Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8cku_Aa.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 8.A N GLN 8.A OE1 no hydrogen 2.578 N/A ARG 10.A NH1 ARG 10.A O no hydrogen 3.040 N/A SER 11.A N ASP 7.A O no hydrogen 2.912 N/A SER 11.A OG GLN 8.A O no hydrogen 2.246 N/A LEU 12.A N GLN 8.A O no hydrogen 3.254 N/A MET 13.A N MET 9.A O no hydrogen 2.866 N/A ASP 14.A N ARG 10.A O no hydrogen 2.871 N/A ASP 14.A N SER 11.A O no hydrogen 3.313 N/A THR 17.A OG1 LYS 92.A O no hydrogen 2.747 N/A ASN 18.A ND2 ASP 94.A O no hydrogen 2.993 N/A ARG 20.A N LEU 99.A O no hydrogen 3.042 N/A ASN 21.A ND2 GLY 451.A O no hydrogen 3.631 N/A MET 22.A N ASN 101.A O no hydrogen 2.950 N/A SER 23.A N GLY 124.A O no hydrogen 3.119 N/A SER 23.A OG ILE 103.A O no hydrogen 3.527 N/A VAL 24.A N ILE 103.A O no hydrogen 3.342 N/A ILE 25.A N LEU 126.A O no hydrogen 2.697 N/A HIS 30.A N HIS 27.A O no hydrogen 3.426 N/A THR 34.A OG1 GLY 31.A O no hydrogen 2.768 N/A THR 36.A N LYS 32.A O no hydrogen 3.294 N/A THR 36.A OG1 LYS 32.A O no hydrogen 3.308 N/A THR 36.A OG1 SER 33.A O no hydrogen 2.978 N/A ASP 37.A N THR 34.A O no hydrogen 3.010 N/A SER 38.A N LEU 35.A O no hydrogen 3.080 N/A SER 38.A OG LEU 35.A O no hydrogen 2.222 N/A LEU 39.A N THR 36.A O no hydrogen 3.045 N/A VAL 40.A N THR 36.A O no hydrogen 3.100 N/A GLN 41.A N ASP 37.A O no hydrogen 2.690 N/A GLN 41.A NE2 ILE 46.A O no hydrogen 3.205 N/A ARG 42.A NH1 ASP 332.A OD1 no hydrogen 2.492 N/A ALA 43.A N VAL 40.A O no hydrogen 2.948 N/A GLY 44.A N GLN 41.A O no hydrogen 3.005 N/A ILE 45.A N VAL 40.A O no hydrogen 3.506 N/A ARG 55.A NH2 GLN 64.A O no hydrogen 3.495 N/A THR 57.A OG1 THR 73.A OG1 no hydrogen 2.468 N/A THR 57.A OG1 ASP 104.A OD2 no hydrogen 3.371 N/A ASP 58.A N ARG 55.A O no hydrogen 2.988 N/A ARG 60.A NH2 ASP 544.A OD1 no hydrogen 3.258 N/A GLN 64.A N LYS 61.A O no hydrogen 3.005 N/A GLU 65.A N LYS 61.A O no hydrogen 2.893 N/A ARG 66.A N ASP 62.A O no hydrogen 3.266 N/A THR 69.A OG1 ASP 58.A OD1 no hydrogen 2.487 N/A THR 69.A OG1 ASP 58.A OD2 no hydrogen 3.172 N/A ILE 70.A N GLU 63.A OE2 no hydrogen 3.054 N/A LYS 71.A N GLU 63.A OE2 no hydrogen 3.287 N/A SER 72.A OG ASP 104.A O no hydrogen 3.287 N/A SER 72.A OG GLU 114.A OE2 no hydrogen 2.624 N/A THR 73.A OG1 THR 57.A O no hydrogen 2.356 N/A THR 73.A OG1 THR 57.A OG1 no hydrogen 2.468 N/A ILE 75.A N LEU 102.A O no hydrogen 2.686 N/A LEU 77.A N ILE 100.A O no hydrogen 2.752 N/A SER 79.A N PHE 98.A O no hydrogen 2.898 N/A SER 82.A OG ASP 85.A OD1 no hydrogen 2.979 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.753 N/A ASP 85.A N SER 82.A OG no hydrogen 