Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xm4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N VAL 36.A O no hydrogen 3.162 N/A THR 7.A OG1 THR 7.A O no hydrogen 2.743 N/A THR 7.A OG1 GLY 156.A O no hydrogen 2.983 N/A ARG 8.A NE GLU 128.A OE1 no hydrogen 3.494 N/A ARG 8.A NH2 GLU 128.A OE2 no hydrogen 2.364 N/A TYR 11.A OH LEU 28.A O no hydrogen 2.282 N/A TYR 12.A N LEU 160.A O no hydrogen 3.277 N/A ARG 18.A NH1 ASP 14.A OD1 no hydrogen 2.927 N/A ARG 18.A NH1 ASP 14.A OD2 no hydrogen 3.038 N/A ARG 18.A NH2 ASP 14.A OD2 no hydrogen 3.487 N/A SER 20.A N ASN 204.A O no hydrogen 3.167 N/A HIS 23.A N LEU 201.A O no hydrogen 3.107 N/A THR 25.A N PHE 199.A O no hydrogen 3.259 N/A ASP 27.A N ARG 197.A O no hydrogen 3.231 N/A LEU 28.A N ASP 27.A OD1 no hydrogen 2.723 N/A PHE 29.A N GLN 195.A O no hydrogen 2.791 N/A PHE 32.A N ASP 214.A OD2 no hydrogen 3.267 N/A VAL 36.A N THR 3.A O no hydrogen 2.904 N/A THR 37.A N VAL 191.A O no hydrogen 3.470 N/A PHE 39.A N TYR 189.A O no hydrogen 3.261 N/A LEU 48.A N PHE 175.A O no hydrogen 3.216 N/A PHE 50.A N THR 173.A O no hydrogen 3.139 N/A VAL 54.A N PHE 131.A O no hydrogen 3.299 N/A TYR 55.A OH GLU 128.A OE1 no hydrogen 2.258 N/A PHE 56.A N PHE 129.A O no hydrogen 2.898 N/A ALA 57.A N TYR 190.A O no hydrogen 3.374 N/A SER 58.A N ARG 127.A O no hydrogen 3.011 N/A THR 59.A N ALA 188.A O no hydrogen 3.193 N/A THR 59.A OG1 ASN 125.A O no hydrogen 3.114 N/A ILE 64.A N GLU 60.A OE1 no hydrogen 2.791 N/A ARG 66.A N LEU 178.A O no hydrogen 3.261 N/A TRP 68.A N ILE 83.A O no hydrogen 3.234 N/A ILE 69.A N GLN 176.A O no hydrogen 2.917 N/A PHE 70.A N LEU 81.A O no hydrogen 3.172 N/A GLY 71.A N ARG 174.A O no hydrogen 3.304 N/A SER 76.A OG SER 76.A O no hydrogen 2.473 N/A THR 78.A OG1 THR 72.A OG1 no hydrogen 2.564 N/A SER 80.A OG PHE 70.A O no hydrogen 3.497 N/A LEU 81.A N PHE 70.A O no hydrogen 2.889 N/A LEU 82.A N LYS 93.A O no hydrogen 3.138 N/A ILE 83.A N TRP 68.A O no hydrogen 2.972 N/A VAL 84.A N VAL 91.A O no hydrogen 2.966 N/A ALA 87.A N ASN 85.A OD1 no hydrogen 2.906 N/A ASN 89.A N ASN 86.A OD1 no hydrogen 2.901 N/A VAL 90.A N SER 121.A O no hydrogen 3.145 N/A VAL 91.A N VAL 84.A O no hydrogen 2.989 N/A ILE 92.A N TYR 119.A O no hydrogen 3.083 N/A LYS 93.A N LEU 82.A O no hydrogen 3.211 N/A GLU 96.A N ASN 113.A O no hydrogen 3.260 N/A CYS 100.A SG LEU 186.A O no hydrogen 3.762 N/A LEU 105.A N LEU 179.A O no hydrogen 3.151 N/A VAL 107.A N LEU 181.A O no hydrogen 3.346 N/A TYR 119.A N ILE 92.A O no hydrogen 2.888 N/A SER 121.A N VAL 90.A O no hydrogen 3.383 N/A GLN 122.A N SER 121.A OG no hydrogen 2.546 N/A LEU 126.A N ASN 125.A OD1 no hydrogen 3.250 N/A ARG 127.A N SER 58.A O no hydrogen 3.300 N/A GLU 128.A N LYS 143.A O no hydrogen 2.893 N/A PHE 129.A N PHE 56.A O no hydrogen 2.730 N/A VAL 130.A N TYR 141.A O no hydrogen 3.015 N/A PHE 131.A N VAL 54.A O no hydrogen 3.042 N/A LYS 132.A N LYS 139.A O no hydrogen 2.916 N/A LYS 132.A NZ TYR 11.A OH no hydrogen 3.419 N/A LYS 132.A NZ ASP 27.A OD1 no hydrogen 3.303 N/A TYR 137.A N ILE 134.A O no hydrogen 3.056 N/A PHE 138.A N LEU 166.A O no hydrogen 2.925 N/A LYS 139.A N LYS 132.A O no hydrogen 2.796 N/A LYS 139.A NZ ASP 165.A OD1 no hydrogen 3.330 N/A ILE 140.A N VAL 164.A O no hydrogen 3.329 N/A TYR 141.A N VAL 130.A O no hydrogen 2.906 N/A SER 142.A N GLU 161.A O no hydrogen 2.864 N/A LYS 143.A N GLU 128.A O no hydrogen 3.220 N/A LYS 143.A NZ ALA 159.A O no hydrogen 2.919 N/A THR 145.A N LEU 126.A O no hydrogen 2.931 N/A LEU 160.A N VAL 10.A O no hydrogen 2.753 N/A GLU 161.A N SER 142.A O no hydrogen 2.983 N/A LEU 163.A