A O no hydrogen 3.187 N/A LEU 61.A N PHE 57.A O no hydrogen 2.896 N/A ILE 63.A N TRP 55.A O no hydrogen 2.939 N/A ASN 69.A N ASN 66.A O no hydrogen 3.075 N/A VAL 70.A N SER 81.A O no hydrogen 2.902 N/A VAL 71.A N VAL 64.A O no hydrogen 2.899 N/A TYR 79.A N ILE 72.A O no hydrogen 2.897 N/A LEU 84.A N THR 103.A O no hydrogen 3.187 N/A ARG 85.A N SER 51.A O no hydrogen 2.816 N/A GLU 86.A N LYS 101.A O no hydrogen 3.163 N/A PHE 89.A N VAL 47.A O no hydrogen 2.834 N/A LYS 90.A N LYS 97.A O no hydrogen 3.445 N/A LYS 90.A NZ TYR 11.A OH no hydrogen 3.477 N/A ILE 92.A N TYR 95.A O no hydrogen 2.910 N/A TYR 95.A N ILE 92.A O no hydrogen 2.916 N/A PHE 96.A N LEU 124.A O no hydrogen 2.506 N/A LYS 97.A N LYS 90.A O no hydrogen 3.118 N/A ILE 98.A N VAL 122.A O no hydrogen 2.806 N/A TYR 99.A N VAL 88.A O no hydrogen 3.080 N/A LYS 101.A NZ HIS 102.A O no hydrogen 2.677 N/A THR 103.A N LEU 84.A O no hydrogen 3.424 N/A ILE 105.A N LYS 82.A O no hydrogen 3.217 N/A LEU 118.A N VAL 10.A O no hydrogen 3.069 N/A LEU 121.A N ILE 98.A O no hydrogen 3.156 N/A VAL 122.A N ILE 98.A O no hydrogen 3.448 N/A LEU 124.A N PHE 96.A O no hydrogen 2.441 N/A GLY 127.A N GLY 94.A O no hydrogen 2.884 N/A THR 131.A N GLY 58.A O no hydrogen 3.337 N/A GLN 134.A N ILE 56.A O no hydrogen 2.957 N/A GLN 134.A NE2 LEU 41.A O no hydrogen 3.607 N/A GLN 134.A NE2 PHE 133.A O no hydrogen 3.153 N/A TYR 141.A N ALA 50.A O no hydrogen 2.857 N/A VAL 142.A N THR 37.A O no hydrogen 3.106 N/A GLY 143.A N TYR 48.A O no hydrogen 2.771 N/A TYR 144.A OH PRO 42.A O no hydrogen 2.943 N/A GLN 146.A N PHE 29.A O no hydrogen 3.110 N/A GLN 146.A NE2 TYR 144.A O no hydrogen 3.307 N/A ARG 148.A N GLN 146.A O no hydrogen 3.058 N/A PHE 150.A N THR 25.A O no hydrogen 2.781 N/A LEU 151.A N VAL 164.A O no hydrogen 2.976 N/A LEU 152.A N HIS 23.A O no hydrogen 2.911 N/A LYS 153.A N ASP 162.A O no hydrogen 3.047 N/A TYR 154.A N VAL 21.A O no hydrogen 3.385 N/A ASN 155.A N THR 159.A O no hydrogen 3.014 N/A GLY 158.A N ASN 155.A O no hydrogen 3.311 N/A THR 159.A N ASN 155.A OD1 no hydrogen 2.480 N/A THR 161.A N LYS 153.A O no hydrogen 3.126 N/A VAL 164.A N LEU 151.A O no hydrogen 2.922 N/A CYS 166.A N THR 149.A O no hydrogen 3.234 N/A SER 172.A N ASP 169.A OD1 no hydrogen 3.088 N/A SER 172.A OG ASP 169.A OD1 no hydrogen 2.794 N/A GLU 173.A N ASP 169.A O no hydrogen 2.924 N/A THR 174.A N PRO 170.A O no hydrogen 2.879 N/A THR 174.A OG1 PRO 170.A O no hydrogen 3.172 N/A LYS 175.A N LEU 171.A O no hydrogen 2.930 N/A CYS 176.A N SER 172.A O no hydrogen 2.857 N/A THR 177.A N GLU 173.A O no hydrogen 2.896 N/A THR 177.A OG1 GLU 173.A O no hydrogen 2.835 N/A LEU 178.A N THR 174.A O no hydrogen 2.903 N/A LYS 179.A N CYS 176.A O no hydrogen 3.403 N/A SER 180.A N LYS 175.A O no hydrogen 3.323 N/A SER 180.A OG THR 182.A O no hydrogen 3.230 N/A THR 182.A N SER 180.A OG no hydrogen 3.216 N/A LYS 185.A NZ ASP 497.A OD1 no hydrogen 2.441 N/A GLY 186.A N THR 433.A O no hydrogen 2.892 N/A TYR 188.A N VAL 431.A O no hydrogen 2.898 N/A TYR 188.A OH GLU 184.A O no hydrogen 2.401 N/A GLN 189.A NE2 GLN 447.A OE1 no hydrogen 3.603 N/A THR 190.A N VAL 429.A O no hydrogen 3.267 N/A THR 190.A OG1 GLU 173.A OE1 no hydrogen 3.402 N/A THR 190.A OG1 VAL 429.A O no hydrogen 3.172 N/A PHE 193.A N GLY 427.A O no hydrogen 2.626 N/A VAL 195.A N SER 425.A O no hydrogen 3.191 N/A THR 198.A N CYS 372.A O no hydrogen 2.822 N/A THR 