3.394 N/A VAL 86.A N SER 82.A O no hydrogen 3.058 N/A LYS 87.A N ASP 83.A O no hydrogen 3.390 N/A ILE 89.A N LYS 87.A O no hydrogen 2.717 N/A GLN 91.A NE2 LEU 340.A O no hydrogen 2.594 N/A SER 97.A OG SER 79.A O no hydrogen 2.628 N/A PHE 98.A N SER 79.A O no hydrogen 2.711 N/A LEU 99.A N ASN 18.A O no hydrogen 2.774 N/A ILE 100.A N LEU 77.A O no hydrogen 3.104 N/A ASN 101.A N ARG 20.A O no hydrogen 2.690 N/A LEU 102.A N ILE 75.A O no hydrogen 2.611 N/A ILE 103.A N MET 22.A O no hydrogen 2.964 N/A ASP 104.A N THR 73.A O no hydrogen 3.416 N/A SER 105.A OG PRO 106.A O no hydrogen 3.397 N/A ASP 110.A N ASP 110.A OD1 no hydrogen 2.562 N/A PHE 111.A N HIS 108.A O no hydrogen 3.250 N/A SER 112.A N VAL 109.A O no hydrogen 3.143 N/A SER 112.A OG VAL 109.A O no hydrogen 3.052 N/A GLU 114.A N PHE 111.A O no hydrogen 3.280 N/A VAL 115.A N PHE 111.A O no hydrogen 3.297 N/A THR 116.A N SER 112.A O no hydrogen 3.126 N/A ALA 118.A N GLU 114.A O no hydrogen 2.835 N/A LEU 119.A N VAL 115.A O no hydrogen 2.884 N/A ARG 120.A N THR 116.A O no hydrogen 2.785 N/A VAL 121.A N ALA 117.A O no hydrogen 3.017 N/A THR 122.A N LEU 119.A O no hydrogen 3.069 N/A THR 122.A OG1 ALA 118.A O no hydrogen 2.330 N/A THR 122.A OG1 LEU 119.A O no hydrogen 3.117 N/A ASP 123.A N ASN 21.A O no hydrogen 2.785 N/A LEU 126.A N SER 23.A O no hydrogen 3.077 N/A VAL 127.A N VAL 154.A O no hydrogen 2.629 N/A VAL 128.A N ILE 25.A O no hydrogen 3.258 N/A VAL 129.A N VAL 156.A O no hydrogen 3.009 N/A THR 131.A N ASN 158.A O no hydrogen 3.049 N/A THR 131.A OG1 LYS 159.A O no hydrogen 3.323 N/A GLY 134.A N ASP 130.A O no hydrogen 2.973 N/A GLN 138.A NE2 GLY 789.A O no hydrogen 2.318 N/A THR 141.A OG1 VAL 137.A O no hydrogen 3.412 N/A THR 141.A OG1 GLN 138.A OE1 no hydrogen 2.895 N/A VAL 142.A N GLN 138.A O no hydrogen 3.020 N/A ARG 144.A N GLU 140.A O no hydrogen 3.046 N/A ALA 146.A N VAL 142.A O no hydrogen 3.125 N/A LEU 147.A N LEU 143.A O no hydrogen 2.579 N/A GLY 148.A N ARG 144.A O no hydrogen 3.037 N/A GLU 149.A N GLN 145.A O no hydrogen 3.501 N/A ARG 150.A N LEU 147.A O no hydrogen 2.946 N/A ARG 150.A NH1 TYR 351.A O no hydrogen 2.303 N/A ILE 151.A N ALA 146.A O no hydrogen 3.399 N/A LYS 152.A NZ ASP 199.A OD1 no hydrogen 2.916 N/A VAL 154.A N ALA 125.A O no hydrogen 2.999 N/A VAL 156.A N VAL 127.A O no hydrogen 2.714 N/A ILE 157.A N ALA 210.A O no hydrogen 2.841 N/A ASN 158.A N VAL 129.A O no hydrogen 2.493 N/A ASN 158.A ND2 HIS 30.A O no hydrogen 3.106 N/A LYS 159.A N ASN 158.A OD1 no hydrogen 2.386 N/A LYS 159.A NZ ASP 29.A O no hydrogen 2.266 N/A LYS 159.A NZ ASP 130.A OD2 no hydrogen 2.638 N/A ASP 161.A N SER 