N ILE 140.A O no hydrogen 2.935 N/A THR 173.A N GLY 71.A O no hydrogen 2.778 N/A ARG 174.A N GLY 71.A O no hydrogen 2.936 N/A ARG 174.A NH1 THR 72.A O no hydrogen 3.208 N/A PHE 175.A N LEU 48.A O no hydrogen 3.038 N/A GLN 176.A N ILE 69.A O no hydrogen 3.377 N/A LEU 178.A N GLY 67.A O no hydrogen 2.842 N/A LEU 181.A N LEU 105.A O no hydrogen 2.969 N/A SER 184.A OG HIS 182.A O no hydrogen 3.111 N/A TYR 185.A N ARG 183.A O no hydrogen 2.705 N/A THR 187.A OG1 ASP 102.A OD1 no hydrogen 3.148 N/A TYR 189.A N PHE 39.A O no hydrogen 3.239 N/A TYR 189.A OH ASN 45.A OD1 no hydrogen 3.063 N/A TYR 190.A N ALA 57.A O no hydrogen 2.966 N/A GLY 192.A N TYR 55.A O no hydrogen 2.922 N/A LEU 194.A N GLY 53.A O no hydrogen 3.412 N/A GLN 195.A N PHE 29.A O no hydrogen 2.676 N/A ARG 197.A N ASP 27.A O no hydrogen 3.058 N/A PHE 199.A N THR 25.A O no hydrogen 2.846 N/A LEU 200.A N VAL 213.A O no hydrogen 3.062 N/A LEU 201.A N HIS 23.A O no hydrogen 3.204 N/A LYS 202.A N ASP 211.A O no hydrogen 3.307 N/A TYR 203.A N VAL 21.A O no hydrogen 3.130 N/A ASN 204.A N THR 208.A O no hydrogen 3.077 N/A GLY 207.A N ASN 204.A O no hydrogen 3.306 N/A THR 208.A N ASN 204.A OD1 no hydrogen 2.905 N/A THR 208.A OG1 ASN 204.A OD1 no hydrogen 2.618 N/A THR 210.A N LYS 202.A O no hydrogen 3.040 N/A ALA 212.A N ASP 211.A OD1 no hydrogen 2.847 N/A VAL 213.A N LEU 200.A O no hydrogen 3.167 N/A CYS 215.A N THR 198.A O no hydrogen 3.458 N/A CYS 215.A SG THR 198.A O no hydrogen 3.221 N/A LEU 217.A N ASP 214.A O no hydrogen 3.200 N/A SER 221.A N ASP 218.A O no hydrogen 3.165 N/A SER 221.A OG ASP 218.A OD1 no hydrogen 2.846 N/A THR 223.A N PRO 219.A O no hydrogen 3.008 N/A THR 223.A OG1 PRO 219.A O no hydrogen 3.202 N/A LYS 224.A N LEU 220.A O no hydrogen 2.978 N/A LYS 224.A NZ PHE 230.A O no hydrogen 3.488 N/A CYS 225.A N SER 221.A O no hydrogen 2.953 N/A CYS 225.A SG SER 221.A O no hydrogen 3.380 N/A THR 226.A N GLU 222.A O no hydrogen 2.973 N/A THR 226.A OG1 GLU 222.A O no hydrogen 2.495 N/A LEU 227.A N THR 223.A O no hydrogen 2.970 N/A THR 231.A N SER 229.A OG no hydrogen 3.411 N/A VAL 232.A N THR 524.A OG1 no hydrogen 3.104 N/A LYS 234.A NZ ASP 585.A OD1 no hydrogen 2.521 N/A LYS 234.A NZ ASP 585.A OD2 no hydrogen 3.297 N/A GLY 235.A N THR 521.A O no hydrogen 3.160 N/A TYR 237.A N VAL 519.A O no hydrogen 3.263 N/A TYR 237.A OH GLU 233.A O no hydrogen 2.475 N/A THR 239.A N VAL 517.A O no hydrogen 3.134 N/A THR 239.A OG1 GLU 222.A OE2 no hydrogen 2.636 N/A THR 239.A OG1 VAL 517.A O no hydrogen 3.509 N/A ASN 241.A ND2 SER 513.A O no hydrogen 3.603 N/A PHE 242.A N GLU 222.A OE1 no hydrogen 3.390 N/A ARG 243.A NH1 PHE 514.A O no hydrogen 2.949 N/A ARG 243.A NH2 PHE 514.A O no hydrogen 3.329 N/A THR 247.A OG1 ASN 462.A OD1 no hydrogen 3.202 N/A ILE 250.A N ASN 462.A O no hydrogen 3.292 N/A ARG 252.A N ASN 464.A O no hydrogen 2.893 N/A ARG 252.A NH2 THR 453.A O no hydrogen 2.331 N/A THR 257.A OG1 ASN 258.A OD1 no hydrogen 2.287 N/A PHE 262.A N CYS 260.A O no hydrogen 2.817 N/A ALA 268.A N GLU 264.A O no hydrogen 3.029 N/A PHE 271.A N THR 269.A O no hydrogen 2.853 N/A ALA 276.A N SER 273.A O no hydrogen 2.983 N/A LYS 280.A N ALA 321.A O no hydrogen 3.185 N/A LYS 280.A NZ GLU 264.A OE2 no hydrogen 3.106 N/A ILE 282.A N VAL 319.A O no hydrogen 3.000 N/A ASN 284.A N THR 445.A OG1 no hydrogen 2.789 N/A VAL 286.A N ASN 258.A O no hydrogen 3.283 N/A ALA 287.A N CYS 447.A O no hydrogen 3.279 N/A SER 290.A N ASP 288.A OD2 no hydrogen 3.209 N/A SER 290.A OG ASP 288.A OD2 no hydrogen 2.622 N/A LEU 292.A N TYR 289.A O no hydrogen 3.260 N/A TYR 293.A OH ASN 312.A OD1 no hydrogen 