198.A OG1 CYS 372.A O no hydrogen 3.199 N/A ILE 201.A N ASN 374.A O no hydrogen 2.749 N/A VAL 202.A N THR 365.A OG1 no hydrogen 2.901 N/A ARG 203.A N ASN 376.A O no hydrogen 3.038 N/A ARG 203.A NE ASP 412.A OD1 no hydrogen 3.149 N/A ARG 203.A NH2 ASP 412.A OD1 no hydrogen 3.444 N/A ARG 203.A NH2 ASP 412.A OD2 no hydrogen 2.665 N/A ILE 207.A N PRO 205.A O no hydrogen 2.959 N/A PHE 213.A N CYS 211.A O no hydrogen 3.037 N/A VAL 216.A N PHE 213.A O no hydrogen 3.257 N/A PHE 217.A N PHE 213.A O no hydrogen 2.928 N/A ASN 218.A N GLY 214.A O no hydrogen 2.882 N/A ALA 227.A N SER 224.A O no hydrogen 3.205 N/A ASN 229.A N SER 274.A O no hydrogen 2.944 N/A LYS 231.A N ALA 272.A O no hydrogen 2.892 N/A ARG 232.A NE ASN 269.A OD1 no hydrogen 3.547 N/A ILE 233.A N VAL 270.A O no hydrogen 2.857 N/A SER 234.A OG ASN 235.A OD1 no hydrogen 3.542 N/A VAL 237.A N ASN 209.A O no hydrogen 3.326 N/A ALA 238.A N CYS 359.A O no hydrogen 2.987 N/A SER 241.A OG ASP 239.A OD1 no hydrogen 2.475 N/A VAL 242.A N ASP 239.A OD1 no hydrogen 3.436 N/A TYR 244.A N TYR 240.A O no hydrogen 2.907 N/A ASN 245.A N SER 241.A O no hydrogen 2.903 N/A SER 246.A N VAL 242.A O no hydrogen 2.909 N/A SER 248.A N SER 246.A OG no hydrogen 3.216 N/A SER 248.A OG SER 246.A OG no hydrogen 2.714 N/A SER 250.A OG ALA 310.A O no hydrogen 2.419 N/A THR 251.A N ALA 310.A O no hydrogen 2.911 N/A LYS 253.A N VAL 308.A O no hydrogen 2.940 N/A TYR 255.A N GLY 306.A O no hydrogen 3.346 N/A LYS 261.A N SER 258.A O no hydrogen 3.271 N/A LYS 261.A N SER 258.A OG no hydrogen 3.242 N/A ASP 264.A N LYS 261.A O no hydrogen 3.240 N/A LEU 265.A N LYS 261.A O no hydrogen 2.924 N/A CYS 266.A SG PHE 267.A O no hydrogen 3.732 N/A PHE 267.A N VAL 358.A O no hydrogen 2.620 N/A THR 268.A OG1 GLU 350.A O no hydrogen 3.141 N/A THR 268.A OG1 GLU 350.A OE1 no hydrogen 3.316 N/A ASN 269.A ND2 GLU 350.A OE1 no hydrogen 2.565 N/A VAL 270.A N ILE 233.A O no hydrogen 2.971 N/A TYR 271.A N SER 348.A O no hydrogen 2.911 N/A ALA 272.A N LYS 231.A O no hydrogen 2.901 N/A ASP 273.A N VAL 346.A O no hydrogen 2.925 N/A SER 274.A N ASN 229.A O no hydrogen 2.875 N/A PHE 275.A N VAL 344.A O no hydrogen 2.943 N/A ILE 277.A N TYR 342.A O no hydrogen 2.925 N/A GLY 279.A N GLY 338.A O no hydrogen 2.815 N/A VAL 282.A N GLY 279.A O no hydrogen 3.253 N/A ARG 283.A NH2 GLN 289.A OE1 no hydrogen 3.092 N/A GLN 284.A N GLU 281.A O no hydrogen 3.058 N/A ILE 285.A N VAL 282.A O no hydrogen 3.280 N/A ALA 286.A N GLN 284.A O no hydrogen 3.051 N/A ALA 294.A N GLN 284.A OE1 no hydrogen 3.264 N/A ASP 295.A N GLY 291.A O no hydrogen 3.186 N/A ASN 297.A N ILE 293.A O no hydrogen 3.219 N/A TYR 298.A N ILE 293.A O no hydrogen 2.583 N/A TYR 298.A OH ASP 273.A OD2 no hydrogen 3.012 N/A PHE 304.A N PRO 301.A O no hydrogen 3.223 N/A THR 305.A OG1 ASP 303.A O no hydrogen 3.294 N/A CYS 307.A N LEU 347.A O no hydrogen 2.893 N/A VAL 308.A N LYS 253.A O no hydrogen 2.851 N/A ILE 309.A N VAL 345.A O no hydrogen 2.887 N/A ALA 310.A N THR 251.A O no hydrogen 2.943 N/A TRP 311.A N ARG 343.A O no hydrogen 2.965 N/A SER 313.A N PRO 341.A O no hydrogen 2.909 N/A SER 313.A OG PRO 341.A O no hydrogen 3.521 N/A LEU 316.A N SER 313.A O no hydrogen 3.297 N/A ASP 317.A N SER 313.A O no hydrogen 3.196 N/A ARG 323.A NH1 SER 325.A O no hydrogen 2.506 N/A ARG 323.A NH2 ASP 333.A OD2 no hydrogen 3.464 N/A THR 336.A OG1 SER 335.A O no hydrogen 2.569 N/A TYR 