213.A OG no hydrogen 3.015 N/A ALA 163.A N LYS 159.A O no hydrogen 3.397 N/A LEU 164.A N VAL 160.A O no hydrogen 2.544 N/A LEU 165.A N ASP 161.A O no hydrogen 2.573 N/A GLU 166.A N ARG 162.A O no hydrogen 3.328 N/A LEU 167.A N ALA 163.A O no hydrogen 3.172 N/A GLN 168.A NE2 LEU 165.A O no hydrogen 2.436 N/A LYS 171.A N SER 170.A OG no hydrogen 2.818 N/A LYS 171.A NZ ASP 279.A OD1 no hydrogen 3.445 N/A GLN 176.A N GLU 172.A O no hydrogen 2.600 N/A GLN 176.A NE2 GLU 172.A OE2 no hydrogen 3.508 N/A THR 177.A N ASP 173.A O no hydrogen 2.866 N/A THR 177.A OG1 ASP 173.A O no hydrogen 2.209 N/A PHE 178.A N LEU 174.A O no hydrogen 2.609 N/A ALA 179.A N TYR 175.A O no hydrogen 3.051 N/A ARG 180.A N GLN 176.A O no hydrogen 2.949 N/A ARG 180.A NH1 GLN 176.A OE1 no hydrogen 2.490 N/A THR 181.A N THR 177.A O no hydrogen 2.860 N/A THR 181.A OG1 THR 177.A O no hydrogen 3.074 N/A THR 181.A OG1 PHE 178.A O no hydrogen 2.531 N/A VAL 182.A N PHE 178.A O no hydrogen 2.904 N/A GLU 183.A N ALA 179.A O no hydrogen 3.026 N/A SER 184.A N ARG 180.A O no hydrogen 2.967 N/A SER 184.A OG ARG 180.A O no hydrogen 2.271 N/A VAL 185.A N THR 181.A O no hydrogen 3.124 N/A ASN 186.A N VAL 182.A O no hydrogen 2.740 N/A ASN 186.A ND2 VAL 202.A O no hydrogen 2.761 N/A VAL 187.A N GLU 183.A O no hydrogen 2.578 N/A ILE 188.A N SER 184.A O no hydrogen 3.079 N/A VAL 189.A N VAL 185.A O no hydrogen 2.654 N/A SER 190.A N ASN 186.A O no hydrogen 3.134 N/A SER 190.A OG ASN 186.A O no hydrogen 3.190 N/A SER 190.A OG VAL 187.A O no hydrogen 2.723 N/A THR 191.A N VAL 187.A O no hydrogen 3.345 N/A TYR 192.A N ILE 188.A O no hydrogen 3.093 N/A GLU 195.A N ASP 194.A OD1 no hydrogen 3.033 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.914 N/A VAL 196.A N ASP 194.A O no hydrogen 2.607 N/A GLN 201.A NE2 ASN 186.A O no hydrogen 2.678 N/A VAL 202.A N ASN 186.A OD1 no hydrogen 2.504 N/A TYR 203.A N THR 208.A OG1 no hydrogen 2.715 N/A GLY 207.A N PRO 204.A O no hydrogen 2.900 N/A THR 208.A N TYR 203.A O no hydrogen 3.159 N/A THR 208.A OG1 TYR 203.A O no hydrogen 2.270 N/A PHE 211.A N PHE 220.A O no hydrogen 2.207 N/A GLY 212.A N ILE 157.A O no hydrogen 3.140 N/A GLY 214.A N ASN 158.A OD1 no hydrogen 3.078 N/A GLY 217.A N GLY 214.A O no hydrogen 2.798 N/A TRP 218.A N SER 213.A O no hydrogen 2.502 N/A PHE 220.A N PHE 211.A O no hydrogen 2.314 N/A THR 221.A N GLN 224.A OE1 no hydrogen 3.025 N/A THR 221.A OG1 VAL 209.A O no hydrogen 2.437 N/A ARG 223.A NH1 ALA 205.A O no hydrogen 2.470 N/A ARG 223.A NH2 ALA 205.A O no hydrogen 3.063 N/A GLN 224.A N THR 221.A O no hydrogen 3.357 N/A GLN 224.A NE2 GLU 336.A OE1 no hydrogen 