3.398 N/A SER 299.A N ALA 359.A O no hydrogen 2.595 N/A THR 300.A N ALA 359.A O no hydrogen 3.293 N/A LYS 302.A N VAL 357.A O no hydrogen 3.212 N/A TYR 304.A N GLY 355.A O no hydrogen 2.791 N/A ASN 312.A ND2 ASP 288.A OD2 no hydrogen 3.330 N/A ASP 313.A N LYS 310.A O no hydrogen 3.274 N/A CYS 315.A SG LEU 314.A O no hydrogen 3.225 N/A PHE 316.A N VAL 446.A O no hydrogen 2.985 N/A ASN 318.A N PHE 316.A O no hydrogen 2.600 N/A TYR 320.A N SER 436.A O no hydrogen 3.058 N/A ALA 321.A N LYS 280.A O no hydrogen 3.197 N/A ASP 322.A N VAL 434.A O no hydrogen 3.121 N/A PHE 324.A N VAL 432.A O no hydrogen 3.489 N/A ILE 326.A N TYR 430.A O no hydrogen 2.981 N/A ARG 327.A N TYR 417.A OH no hydrogen 3.464 N/A ARG 327.A NH2 GLU 330.A OE2 no hydrogen 2.774 N/A GLY 328.A N GLN 428.A O no hydrogen 3.385 N/A GLU 330.A N ARG 327.A O no hydrogen 3.311 N/A GLN 333.A N GLU 330.A O no hydrogen 3.255 N/A ILE 334.A N VAL 331.A O no hydrogen 3.490 N/A ALA 343.A N GLN 333.A OE1 no hydrogen 3.211 N/A ASP 344.A N GLY 340.A O no hydrogen 2.499 N/A TYR 345.A N LYS 341.A O no hydrogen 2.932 N/A ASN 346.A N ILE 342.A O no hydrogen 3.322 N/A TYR 347.A N ILE 342.A O no hydrogen 2.933 N/A TYR 347.A OH ASP 322.A OD2 no hydrogen 2.967 N/A ASP 352.A N ASP 352.A OD1 no hydrogen 2.556 N/A CYS 356.A N LEU 435.A O no hydrogen 3.183 N/A VAL 357.A N LYS 302.A O no hydrogen 3.015 N/A ILE 358.A N VAL 433.A O no hydrogen 2.966 N/A ALA 359.A N THR 300.A O no hydrogen 3.137 N/A TRP 360.A N ARG 431.A O no hydrogen 3.267 N/A SER 362.A N PRO 429.A O no hydrogen 2.617 N/A LEU 365.A N ASN 364.A OD1 no hydrogen 2.694 N/A SER 367.A OG PHE 419.A O no hydrogen 3.280 N/A ASN 370.A N PHE 419.A O no hydrogen 3.291 N/A TYR 373.A OH ASP 366.A OD1 no hydrogen 2.296 N/A ARG 379.A NE ASP 389.A OD2 no hydrogen 3.052 N/A ARG 379.A NH1 ASP 389.A OD2 no hydrogen 2.485 N/A ARG 379.A NH2 SER 381.A O no hydrogen 2.410 N/A LEU 383.A N ASP 344.A O no hydrogen 3.289 N/A PHE 386.A N LYS 348.A O no hydrogen 2.933 N/A TYR 395.A N TYR 411.A O no hydrogen 2.837 N/A ALA 397.A N ASN 409.A O no hydrogen 2.851 N/A CYS 410.A SG PHE 408.A O no hydrogen 3.323 N/A TYR 411.A N TYR 395.A O no hydrogen 2.876 N/A GLN 415.A N PRO 413.A O no hydrogen 2.763 N/A TYR 417.A N TYR 373.A O no hydrogen 3.119 N/A GLY 424.A N ASN 423.A OD1 no hydrogen 2.681 N/A TYR 430.A N ILE 326.A O no hydrogen 2.683 N/A ARG 431.A N TRP 360.A O no hydrogen 3.138 N/A ARG 431.A NE SER 362.A OG no hydrogen 2.696 N/A VAL 432.A N PHE 324.A O no hydrogen 3.306 N/A VAL 433.A N ILE 358.A O no hydrogen 2.950 N/A VAL 434.A N ASP 322.A O no hydrogen 2.994 N/A LEU 435.A N CYS 356.A O no hydrogen 3.049 N/A SER 436.A N TYR 320.A O no hydrogen 3.327 N/A PHE 437.A N THR 354.A O no hydrogen 3.330 N/A CYS 447.A N CYS 285.A O no hydrogen 3.217 N/A CYS 447.A SG VAL 446.A O no hydrogen 3.304 N/A LYS 450.A N GLY 448.A O no hydrogen 2.948 N/A LYS 450.A NZ ASP 313.A OD1 no hydrogen 2.533 N/A THR 453.A N VAL 251.A O no hydrogen 2.970 N/A ASN 458.A ND2 GLU 476.A OE1 no hydrogen 3.543 N/A LYS 459.A NZ PRO 246.A O no hydrogen 3.437 N/A LYS 459.A NZ CYS 460.A O no hydrogen 3.249 N/A CYS 460.A SG HIS 547.A NE2 no hydrogen 3.653 N/A VAL 461.A N GLY 472.A O no hydrogen 3.484 N/A ASN 462.A N GLU 248.A O no hydrogen 2.879 N/A PHE 465.A N LEU 468.A O no hydrogen 3.125 N/A LEU 468.A N PHE 465.A O no hydrogen 2.966 N/A THR 469.A OG1 GLY 467.A O no hydrogen 3.203 N/A GLY 472.A N VAL 461.A O no hydrogen 3.345 N/A VAL 473.A N THR 510.A O no hydrogen 3.113 N/A THR 475.A N ASP 508.A O no hydrogen 2.738 N/A SER 477.A N ILE 506.A O no hydrogen 3.338 N/A LYS 479.A N SER 477.A