342.A N ILE 277.A O no hydrogen 2.887 N/A ARG 343.A N TRP 311.A O no hydrogen 2.867 N/A VAL 344.A N PHE 275.A O no hydrogen 2.896 N/A VAL 345.A N ILE 309.A O no hydrogen 2.889 N/A VAL 346.A N ASP 273.A O no hydrogen 2.875 N/A LEU 347.A N CYS 307.A O no hydrogen 2.889 N/A SER 348.A N TYR 271.A O no hydrogen 2.899 N/A SER 348.A OG TYR 271.A O no hydrogen 3.530 N/A PHE 349.A N THR 305.A O no hydrogen 2.927 N/A GLU 350.A N ASN 269.A O no hydrogen 2.928 N/A THR 357.A N PHE 267.A O no hydrogen 3.002 N/A THR 357.A OG1 PRO 355.A O no hydrogen 3.277 N/A VAL 358.A N PHE 267.A O no hydrogen 2.569 N/A LYS 362.A N GLY 360.A O no hydrogen 2.866 N/A THR 365.A N VAL 202.A O no hydrogen 2.688 N/A THR 365.A OG1 VAL 202.A O no hydrogen 3.347 N/A THR 365.A OG1 ASN 366.A O no hydrogen 3.398 N/A LYS 369.A NZ GLU 388.A OE1 no hydrogen 3.192 N/A ASN 370.A N LEU 386.A O no hydrogen 2.915 N/A CYS 372.A SG VAL 195.A O no hydrogen 3.633 N/A CYS 372.A SG GLN 196.A O no hydrogen 3.528 N/A VAL 373.A N GLY 384.A O no hydrogen 3.026 N/A ASN 374.A N GLU 199.A O no hydrogen 2.697 N/A PHE 377.A N LEU 380.A O no hydrogen 3.422 N/A GLY 379.A N ASN 376.A OD1 no hydrogen 3.193 N/A LEU 380.A N PHE 377.A O no hydrogen 2.998 N/A GLY 384.A N VAL 373.A O no hydrogen 3.005 N/A VAL 385.A N THR 422.A O no hydrogen 2.534 N/A THR 387.A N ASP 420.A O no hydrogen 2.889 N/A SER 389.A N ILE 418.A O no hydrogen 3.361 N/A LYS 392.A NZ ASN 390.A O no hydrogen 3.516 N/A PHE 393.A N LYS 391.A O no hydrogen 2.906 N/A LEU 394.A N GLN 397.A OE1 no hydrogen 2.493 N/A GLN 397.A N LEU 394.A O no hydrogen 2.968 N/A GLY 400.A N ALA 409.A O no hydrogen 2.886 N/A ASP 402.A N THR 406.A O no hydrogen 3.148 N/A ASP 405.A N ASP 402.A O no hydrogen 3.142 N/A ASP 408.A N GLY 400.A O no hydrogen 3.039 N/A VAL 410.A N LEU 419.A O no hydrogen 2.914 N/A ARG 411.A N GLN 398.A O no hydrogen 2.903 N/A ARG 411.A NE GLN 397.A O no hydrogen 3.097 N/A ARG 411.A NH2 GLN 397.A O no hydrogen 3.513 N/A ASP 412.A N GLU 417.A O no hydrogen 2.907 N/A GLU 417.A N THR 415.A O no hydrogen 2.646 N/A LEU 419.A N VAL 410.A O no hydrogen 2.889 N/A ASP 420.A N THR 387.A O no hydrogen 2.504 N/A ILE 421.A N ASP 408.A O no hydrogen 2.881 N/A THR 422.A N VAL 385.A O no hydrogen 2.922 N/A GLY 427.A N PHE 193.A O no hydrogen 3.291 N/A VAL 429.A N GLN 189.A OE1 no hydrogen 3.205 N/A VAL 429.A N SER 191.A O no hydrogen 3.328 N/A SER 430.A N LEU 445.A O no hydrogen 2.912 N/A SER 430.A OG GLN 447.A OE1 no hydrogen 2.721 N/A VAL 431.A N TYR 188.A O no hydrogen 2.889 N/A ILE 432.A N ALA 443.A O no hydrogen 2.866 N/A THR 433.A N GLY 186.A O no hydrogen 2.936 N/A THR 433.A OG1 PRO 434.A O no hydrogen 2.918 N/A THR 436.A N VAL 183.A O no hydrogen 3.360 N/A THR 438.A N GLY 435.A O no hydrogen 2.835 N/A SER 439.A N GLY 435.A O no hydrogen 3.073 N/A GLU 441.A N SER 439.A OG no hydrogen 3.171 N/A ALA 443.A N ILE 432.A O no hydrogen 2.922 N/A VAL 444.A N ILE 485.A O no hydrogen 2.981 N/A LEU 445.A N SER 430.A O no hydrogen 2.881 N/A TYR 446.A N CYS 483.A O no hydrogen 2.909 N/A TYR 446.A OH TYR 470.A O no hydrogen 3.112 N/A GLN 447.A N GLY 428.A O no hydrogen 2.914 N/A CYS 451.A SG PHE 477.A O no hydrogen 4.011 N/A CYS 451.A SG GLN 478.A OE1 no hydrogen 3.333 N/A ILE 458.A N VAL 454.A O no hydrogen 3.201 N/A GLN 462.A N HIS 459.A O no hydrogen 3.037 N/A LEU 463.A N ALA 460.A O no hydrogen 2.980 N/A THR 464.A OG1 LEU 168.A O no