2.780 N/A ALA 226.A N ILE 222.A O no hydrogen 3.320 N/A THR 227.A N ARG 223.A O no hydrogen 2.748 N/A THR 227.A OG1 ARG 223.A O no hydrogen 3.556 N/A ARG 228.A N GLN 224.A O no hydrogen 2.486 N/A TYR 229.A N PHE 225.A O no hydrogen 2.279 N/A LYS 231.A N THR 227.A O no hydrogen 3.320 N/A PHE 233.A N TYR 229.A O no hydrogen 3.056 N/A GLY 234.A N ALA 230.A O no hydrogen 2.949 N/A LYS 239.A N ASP 236.A OD2 no hydrogen 3.348 N/A ARG 243.A N MET 240.A O no hydrogen 3.023 N/A LEU 244.A N MET 240.A O no hydrogen 3.170 N/A SER 248.A N GLY 246.A O no hydrogen 2.771 N/A SER 248.A OG ASP 247.A O no hydrogen 2.904 N/A PHE 249.A N THR 258.A O no hydrogen 2.236 N/A ASN 251.A ND2 THR 258.A OG1 no hydrogen 2.923 N/A THR 258.A N LYS 256.A O no hydrogen 2.922 N/A THR 258.A OG1 LYS 256.A O no hydrogen 3.473 N/A LYS 260.A NZ ASP 247.A OD2 no hydrogen 3.247 N/A LYS 267.A NZ LYS 267.A O no hydrogen 3.054 N/A ARG 271.A NE GLU 172.A OE1 no hydrogen 3.163 N/A ARG 271.A NH1 ASP 247.A OD1 no hydrogen 3.088 N/A ALA 272.A N SER 248.A O no hydrogen 3.405 N/A ASN 274.A ND2 LYS 171.A O no hydrogen 2.892 N/A MET 275.A N ARG 271.A O no hydrogen 3.075 N/A PHE 276.A N ALA 272.A O no hydrogen 2.773 N/A ILE 277.A N PHE 273.A O no hydrogen 3.008 N/A LEU 278.A N PHE 273.A O no hydrogen 3.028 N/A PHE 282.A N LEU 278.A O no hydrogen 2.840 N/A ARG 283.A N ASP 279.A O no hydrogen 3.047 N/A LEU 284.A N PRO 280.A O no hydrogen 2.990 N/A PHE 285.A N ILE 281.A O no hydrogen 3.213 N/A THR 286.A N PHE 282.A O no hydrogen 2.705 N/A THR 286.A OG1 PHE 282.A O no hydrogen 2.911 N/A THR 286.A OG1 ARG 283.A O no hydrogen 2.926 N/A ALA 287.A N ARG 283.A O no hydrogen 2.985 N/A ILE 288.A N LEU 284.A O no hydrogen 2.660 N/A MET 289.A N PHE 285.A O no hydrogen 2.693 N/A PHE 291.A N ILE 288.A O no hydrogen 3.092 N/A LYS 292.A N ASN 290.A OD1 no hydrogen 3.174 N/A LYS 293.A NZ GLU 315.A OE1 no hydrogen 3.258 N/A ASP 294.A N ASP 294.A OD1 no hydrogen 2.428 N/A GLU 295.A N LYS 292.A O no hydrogen 2.944 N/A ILE 296.A N LYS 292.A O no hydrogen 3.208 N/A LEU 300.A N ILE 296.A O no hydrogen 3.259 N/A GLU 301.A N PRO 297.A O no hydrogen 3.401 N/A LYS 302.A N VAL 298.A O no hydrogen 3.446 N/A LEU 303.A N LEU 300.A O no hydrogen 2.881 N/A GLU 304.A N GLU 301.A O no hydrogen 3.269 N/A ILE 305.A N LEU 300.A O no hydrogen 3.018 N/A ASP 310.A N LYS 308.A O no hydrogen 3.086 N/A GLU 311.A N GLU 311.A OE1 no hydrogen 2.826 N/A LYS 312.A NZ GLY 309.A O no hydrogen 2.696 N/A ASP 313.A N ASP 310.A O no hydrogen 3.260 N/A LEU 314.A N GLU 311.A O no hydrogen 3.342 N/A LEU 320.A N GLY 316.A O no hydrogen 3.214 N/A LYS 321.A N LYS 317.A O no