OG no hydrogen 3.228 N/A LEU 482.A N GLN 485.A OE1 no hydrogen 3.219 N/A GLY 488.A N ALA 497.A O no hydrogen 3.088 N/A ARG 489.A NH2 HIS 441.A NE2 no hydrogen 3.139 N/A ASP 490.A N ASP 490.A OD2 no hydrogen 2.497 N/A THR 494.A OG1 ASP 490.A OD1 no hydrogen 3.154 N/A THR 494.A OG1 ASP 490.A OD2 no hydrogen 2.634 N/A ASP 496.A N GLY 488.A O no hydrogen 3.336 N/A VAL 498.A N LEU 507.A O no hydrogen 3.386 N/A ARG 499.A N GLN 486.A O no hydrogen 3.078 N/A ASP 500.A N GLU 505.A O no hydrogen 3.050 N/A GLN 502.A N ASP 500.A OD2 no hydrogen 3.027 N/A GLN 502.A NE2 SER 452.A OG no hydrogen 3.001 N/A THR 503.A N ASP 500.A OD2 no hydrogen 3.109 N/A LEU 504.A N ASP 500.A O no hydrogen 3.230 N/A LEU 507.A N VAL 498.A O no hydrogen 3.196 N/A ASP 508.A N THR 475.A O no hydrogen 2.460 N/A ILE 509.A N ASP 496.A O no hydrogen 2.762 N/A THR 510.A N VAL 473.A O no hydrogen 3.362 N/A THR 510.A OG1 PRO 511.A O no hydrogen 3.553 N/A SER 518.A N LEU 533.A O no hydrogen 3.146 N/A VAL 519.A N TYR 237.A O no hydrogen 3.005 N/A ILE 520.A N ALA 531.A O no hydrogen 2.869 N/A THR 521.A N GLY 235.A O no hydrogen 3.171 N/A THR 521.A OG1 PRO 522.A O no hydrogen 2.442 N/A THR 524.A N VAL 232.A O no hydrogen 2.983 N/A THR 524.A OG1 VAL 232.A O no hydrogen 3.009 N/A THR 526.A N GLY 523.A O no hydrogen 3.207 N/A THR 526.A OG1 ASN 525.A OD1 no hydrogen 2.992 N/A SER 527.A N GLY 523.A O no hydrogen 3.346 N/A GLN 529.A N SER 527.A OG no hydrogen 2.964 N/A GLN 529.A NE2 GLN 600.A O no hydrogen 2.919 N/A ALA 531.A N ILE 520.A O no hydrogen 3.135 N/A VAL 532.A N ILE 573.A O no hydrogen 3.092 N/A LEU 533.A N SER 518.A O no hydrogen 2.954 N/A TYR 534.A N CYS 571.A O no hydrogen 3.063 N/A GLN 535.A N GLY 516.A O no hydrogen 3.221 N/A ASP 536.A N ALA 569.A O no hydrogen 3.049 N/A CYS 539.A N ASN 538.A OD1 no hydrogen 2.737 N/A CYS 539.A SG PHE 565.A O no hydrogen 3.590 N/A CYS 539.A SG GLN 566.A OE1 no hydrogen 3.241 N/A GLU 541.A N ASN 538.A O no hydrogen 3.252 N/A ALA 545.A N GLU 541.A O no hydrogen 2.748 N/A ILE 546.A N VAL 542.A O no hydrogen 3.365 N/A ALA 548.A N PRO 543.A O no hydrogen 2.978 N/A GLN 550.A N HIS 547.A O no hydrogen 3.409 N/A LEU 551.A N ALA 548.A O no hydrogen 3.488 N/A THR 552.A OG1 THR 554.A OG1 no hydrogen 3.036 N/A THR 554.A OG1 THR 552.A OG1 no hydrogen 3.036 N/A TRP 555.A N THR 552.A O no hydrogen 2.976 N/A ARG 556.A N THR 552.A O no hydrogen 3.197 N/A ARG 556.A NE ALA 548.A O no hydrogen 3.384 N/A ARG 556.A NH1 LEU 551.A O no hydrogen 3.375 N/A TYR 558.A N TRP 555.A O no hydrogen 3.010 N/A SER 559.A N ARG 556.A O no hydrogen 3.404 N/A SER 559.A OG ARG 556.A O no hydrogen 2.900 N/A PHE 565.A N LEU 572.A O no hydrogen 2.894 N/A THR 567.A N GLY 570.A O no hydrogen 2.849 N/A THR 567.A OG1 GLY 570.A O no hydrogen 2.943 N/A ALA 569.A N THR 567.A OG1 no hydrogen 2.996 N/A GLY 570.A N THR 567.A OG1 no hydrogen 3.138 N/A CYS 571.A N TYR 534.A O no hydrogen 3.167 N/A LEU 572.A N PHE 565.A O no hydrogen 2.690 N/A ILE 573.A N VAL 532.A O no hydrogen 3.047 N/A GLY 574.A N ASN 563.A O no hydrogen 3.163 N/A GLU 576.A N ILE 602.A O no hydrogen 3.156 N/A VAL 578.A N ALA 604.A O no hydrogen 3.105 N/A SER 581.A OG THR 606.A O no hydrogen 2.707 N/A ILE 586.A N ALA 594.A O no hydrogen 3.076 N/A ILE 588.A N ILE 592.A O no hydrogen 3.093 N/A GLY 589.A N ILE 592.A O no hydrogen 3.436 N/A ILE 592.A N GLY 589.A O no hydrogen 3.301 N/A CYS 593.A N TYR 605.A O no hydrogen 3.037 N/A ALA 594.A N ILE 586.A O no hydrogen 2.944 N/A SER 595.A N ILE 603.A O no hydrogen 3.138 N/A SER 595.A OG ASP 585.A OD2 no hydrogen 2.943 N/A GLN 597.A N SER 601.A O no hydrogen 