hydrogen 2.561 N/A TRP 467.A N THR 464.A O no hydrogen 2.922 N/A ARG 468.A N PRO 465.A O no hydrogen 3.264 N/A ARG 468.A NE ALA 460.A O no hydrogen 2.457 N/A VAL 469.A N THR 466.A O no hydrogen 3.291 N/A SER 471.A N ARG 468.A O no hydrogen 3.266 N/A SER 471.A OG ARG 468.A O no hydrogen 2.743 N/A VAL 476.A N SER 474.A O no hydrogen 3.060 N/A PHE 477.A N LEU 484.A O no hydrogen 2.794 N/A GLN 478.A NE2 THR 479.A O no hydrogen 3.297 N/A THR 479.A N GLY 482.A O no hydrogen 2.819 N/A THR 479.A OG1 GLY 482.A O no hydrogen 2.648 N/A GLY 482.A N THR 479.A O no hydrogen 3.201 N/A CYS 483.A N TYR 446.A O no hydrogen 2.982 N/A CYS 483.A SG PHE 477.A O no hydrogen 3.969 N/A LEU 484.A N PHE 477.A O no hydrogen 2.696 N/A ILE 485.A N VAL 444.A O no hydrogen 2.933 N/A GLY 486.A N ASN 475.A O no hydrogen 3.217 N/A GLU 488.A N ILE 513.A O no hydrogen 2.911 N/A VAL 490.A N ALA 515.A O no hydrogen 2.917 N/A SER 493.A OG THR 517.A OG1 no hydrogen 3.278 N/A ILE 498.A N ALA 506.A O no hydrogen 2.923 N/A ILE 500.A N ILE 504.A O no hydrogen 2.923 N/A ILE 504.A N GLY 501.A O no hydrogen 3.126 N/A CYS 505.A N TYR 516.A O no hydrogen 2.905 N/A ALA 506.A N ILE 498.A O no hydrogen 2.885 N/A SER 507.A N ILE 514.A O no hydrogen 2.929 N/A SER 507.A OG ASP 497.A OD2 no hydrogen 2.805 N/A SER 507.A OG GLN 509.A OE1 no hydrogen 2.944 N/A GLN 509.A N SER 512.A O no hydrogen 2.913 N/A THR 510.A OG1 GLN 511.A OE1 no hydrogen 2.570 N/A SER 512.A N GLN 509.A O no hydrogen 2.898 N/A ILE 514.A N SER 507.A O no hydrogen 2.878 N/A ALA 515.A N GLU 488.A O no hydrogen 2.881 N/A TYR 516.A N CYS 505.A O no hydrogen 2.911 N/A TYR 516.A OH GLU 495.A O no hydrogen 2.687 N/A THR 517.A OG1 SER 493.A OG no hydrogen 3.278 N/A MET 518.A N GLY 503.A O no hydrogen 3.128 N/A SER 519.A N TYR 494.A O no hydrogen 3.031 N/A TYR 528.A N VAL 526.A O no hydrogen 2.709 N/A SER 532.A OG PHE 869.A O no hydrogen 3.443 N/A ILE 533.A N PHE 869.A O no hydrogen 2.911 N/A ILE 535.A N LYS 867.A O no hydrogen 2.936 N/A THR 537.A N GLN 865.A O no hydrogen 2.845 N/A THR 540.A N VAL 862.A O no hydrogen 2.684 N/A THR 540.A OG1 VAL 862.A O no hydrogen 3.154 N/A ILE 541.A N GLN 720.A OE1 no hydrogen 2.951 N/A SER 542.A N THR 860.A O no hydrogen 3.296 N/A SER 542.A OG THR 860.A OG1 no hydrogen 3.018 N/A THR 544.A N HIS 858.A O no hydrogen 3.139 N/A GLU 546.A N PHE 856.A O no hydrogen 2.916 N/A LEU 548.A N VAL 854.A O no hydrogen 3.166 N/A VAL 550.A N HIS 852.A O no hydrogen 3.157 N/A SER 551.A OG THR 599.A OG1 no hydrogen 3.340 N/A MET 552.A N GLN 595.A OE1 no hydrogen 3.188 N/A LYS 554.A NZ ASP 596.A OD2 no hydrogen 2.642 N/A LYS 554.A NZ PRO 656.A O no hydrogen 3.318 N/A SER 556.A N THR 653.A O no hydrogen 2.779 N/A SER 556.A OG THR 653.A O no hydrogen 3.510 N/A ASP 558.A N GLY 651.A O no hydrogen 2.902 N/A CYS 559.A SG CYS 581.A O no hydrogen 3.015 N/A TYR 562.A N ASP 558.A O no hydrogen 2.882 N/A TYR 562.A OH LEU 756.A O no hydrogen 2.910 N/A ILE 563.A N CYS 559.A O no hydrogen 2.954 N/A CYS 564.A N THR 560.A O no hydrogen 2.912 N/A SER 571.A N SER 567.A O no hydrogen 2.904 N/A ASN 572.A N THR 568.A O no hydrogen 2.893 N/A LEU 573.A N GLU 569.A O no hydrogen 2.944 N/A LEU 574.A N CYS 570.A O no hydrogen 2.866 N/A LEU 575.A N SER 571.A O no hydrogen 2.917 N/A GLN 576.A N LEU 573.A O no hydrogen 3.340 N/A TYR 577.A N LEU 574.A O no hydrogen 3.114 N/A CYS 581.A SG THR 560.A OG1 no hydrogen 2.837 N/A