3.376 N/A THR 598.A OG1 GLN 600.A OE1 no hydrogen 2.856 N/A SER 601.A N GLN 597.A O no hydrogen 3.417 N/A ILE 603.A N SER 595.A O no hydrogen 3.058 N/A ALA 604.A N GLU 576.A O no hydrogen 3.008 N/A TYR 605.A N CYS 593.A O no hydrogen 3.229 N/A TYR 605.A OH GLU 583.A O no hydrogen 2.906 N/A MET 607.A N GLY 591.A O no hydrogen 3.144 N/A SER 608.A N TYR 582.A O no hydrogen 3.090 N/A SER 614.A N ASN 613.A OD1 no hydrogen 2.587 N/A SER 621.A OG PHE 965.A O no hydrogen 3.476 N/A ILE 622.A N PHE 965.A O no hydrogen 3.199 N/A ILE 624.A N LYS 963.A O no hydrogen 3.185 N/A THR 626.A N GLN 961.A O no hydrogen 3.039 N/A THR 626.A OG1 GLN 961.A O no hydrogen 2.240 N/A ASN 627.A N ALA 960.A O no hydrogen 3.067 N/A THR 629.A N VAL 958.A O no hydrogen 2.960 N/A THR 629.A OG1 VAL 958.A O no hydrogen 3.545 N/A SER 631.A N THR 956.A O no hydrogen 3.127 N/A THR 633.A N HIS 954.A O no hydrogen 3.211 N/A GLU 635.A N PHE 952.A O no hydrogen 3.062 N/A LEU 637.A N VAL 950.A O no hydrogen 3.205 N/A VAL 639.A N HIS 948.A O no hydrogen 2.956 N/A SER 640.A N HIS 948.A O no hydrogen 3.505 N/A SER 640.A OG HIS 948.A ND1 no hydrogen 3.195 N/A MET 641.A N GLN 684.A OE1 no hydrogen 3.083 N/A LYS 643.A NZ ASP 685.A OD2 no hydrogen 2.909 N/A LYS 643.A NZ PRO 752.A O no hydrogen 3.418 N/A SER 645.A N THR 749.A O no hydrogen 3.041 N/A ASP 647.A N GLY 747.A O no hydrogen 3.120 N/A TYR 651.A N ASP 647.A O no hydrogen 3.165 N/A TYR 651.A OH LEU 852.A O no hydrogen 2.909 N/A ILE 652.A N CYS 648.A O no hydrogen 2.937 N/A CYS 653.A N THR 649.A O no hydrogen 2.937 N/A SER 656.A N CYS 653.A O no hydrogen 3.249 N/A SER 656.A OG GLU 658.A OE2 no hydrogen 3.361 N/A GLU 658.A N GLU 658.A OE2 no hydrogen 2.704 N/A SER 660.A OG SER 656.A O no hydrogen 3.045 N/A LEU 663.A N CYS 659.A O no hydrogen 2.990 N/A TYR 666.A N LEU 663.A O no hydrogen 3.330 N/A GLN 672.A NE2 SER 668.A O no hydrogen 3.334 N/A ASN 674.A N THR 671.A O no hydrogen 3.274 N/A ASN 674.A ND2 CYS 670.A O no hydrogen 2.721 N/A ARG 675.A N THR 671.A O no hydrogen 2.984 N/A ALA 676.A N GLN 672.A O no hydrogen 3.036 N/A THR 678.A N ASN 674.A O no hydrogen 3.005 N/A THR 678.A OG1 ASN 674.A O no hydrogen 2.600 N/A GLY 679.A N ARG 675.A O no hydrogen 3.068 N/A ILE 680.A N ALA 676.A O no hydrogen 3.098 N/A ALA 681.A N LEU 677.A O no hydrogen 3.001 N/A VAL 682.A N THR 678.A O no hydrogen 3.045 N/A GLU 683.A N GLY 679.A O no hydrogen 3.078 N/A GLN 684.A N ILE 680.A O no hydrogen 3.080 N/A GLN 684.A NE2 ILE 680.A O no hydrogen 3.101 N/A ASP 685.A N VAL 682.A O no hydrogen 3.208 N/A LYS 686.A N VAL 682.A O no hydrogen 3.203 N/A ASN 687.A N GLU 683.A O no hydrogen 2.957 N/A ASN 687.A ND2 VAL 639.A O no hydrogen 3.522 N/A ASN 687.A ND2 GLN 684.A OE1 no hydrogen 3.679 N/A THR 688.A OG1 GLN 684.A O no hydrogen 3.266 N/A GLN 689.A N ASP 685.A O no hydrogen 3.106 N/A GLU 690.A N LYS 686.A O no hydrogen 3.074 N/A VAL 691.A N THR 688.A O no hydrogen 3.302 N/A PHE 692.A N THR 688.A O no hydrogen 3.017 N/A ALA 693.A N GLN 689.A O no hydrogen 3.197 N/A GLN 694.A NE2 GLU 690.A O no hydrogen 3.414 N/A GLN 694.A NE2 ALA 916.A O no hydrogen 3.656 N/A ASN 711.A N ASN 818.A OD1 no hydrogen 3.275 N/A ILE 715.A N PHE 712.A O no hydrogen 3.232 N/A LEU 716.A N PHE 712.A O no hydrogen 3.314 N/A ASP 718.A N ARG 725.A O no hydrogen 3.387 N/A ARG 725.A NE ASP 730.A OD1 no hydrogen 3.082 N/A SER 726.A OG GLN 944.A OE1 no hydrogen 2.873 N/A ILE 728.A N GLN 714.A O no hydrogen 3.442 N/A GLU 729.A N SER 726.A OG no hydrogen 3.355 N/A ASP 730.A N SER 726.A O no hydrogen 3.088 N/A LEU 731.A N PHE 727.A O no hydrogen 2.982 N/A LEU 732.A N ILE 728.A