GLN 583.A N SER 579.A O no hydrogen 2.942 N/A LEU 584.A N PHE 580.A O no hydrogen 2.937 N/A ASN 585.A N CYS 581.A O no hydrogen 2.983 N/A ARG 586.A N THR 582.A O no hydrogen 2.930 N/A ALA 587.A N GLN 583.A O no hydrogen 2.919 N/A LEU 588.A N LEU 584.A O no hydrogen 3.005 N/A THR 589.A N ASN 585.A O no hydrogen 2.956 N/A THR 589.A OG1 ASN 585.A O no hydrogen 2.838 N/A GLY 590.A N ARG 586.A O no hydrogen 2.937 N/A ILE 591.A N ALA 587.A O no hydrogen 2.952 N/A ALA 592.A N LEU 588.A O no hydrogen 3.002 N/A VAL 593.A N THR 589.A O no hydrogen 2.983 N/A GLU 594.A N GLY 590.A O no hydrogen 2.902 N/A GLN 595.A N ILE 591.A O no hydrogen 2.946 N/A GLN 595.A NE2 ILE 591.A O no hydrogen 3.316 N/A GLN 595.A NE2 GLU 594.A OE2 no hydrogen 3.113 N/A ASP 596.A N ALA 592.A O no hydrogen 3.060 N/A LYS 597.A N VAL 593.A O no hydrogen 2.933 N/A ASN 598.A N GLU 594.A O no hydrogen 2.860 N/A ASN 598.A ND2 GLU 594.A OE2 no hydrogen 3.410 N/A THR 599.A N GLN 595.A O no hydrogen 3.050 N/A THR 599.A OG1 GLN 595.A O no hydrogen 3.361 N/A GLN 600.A N ASP 596.A O no hydrogen 2.973 N/A GLU 601.A N LYS 597.A O no hydrogen 2.892 N/A VAL 602.A N ASN 598.A O no hydrogen 2.980 N/A PHE 603.A N THR 599.A O no hydrogen 2.988 N/A ALA 604.A N GLN 600.A O no hydrogen 2.928 N/A GLN 605.A N PHE 603.A O no hydrogen 2.826 N/A GLN 605.A NE2 VAL 602.A O no hydrogen 3.569 N/A GLN 605.A NE2 ALA 820.A O no hydrogen 3.350 N/A LYS 616.A NZ PRO 613.A O no hydrogen 2.483 N/A ASP 617.A N ASP 617.A OD1 no hydrogen 2.424 N/A ASN 622.A N ASN 722.A OD1 no hydrogen 3.421 N/A GLN 625.A N GLN 625.A OE1 no hydrogen 3.160 N/A LEU 627.A N PHE 623.A O no hydrogen 3.134 N/A LYS 632.A N ASP 629.A O no hydrogen 3.526 N/A ARG 635.A NE ASP 640.A OD1 no hydrogen 3.333 N/A ARG 635.A NH2 ASP 640.A OD1 no hydrogen 2.969 N/A SER 636.A N GLU 639.A OE1 no hydrogen 3.362 N/A SER 636.A OG GLU 639.A OE1 no hydrogen 3.478 N/A SER 636.A OG GLN 848.A OE1 no hydrogen 3.187 N/A ILE 638.A N GLN 625.A O no hydrogen 3.388 N/A GLU 639.A N SER 636.A OG no hydrogen 3.186 N/A ASP 640.A N SER 636.A O no hydrogen 2.896 N/A LEU 641.A N PHE 637.A O no hydrogen 2.945 N/A LEU 642.A N ILE 638.A O no hydrogen 2.890 N/A PHE 643.A N GLU 639.A O no hydrogen 2.901 N/A ASN 644.A N ASP 640.A O no hydrogen 2.941 N/A LYS 645.A N LEU 642.A O no hydrogen 3.341 N/A LYS 645.A NZ LEU 732.A O no hydrogen 3.396 N/A LYS 645.A NZ THR 735.A O no hydrogen 3.346 N/A THR 647.A N GLN 743.A OE1 no hydrogen 3.381 N/A LYS 648.A NZ VAL 654.A O no hydrogen 3.547 N/A LEU 652.A N PHE 649.A O no hydrogen 3.314 N/A THR 653.A N SER 556.A O no hydrogen 2.948 N/A LEU 655.A N LYS 554.A O no hydrogen 2.616 N/A LEU 658.A N ASP 596.A OD1 no hydrogen 3.268 N/A THR 660.A OG1 GLU 662.A OE1 no hydrogen 3.553 N/A MET 663.A N THR 660.A OG1 no hydrogen 3.378 N/A ILE 664.A N THR 660.A O no hydrogen 2.943 N/A ALA 665.A N ASP 661.A O no hydrogen 2.890 N/A GLN 666.A N GLU 662.A O no hydrogen 2.901 N/A TYR 667.A N MET 663.A O no hydrogen 2.950 N/A THR 668.A N ILE 664.A O no hydrogen 2.936 N/A THR 668.A OG1 ILE 664.A O no hydrogen 3.363 N/A SER 669.A N ALA 665.A O no hydrogen 2.859 N/A SER 669.A OG ALA 665.A O no hydrogen 3.364 N/A SER 669.A OG GLN 666.A O no hydrogen 2.821 N/A ALA 670.A N GLN 666.A O no hydrogen 2.905 N/A LEU 671.A N TYR 667.A O no hydrogen 2.943 N/A LEU 672.A N THR 668.A O no hydrogen 2.911 N/A ALA 673.A N SER 669.A O no hydrogen 2.882 N/A GLY 674.A N ALA 670.A O no hydrogen 2.934 N/A THR 675.A N LEU 671.A O no hydrogen 2.922 N/A THR 675.A OG1 LEU 671.A O no hydrogen 2.821 N/A ILE 676.A N LEU 672.A O no hydrogen 2.908 N/A THR 677.A N ALA 673.A O no hydrogen 2.929 N/A THR 677.A OG1 ALA 673.A O no hydrogen 2.942 N/A SER 678.A N GLY 674.A O no hydrogen 2.898 N/A SER 678.A OG GLY 674.A O no hydrogen 2.433 N/A GLY 679.A N GLY 674.A O no hydrogen 3.409 N/A THR 681.A OG1 LEU 688.A O no hydrogen 3.503 N/A ALA 684.A N TRP 680.A O no hydrogen 2.958 N/A GLY 685.A N THR 681.A O no hydrogen 2.880 N/A LEU 688.A N THR 681.A OG1 no hydrogen 2.706 N/A GLN 689.A N GLN 689.A OE1 no hydrogen 2.833 N/A ILE 690.A N THR 677.A O no hydrogen 3.281 N/A GLN 695.A N PRO 691.A O no hydrogen 2.931 N/A GLN 695.A NE2 THR 675.A O no hydrogen 3.386 N/A GLN 695.A NE2 ILE 676.A O no hydrogen 3.352 N/A MET 696.A N PHE 692.A O no hydrogen 2.901 N/A ALA 697.A N ALA 693.A O no hydrogen 2.923 N/A TYR 698.A N MET 694.A O no hydrogen 2.912 N/A ARG 699.A N GLN 695.A O no hydrogen 2.947 N/A ARG 699.A NH1 LEU 843.A O no hydrogen 3.136 N/A ARG 699.A NH2 GLN 695.A OE1 no hydrogen 3.445 N/A PHE 700.A N MET 696.A O no hydrogen 2.897 N/A ASN 701.A N ALA 697.A O no hydrogen 2.923 N/A GLY 702.A N TYR 698.A O no hydrogen 2.899 N/A ILE 703.A N ARG 699.A O no hydrogen 2.945 N/A GLY 704.A N PHE 700.A O no hydrogen 2.935 N/A GLY 704.A N ASN 701.A O no hydrogen 3.238 N/A VAL 705.A N PHE 700.A O no hydrogen 2.796 N/A THR 706.A OG1 GLN 900.A OE1 no hydrogen 2.840 N/A VAL 709.A N THR 706.A O no hydrogen 3.075 N/A TYR 711.A N GLN 707.A O no hydrogen 2.954 N/A GLU 712.A N ASN 708.A O no hydrogen 2.891 N/A ASN 713.A N VAL 709.A O no hydrogen 2.924 N/A ASN 713.A N LEU 710.A O no hydrogen 3.123 N/A ASN 713.A ND2 VAL 709.A O no hydrogen 2.675 N/A GLN 714.A NE2 GLY 619.A O no hydrogen 3.642 N/A ILE 717.A N ASN 713.A O no hydrogen 3.073 N/A ALA 718.A N GLN 714.A O no hydrogen 3.072 N/A ASN 719.A N LYS 715.A O no hydrogen 2.935 N/A GLN 720.A N LEU 716.A O no hydrogen 2.905 N/A PHE 721.A N ILE 717.A O no hydrogen 2.913 N/A ASN 722.A N ALA 718.A O no hydrogen 2.942 N/A ASN 722.A ND2 GLY 620.A O no hydrogen 3.527 N/A SER 723.A N ASN 719.A O no hydrogen 2.911 N/A SER 723.A OG ASN 719.A O no hydrogen 2.723 N/A ALA 724.A N GLN 720.A O no hydrogen 2.906 N/A ILE 725.A N PHE 721.A O no hydrogen 2.947 N/A GLY 726.A N ASN 722.A O no hydrogen 2.938 N/A LYS 727.A N SER 723.A O no hydrogen 2.890 N/A ILE 728.A N ALA 724.A O no hydrogen 2.910 N/A GLN 729.A N ILE 725.A O no hydrogen 2.962 N/A ASP 730.A N GLY 726.A O no hydrogen 2.921 N/A SER 731.A N LYS 727.A O no hydrogen 2.898 N/A LEU 732.A N ILE 728.A O no hydrogen 2.922 N/A SER 733.A N GLN 729.A O no hydrogen 2.919 N/A SER 734.A N ASP 730.A O no hydrogen 2.910 N/A THR 735.A N SER 731.A O no hydrogen 2.904 N/A GLN 743.A N LEU 739.A O no hydrogen 3.518 N/A GLN 743.A NE2 ASN 747.A OD1 no hydrogen 3.254 N/A ASP 744.A N GLY 740.A O no hydrogen 2.979 N/A VAL 746.A N LEU 742.A O no hydrogen 2.999 N/A ASN 747.A N GLN 743.A O no hydrogen 2.874 N/A GLN 748.A N ASP 744.A O no hydrogen 2.910 N/A ASN 749.A N VAL 745.A O no hydrogen 2.982 N/A ALA 750.A N VAL 746.A O no hydrogen 2.944 N/A GLN 751.A N ASN 747.A O no hydrogen 2.873 N/A ALA 752.A N GLN 748.A O no hydrogen 2.956 N/A LEU 753.A N ASN 749.A O no hydrogen 2.981 N/A ASN 754.A N ALA 750.A O no hydrogen 2.889 N/A THR 755.A N GLN 751.A O no