O no hydrogen 2.935 N/A PHE 733.A N GLU 729.A O no hydrogen 2.978 N/A ASN 734.A N LEU 731.A O no hydrogen 3.365 N/A LYS 735.A NZ SER 830.A O no hydrogen 3.191 N/A GLN 743.A N LEU 739.A O no hydrogen 3.428 N/A LYS 744.A N ILE 740.A O no hydrogen 2.892 N/A PHE 745.A N CYS 741.A O no hydrogen 2.941 N/A ASN 746.A N GLN 743.A O no hydrogen 3.491 N/A ASN 746.A ND2 ALA 742.A O no hydrogen 2.467 N/A GLY 747.A N LYS 744.A O no hydrogen 3.523 N/A THR 749.A N SER 645.A O no hydrogen 3.069 N/A LEU 751.A N LYS 643.A O no hydrogen 2.974 N/A GLU 758.A N GLU 758.A OE1 no hydrogen 2.903 N/A ILE 760.A N THR 756.A O no hydrogen 3.309 N/A ALA 761.A N ASP 757.A O no hydrogen 3.016 N/A GLN 762.A N GLU 758.A O no hydrogen 2.978 N/A TYR 763.A N MET 759.A O no hydrogen 2.994 N/A THR 764.A N ILE 760.A O no hydrogen 3.036 N/A THR 764.A OG1 GLU 729.A OE2 no hydrogen 3.462 N/A THR 764.A OG1 ILE 760.A O no hydrogen 3.356 N/A THR 764.A OG1 ALA 761.A O no hydrogen 2.811 N/A SER 765.A N ALA 761.A O no hydrogen 3.001 N/A SER 765.A OG ALA 761.A O no hydrogen 3.517 N/A SER 765.A OG GLN 762.A O no hydrogen 3.029 N/A ALA 766.A N GLN 762.A O no hydrogen 3.001 N/A LEU 767.A N TYR 763.A O no hydrogen 3.078 N/A LEU 768.A N THR 764.A O no hydrogen 3.005 N/A ALA 769.A N SER 765.A O no hydrogen 2.983 N/A GLY 770.A N ALA 766.A O no hydrogen 3.023 N/A THR 771.A N LEU 767.A O no hydrogen 3.062 N/A THR 771.A OG1 LEU 767.A O no hydrogen 2.732 N/A ILE 772.A N LEU 768.A O no hydrogen 3.013 N/A THR 773.A N ALA 769.A O no hydrogen 3.011 N/A THR 773.A OG1 ALA 769.A O no hydrogen 2.427 N/A SER 774.A N GLY 770.A O no hydrogen 2.966 N/A GLY 775.A N THR 771.A O no hydrogen 3.243 N/A THR 777.A OG1 SER 774.A O no hydrogen 3.264 N/A THR 777.A OG1 LEU 784.A O no hydrogen 3.431 N/A ALA 780.A N THR 777.A O no hydrogen 3.226 N/A LEU 784.A N THR 777.A OG1 no hydrogen 3.154 N/A GLN 785.A N GLN 785.A OE1 no hydrogen 3.236 N/A GLN 791.A N PRO 787.A O no hydrogen 3.068 N/A MET 792.A N PHE 788.A O no hydrogen 2.952 N/A ALA 793.A N ALA 789.A O no hydrogen 3.009 N/A ARG 795.A N GLN 791.A O no hydrogen 3.045 N/A ARG 795.A NH1 LEU 939.A O no hydrogen 2.802 N/A PHE 796.A N MET 792.A O no hydrogen 2.963 N/A ASN 797.A N ALA 793.A O no hydrogen 3.044 N/A GLY 798.A N ARG 795.A O no hydrogen 3.294 N/A ILE 799.A N PHE 796.A O no hydrogen 3.433 N/A VAL 801.A N PHE 796.A O no hydrogen 3.159 N/A THR 802.A N GLN 996.A OE1 no hydrogen 3.388 N/A THR 802.A OG1 ASN 804.A OD1 no hydrogen 2.897 N/A THR 802.A OG1 GLN 996.A OE1 no hydrogen 3.549 N/A ASN 804.A ND2 GLU 1001.A OE1 no hydrogen 3.562 N/A VAL 805.A N THR 802.A O no hydrogen 3.289 N/A GLU 808.A N ASN 804.A O no hydrogen 2.984 N/A ASN 809.A N LEU 806.A O no hydrogen 3.135 N/A ASN 809.A ND2 VAL 805.A O no hydrogen 2.719 N/A GLN 810.A NE2 GLY 708.A O no hydrogen 3.622 N/A ILE 813.A N ASN 809.A O no hydrogen 3.209 N/A ALA 814.A N GLN 810.A O no hydrogen 3.011 N/A ASN 815.A N LYS 811.A O no hydrogen 2.982 N/A GLN 816.A N LEU 812.A O no hydrogen 2.960 N/A PHE 817.A N ILE 813.A O no hydrogen 3.047 N/A ASN 818.A N ALA 814.A O no hydrogen 3.034 N/A ASN 818.A ND2 GLY 709.A O no hydrogen 3.399 N/A SER 819.A N ASN 815.A O no hydrogen 2.982 N/A SER 819.A OG ASN 815.A O no hydrogen 3.032 N/A ALA 820.A N GLN 816.A O no hydrogen 3.047 N/A ILE 821.A N PHE 817.A O no hydrogen 3.016 N/A GLY 822.A N ASN 818.A O no hydrogen 2.970 N/A LYS 823.A N SER 819.A O no hydrogen 2.968 N/A LYS 823.A N ALA 820.A O no hydrogen 3.214 N/A ILE 824.A N ALA 820.A O no hydrogen 3.113 N/A SER 827.A N LYS 823.A O no hydrogen 3.054 N/A SER 827.A OG ILE 824.A O no hydrogen 3.211 N/A LEU 828.A N ILE 824.A O no hydrogen 3.026 N/A LEU 828.A N GLN 825.A O no hydrogen 3.295 N/A SER 829.A N GLN 825.A O no hydrogen 2.883 N/A SER 829.A OG GLN 825.A O no hydrogen 3.302 N/A ALA 832.A N SER 830.A OG no hydrogen 3.354 N/A GLN 839.A N LEU 835.A O no hydrogen 3.276 N/A GLN 839.A NE2 ASN 843.A OD1 no hydrogen 3.046 N/A ASP 840.A N GLY 836.A O no hydrogen 2.965 N/A ASN 843.A N GLN 839.A O no hydrogen 3.006 N/A GLN 844.A N ASP 840.A O no hydrogen 2.971 N/A ASN 845.A N VAL 841.A O no hydrogen 3.097 N/A ALA 846.A N VAL 842.A O no hydrogen 3.067 N/A GLN 847.A N ASN 843.A O no hydrogen 2.997 N/A ALA 848.A N GLN 844.A O no hydrogen 3.073 N/A LEU 849.A N ASN 845.A O no hydrogen 3.129 N/A ASN 850.A N ALA 846.A O no hydrogen 3.015 N/A THR 851.A N GLN 847.A O no hydrogen 2.997 N/A THR 851.A OG1 GLN 847.A O no hydrogen 3.444 N/A LEU 852.A N ALA 848.A O no hydrogen 3.075 N/A VAL 853.A N LEU 849.A O no hydrogen 3.053 N/A LYS 854.A N ASN 850.A O no hydrogen 2.992 N/A GLN 855.A N THR 851.A O no hydrogen 3.059 N/A GLN 855.A NE2 SER 893.A OG no hydrogen 3.167 N/A LEU 856.A N VAL 853.A O no hydrogen 3.253 N/A SER 857.A N LYS 854.A O no hydrogen 3.473 N/A SER 857.A OG LYS 854.A O no hydrogen 3.139 N/A ALA 862.A N ASN 859.A O no hydrogen 3.034 N/A SER 864.A OG VAL 866.A O no hydrogen 3.488 N/A SER 865.A OG SER 857.A O no hydrogen 3.565 N/A ASP 869.A N VAL 866.A O no hydrogen 3.419 N/A SER 872.A OG ASN 868.A O no hydrogen 3.409 N/A ARG 873.A N ILE 870.A O no hydrogen 3.513 N/A GLU 878.A N ASP 875.A O no hydrogen 2.769 N/A ALA 879.A N ASP 875.A O no hydrogen 3.089 N/A GLN 882.A N ALA 879.A O no hydrogen 3.252 N/A ILE 883.A N ALA 879.A O no hydrogen 3.026 N/A ASP 884.A N GLU 880.A O no hydrogen 2.993 N/A ARG 885.A NH1 GLY 861.A O no hydrogen 3.150 N/A LEU 886.A N GLN 882.A O no hydrogen 3.129 N/A ILE 887.A N ILE 883.A O no hydrogen 2.904 N/A THR 888.A N ASP 884.A O no hydrogen 3.003 N/A THR 888.A OG1 ASP 884.A O no hydrogen 2.889 N/A GLY 889.A N ARG 885.A O no hydrogen 3.121 N/A ARG 890.A N LEU 886.A O no hydrogen 3.029 N/A ARG 890.A NH1 ILE 652.A O no hydrogen 3.035 N/A LEU 891.A N ILE 887.A O no hydrogen 2.962 N/A GLN 892.A N THR 888.A O no hydrogen 3.130 N/A SER 893.A N GLY 889.A O no hydrogen 3.076 N/A SER 893.A OG GLY 889.A O no hydrogen 3.227 N/A LEU 894.A N ARG 890.A O no hydrogen 3.075 N/A GLN 895.A N LEU 891.A O no hydrogen 2.985 N/A THR 896.A N GLN 892.A O no hydrogen 3.048 N/A THR 896.A OG1 GLN 892.A O no hydrogen 2.989 N/A TYR 897.A N SER 893.A O no hydrogen 3.129 N/A VAL 898.A N LEU 894.A O no hydrogen 3.067 N/A THR 899.A N GLN 895.A O no hydrogen 3.060 N/A THR 899.A OG1 GLN 895.A O no hydrogen 2.704 N/A GLN 900.A N THR 896.A O no hydrogen 3.171 N/A GLN 901.A N TYR 897.A O no hydrogen 3.047 N/A LEU 902.A N VAL 898.A O no hydrogen 3.034 N/A ILE 903.A N THR 899.A O no hydrogen 3.133 N/A ARG 904.A N GLN 900.A O no hydrogen 3.005 N/A ALA 905.A N GLN 901.A O no hydrogen 2.980 N/A ALA 906.A N LEU 902.A O no hydrogen 3.140 N/A ILE 908.A N ARG 904.A O no hydrogen 3.091 N/A ARG 909.A N ALA 905.A O no hydrogen 2.971 N/A ARG 909.A NH1 ASN 687.A OD1 no hydrogen 2.746 N/A ALA 910.A N ALA 906.A O no hydrogen 3.075 N/A SER 911.A N GLU 907.A O no hydrogen 3.051 N/A SER 911.A OG PRO 638.A O no hydrogen 2.866 N/A ALA 912.A N ILE 908.A O no hydrogen 2.996 N/A ASN 913.A N ARG 909.A O no hydrogen 3.060 N/A ALA 915.A N SER 911.A O no hydrogen 3.063 N/A ALA 916.A N ALA 912.A O no hydrogen 3.010 N/A THR 917.A N ASN 913.A O no hydrogen 3.046 N/A THR 917.A OG1 ASN 913.A O no hydrogen 2.944 N/A LYS 918.A N LEU 914.A O no hydrogen 2.957 N/A LYS 918.A