hydrogen 2.922 N/A THR 755.A OG1 GLN 751.A O no hydrogen 2.673 N/A LEU 756.A N ALA 752.A O no hydrogen 2.958 N/A VAL 757.A N LEU 753.A O no hydrogen 2.927 N/A LYS 758.A N ASN 754.A O no hydrogen 2.895 N/A GLN 759.A N THR 755.A O no hydrogen 2.949 N/A GLN 759.A NE2 SER 797.A OG no hydrogen 3.148 N/A LEU 760.A N VAL 757.A O no hydrogen 3.197 N/A SER 761.A N LYS 758.A O no hydrogen 3.237 N/A ALA 766.A N ASN 763.A O no hydrogen 3.063 N/A ILE 767.A N GLN 786.A OE1 no hydrogen 3.021 N/A VAL 770.A N SER 768.A OG no hydrogen 3.423 N/A ILE 774.A N VAL 770.A O no hydrogen 2.942 N/A LEU 775.A N LEU 771.A O no hydrogen 2.900 N/A SER 776.A N ASN 772.A O no hydrogen 2.900 N/A SER 776.A OG ASN 772.A O no hydrogen 3.407 N/A SER 776.A OG ASP 773.A O no hydrogen 3.099 N/A ARG 777.A N ASP 773.A O no hydrogen 2.915 N/A LEU 778.A N ILE 774.A O no hydrogen 2.921 N/A GLU 782.A N ASP 779.A O no hydrogen 3.158 N/A ALA 783.A N ASP 779.A O no hydrogen 2.762 N/A GLU 784.A N PRO 780.A O no hydrogen 2.935 N/A GLN 786.A N GLU 782.A O no hydrogen 3.026 N/A ILE 787.A N ALA 783.A O no hydrogen 2.865 N/A ASP 788.A N GLU 784.A O no hydrogen 2.871 N/A ARG 789.A N VAL 785.A O no hydrogen 2.998 N/A LEU 790.A N GLN 786.A O no hydrogen 3.012 N/A ILE 791.A N ILE 787.A O no hydrogen 2.824 N/A THR 792.A N ASP 788.A O no hydrogen 2.936 N/A THR 792.A OG1 ASP 788.A O no hydrogen 2.991 N/A GLY 793.A N ARG 789.A O no hydrogen 3.033 N/A ARG 794.A N LEU 790.A O no hydrogen 2.938 N/A ARG 794.A NH1 ILE 563.A O no hydrogen 3.119 N/A ARG 794.A NH2 SER 769.A O no hydrogen 3.225 N/A LEU 795.A N ILE 791.A O no hydrogen 2.883 N/A GLN 796.A N THR 792.A O no hydrogen 2.991 N/A SER 797.A N GLY 793.A O no hydrogen 2.985 N/A SER 797.A OG GLY 793.A O no hydrogen 2.856 N/A LEU 798.A N ARG 794.A O no hydrogen 2.935 N/A GLN 799.A N LEU 795.A O no hydrogen 2.942 N/A THR 800.A N GLN 796.A O no hydrogen 2.988 N/A THR 800.A OG1 GLN 796.A O no hydrogen 3.215 N/A TYR 801.A N SER 797.A O no hydrogen 2.969 N/A VAL 802.A N LEU 798.A O no hydrogen 2.908 N/A THR 803.A N GLN 799.A O no hydrogen 2.974 N/A THR 803.A OG1 GLN 799.A O no hydrogen 2.785 N/A GLN 804.A N THR 800.A O no hydrogen 3.014 N/A GLN 805.A N TYR 801.A O no hydrogen 2.919 N/A LEU 806.A N VAL 802.A O no hydrogen 2.893 N/A ILE 807.A N THR 803.A O no hydrogen 3.042 N/A ARG 808.A N GLN 804.A O no hydrogen 2.958 N/A ALA 809.A N GLN 805.A O no hydrogen 2.846 N/A ALA 810.A N LEU 806.A O no hydrogen 2.964 N/A GLU 811.A N ILE 807.A O no hydrogen 3.042 N/A ILE 812.A N ARG 808.A O no hydrogen 2.913 N/A ARG 813.A N ALA 809.A O no hydrogen 2.858 N/A ARG 813.A NH2 GLU 594.A OE1 no hydrogen 3.518 N/A ALA 814.A N ALA 810.A O no hydrogen 2.998 N/A SER 815.A N GLU 811.A O no hydrogen 3.001 N/A SER 815.A OG PRO 549.A O no hydrogen 3.121 N/A ALA 816.A N ILE 812.A O no hydrogen 2.859 N/A ASN 817.A N ARG 813.A O no hydrogen 2.912 N/A LEU 818.A N ALA 814.A O no hydrogen 2.995 N/A ALA 819.A N SER 815.A O no hydrogen 2.918 N/A ALA 820.A N ALA 816.A O no hydrogen 2.890 N/A THR 821.A N ASN 817.A O no hydrogen 2.962 N/A THR 821.A OG1 ASN 817.A O no hydrogen 3.014 N/A LYS 822.A N LEU 818.A O no hydrogen 2.915 N/A LYS 822.A NZ GLU 546.A OE2 no hydrogen 3.385 N/A MET 823.A N ALA 819.A O no hydrogen 2.897 N/A SER 824.A N ALA 820.A O no hydrogen 2.933 N/A SER 824.A OG GLN 605.A OE1 no hydrogen 2.887 N/A SER 824.A OG ALA 820.A O no hydrogen 3.052 N/A GLU 825.A N THR 821.A O no hydrogen 2.932 N/A CYS 826.A N LYS 822.A O no hydrogen 2.870 N/A LEU 828.A N MET 823.A O no hydrogen 3.282 N/A GLN 830.A NE2 ARG 699.A O no hydrogen 2.932 N/A GLN 830.A NE2 HIS 842.A O no hydrogen 3.243 N/A GLN 830.A NE2 LEU 843.A O no hydrogen 3.600 N/A SER 831.A N HIS 842.A ND1 no hydrogen 3.253 N/A ARG 833.A NH1 GLU 825.A OE1 no hydrogen 3.351 N/A TYR 841.A N TYR 861.A O no hydrogen 2.936 N/A TYR 841.A OH ASN 902.A OD1 no hydrogen 3.257 N/A LEU 843.A N VAL 859.A O no hydrogen 2.873 N/A MET 844.A N VAL 859.A O no hydrogen 3.011 N/A SER 845.A OG HIS 842.A NE2 no hydrogen 3.332 N/A SER 845.A OG MET 844.A O no hydrogen 2.881 N/A SER 845.A OG HIS 858.A ND1 no hydrogen 2.562 N/A PHE 846.A N LEU 857.A O no hydrogen 2.906 N/A GLN 848.A N VAL 855.A O no hydrogen 2.870 N/A GLN 848.A NE2 PRO 847.A O no hydrogen 2.439 N/A SER 849.A N GLU 639.A OE2 no hydrogen 3.149 N/A SER 849.A OG GLU 639.A OE2 no hydrogen 2.252 N/A ALA 850.A N GLY 853.A O no hydrogen 2.924 N/A GLY 853.A N ALA 850.A O no hydrogen 2.922 N/A VAL 854.A N LEU 548.A O no hydrogen 3.219 N/A VAL 855.A N GLN 848.A O no hydrogen 2.877 N/A PHE 856.A N GLU 546.A O no hydrogen 2.800 N/A LEU 857.A N PHE 846.A O no hydrogen 2.895 N/A HIS 858.A N THR 544.A O no hydrogen 2.892 N/A HIS 858.A ND1 SER 845.A OG no hydrogen 2.562 N/A HIS 858.A NE2 GLU 546.A OE1 no hydrogen 2.773 N/A VAL 859.A N MET 844.A O no hydrogen 2.861 N/A THR 860.A N SER 542.A O no hydrogen 3.109 N/A THR 860.A OG1 SER 542.A OG no hydrogen 3.018 N/A THR 860.A OG1 LYS 839.A O no hydrogen 2.786 N/A TYR 861.A N TYR 841.A O no hydrogen 2.839 N/A TYR 861.A OH ASN 902.A O no hydrogen 3.346 N/A VAL 862.A N THR 540.A O no hydrogen 3.038 N/A LYS 867.A N ILE 535.A O no hydrogen 2.909 N/A PHE 869.A N ILE 533.A O no hydrogen 2.886 N/A THR 871.A N ASN 531.A O no hydrogen 3.346 N/A THR 871.A OG1 PHE 889.A O no hydrogen 2.703 N/A ILE 875.A N HIS 882.A O no hydrogen 3.120 N/A CYS 876.A N VAL 927.A O no hydrogen 2.652 N/A HIS 882.A N ILE 875.A O no hydrogen 2.982 N/A PHE 883.A N PHE 915.A O no hydrogen 2.942 N/A ARG 885.A N ASN 913.A O no hydrogen 2.795 N/A ARG 885.A NE ASP 912.A O no hydrogen 3.026 N/A ARG 885.A NH2 THR 911.A O no hydrogen 3.543 N/A VAL 888.A N THR 899.A O no hydrogen 2.892 N/A VAL 890.A N PHE 897.A O no hydrogen 2.876 N/A SER 891.A OG HIS 895.A O no hydrogen 3.429 N/A ASN 892.A N HIS 895.A O no hydrogen 3.333 N/A GLY 893.A N SER 891.A OG no hydrogen 3.146 N/A THR 894.A N ASN 892.A OD1 no hydrogen 3.428 N/A THR 894.A OG1 HIS 895.A ND1 no hydrogen 2.707 N/A HIS 895.A N ASN 892.A OD1 no hydrogen 3.046 N/A HIS 895.A ND1 THR 894.A OG1 no hydrogen 2.707 N/A PHE 897.A N VAL 890.A O no hydrogen 2.895 N/A VAL 898.A N GLN 907.A O no hydrogen 3.159 N/A THR 899.A N VAL 888.A O no hydrogen 2.916 N/A TYR 904.A N PRO 536.A O no hydrogen 2.759 N/A THR 910.A N ASN 913.A OD1 no hydrogen 2.882 N/A THR 910.A OG1 ASN 913.A OD1 no hydrogen 3.502 N/A ASN 913.A ND2 ILE 908.A O no hydrogen 3.033 N/A THR 914.A OG1 THR 910.A O no hydrogen 2.353 N/A PHE 915.A N PHE 883.A O no hydrogen 2.927 N/A SER 917.A N ALA 881.A O no hydrogen 3.031 N/A ASN 919.A ND2 ASP 921.A OD2 no hydrogen 3.501 N/A CYS 920.A N GLY 879.A O no hydrogen 3.239 N/A CYS 920.A SG LYS 880.A O no hydrogen 3.574 N/A VAL 927.A N ALA 874.A O no hydrogen 3.448 N/A ASN 929.A N CYS 876.A O no hydrogen 3.109 N/A TYR 932.A N ILE 909.A O no hydrogen 3.187 N/A