NZ PHE 932.A O no hydrogen 2.704 N/A MET 919.A N ALA 915.A O no hydrogen 2.982 N/A SER 920.A N ALA 916.A O no hydrogen 3.075 N/A SER 920.A OG GLN 694.A OE1 no hydrogen 2.926 N/A GLU 921.A N THR 917.A O no hydrogen 2.924 N/A CYS 922.A N LYS 918.A O no hydrogen 2.939 N/A GLN 926.A NE2 ARG 795.A O no hydrogen 3.055 N/A GLN 926.A NE2 HIS 938.A O no hydrogen 2.973 N/A SER 927.A N HIS 938.A ND1 no hydrogen 3.291 N/A LYS 928.A NZ GLY 798.A O no hydrogen 3.060 N/A ARG 929.A NH1 GLU 921.A OE1 no hydrogen 3.175 N/A TYR 937.A N TYR 957.A O no hydrogen 3.177 N/A LEU 939.A N VAL 955.A O no hydrogen 2.914 N/A MET 940.A N VAL 955.A O no hydrogen 3.412 N/A SER 941.A OG HIS 954.A ND1 no hydrogen 2.543 N/A PHE 942.A N LEU 953.A O no hydrogen 3.109 N/A GLN 944.A N VAL 951.A O no hydrogen 2.972 N/A GLN 944.A NE2 ILE 715.A O no hydrogen 3.524 N/A GLN 944.A NE2 PRO 943.A O no hydrogen 2.690 N/A SER 945.A N GLU 729.A OE2 no hydrogen 3.218 N/A ALA 946.A N GLY 949.A O no hydrogen 3.440 N/A HIS 948.A ND1 SER 640.A OG no hydrogen 3.195 N/A GLY 949.A N ALA 946.A O no hydrogen 3.461 N/A VAL 950.A N LEU 637.A O no hydrogen 3.113 N/A VAL 951.A N GLN 944.A O no hydrogen 3.105 N/A PHE 952.A N GLU 635.A O no hydrogen 2.943 N/A LEU 953.A N PHE 942.A O no hydrogen 3.012 N/A HIS 954.A N THR 633.A O no hydrogen 3.157 N/A HIS 954.A ND1 SER 941.A OG no hydrogen 2.543 N/A HIS 954.A NE2 GLU 635.A OE1 no hydrogen 3.239 N/A VAL 955.A N MET 940.A O no hydrogen 2.788 N/A THR 956.A N SER 631.A O no hydrogen 2.934 N/A THR 956.A OG1 LYS 935.A O no hydrogen 3.210 N/A TYR 957.A N TYR 937.A O no hydrogen 2.865 N/A VAL 958.A N THR 629.A O no hydrogen 3.339 N/A ALA 960.A N ASN 627.A O no hydrogen 3.230 N/A GLU 962.A N GLU 962.A OE1 no hydrogen 2.897 N/A LYS 963.A N ILE 624.A O no hydrogen 3.050 N/A PHE 965.A N ILE 622.A O no hydrogen 3.021 N/A THR 967.A N ASN 620.A O no hydrogen 3.128 N/A THR 967.A OG1 PHE 985.A O no hydrogen 2.686 N/A ILE 971.A N HIS 978.A O no hydrogen 3.048 N/A CYS 972.A N VAL 1023.A O no hydrogen 2.956 N/A HIS 973.A N LYS 976.A O no hydrogen 3.264 N/A ALA 977.A N GLY 1014.A O no hydrogen 3.229 N/A HIS 978.A N ILE 971.A O no hydrogen 2.804 N/A PHE 979.A N PHE 1011.A O no hydrogen 2.996 N/A ARG 981.A N ASN 1009.A O no hydrogen 3.033 N/A ARG 981.A NH1 ASP 1008.A O no hydrogen 3.223 N/A VAL 984.A N THR 995.A O no hydrogen 3.007 N/A VAL 986.A N PHE 993.A O no hydrogen 3.000 N/A SER 987.A N THR 966.A O no hydrogen 2.883 N/A SER 987.A OG HIS 991.A O no hydrogen 3.505 N/A ASN 988.A N HIS 991.A O no hydrogen 3.235 N/A GLY 989.A N SER 987.A OG no hydrogen 3.281 N/A THR 990.A N ASN 988.A OD1 no hydrogen 3.341 N/A HIS 991.A N ASN 988.A OD1 no hydrogen 2.955 N/A PHE 993.A N VAL 986.A O no hydrogen 2.960 N/A VAL 994.A N GLN 1003.A O no hydrogen 3.177 N/A THR 995.A N VAL 984.A O no hydrogen 3.062 N/A THR 995.A OG1 GLN 996.A O no hydrogen 3.033 N/A GLN 996.A NE2 PHE 999.A O no hydrogen 3.694 N/A TYR 1000.A N PRO 625.A O no hydrogen 2.975 N/A GLU 1001.A N THR 995.A OG1 no hydrogen 3.246 N/A GLN 1003.A N VAL 994.A O no hydrogen 2.859 N/A THR 1006.A N ASN 1009.A OD1 no hydrogen 3.081 N/A THR 1006.A OG1 ILE 1004.A O no hydrogen 2.954 N/A THR 1007.A N TYR 1028.A O no hydrogen 2.984 N/A THR 1007.A OG1 TYR 1028.A O no hydrogen 2.754 N/A ASN 1009.A ND2 ILE 1004.A O no hydrogen 3.369 N/A THR 1010.A OG1 THR 1006.A O no hydrogen 2.729 N/A PHE 1011.A N PHE 979.A O no hydrogen 2.984 N/A SER 1013.A N ALA 977.A O no hydrogen 3.265 N/A ASN 1025.A N CYS 972.A O no hydrogen 3.472 N/A ASN 1025.A ND2 THR 1026.A O no hydrogen 3.533 N/A TYR 1028.A N ILE 1005.A O no hydrogen 3.159 N/A