hydrogen 2.792 N/A VAL 322.A N ALA 318.A O no hydrogen 3.383 N/A VAL 323.A N LEU 319.A O no hydrogen 2.556 N/A MET 324.A N LEU 320.A O no hydrogen 2.796 N/A ARG 325.A N LYS 321.A O no hydrogen 3.286 N/A ARG 325.A NH1 HIS 216.A O no hydrogen 2.599 N/A LYS 326.A N VAL 322.A O no hydrogen 2.819 N/A PHE 327.A N VAL 323.A O no hydrogen 3.102 N/A LEU 328.A N MET 324.A O no hydrogen 3.468 N/A LEU 335.A N ALA 331.A O no hydrogen 3.253 N/A GLU 336.A N ASP 332.A O no hydrogen 3.105 N/A MET 337.A N ALA 333.A O no hydrogen 2.926 N/A ILE 338.A N LEU 334.A O no hydrogen 2.917 N/A VAL 339.A N LEU 335.A O no hydrogen 3.268 N/A LEU 340.A N GLU 336.A O no hydrogen 3.228 N/A HIS 341.A N MET 337.A O no hydrogen 3.473 N/A LEU 342.A N ILE 338.A O no hydrogen 3.149 N/A SER 344.A OG THR 347.A OG1 no hydrogen 3.189 N/A THR 347.A N SER 344.A O no hydrogen 2.730 N/A THR 347.A OG1 SER 344.A O no hydrogen 2.512 N/A THR 347.A OG1 SER 344.A OG no hydrogen 3.189 N/A ALA 348.A N PRO 345.A O no hydrogen 2.890 N/A ARG 352.A N GLN 349.A O no hydrogen 3.154 N/A ALA 353.A N GLN 349.A O no hydrogen 2.817 N/A GLN 355.A N ARG 352.A O no hydrogen 2.980 N/A LEU 356.A N ALA 353.A O no hydrogen 2.647 N/A TYR 357.A OH ASN 365.A OD1 no hydrogen 2.691 N/A GLU 358.A N GLU 358.A OE1 no hydrogen 2.666 N/A ILE 367.A N ASP 363.A O no hydrogen 3.117 N/A ALA 368.A N ALA 364.A O no hydrogen 3.208 N/A ILE 369.A N CYS 366.A O no hydrogen 3.004 N/A LYS 370.A N CYS 366.A O no hydrogen 3.460 N/A ASN 371.A N ILE 367.A O no hydrogen 3.312 N/A CYS 372.A N ALA 368.A O no hydrogen 2.671 N/A CYS 372.A SG ASN 371.A O no hydrogen 2.959 N/A ASP 373.A N ASN 371.A OD1 no hydrogen 2.950 N/A LYS 375.A N ASP 373.A OD1 no hydrogen 2.564 N/A LEU 380.A N LEU 469.A O no hydrogen 3.181 N/A TYR 381.A N ARG 399.A O no hydrogen 3.185 N/A TYR 381.A OH THR 466.A OG1 no hydrogen 2.730 N/A VAL 382.A N GLY 467.A O no hydrogen 3.275 N/A SER 383.A N PHE 397.A O no hydrogen 3.019 N/A VAL 386.A N TYR 395.A O no hydrogen 2.822 N/A THR 388.A OG1 ASP 390.A O no hydrogen 3.128 N/A SER 389.A OG THR 388.A O no hydrogen 2.609 N/A SER 389.A OG ASP 390.A OD1 no hydrogen 3.420 N/A ASP 390.A N THR 388.A OG1 no hydrogen 3.369 N/A PHE 397.A N LYS 384.A O no hydrogen 3.337 N/A ARG 399.A N TYR 381.A O no hydrogen 3.205 N/A ARG 399.A NH1 ASP 123.A OD1 no hydrogen 2.975 N/A ARG 399.A NH2 ASN 21.A OD1 no hydrogen 3.418 N/A VAL 400.A N ASN 452.A O no hydrogen 3.201 N/A PHE 401.A N MET 379.A O no hydrogen 2.646 N/A GLY 403.A N ASP 373.A O no hydrogen 2.448 N/A THR 404.A OG1 PRO 374.A O no hydrogen 2.221 N/A VAL 405.A N CYS 448.A O no hydrogen 2.400 N/A SER 407.A N ASP 447.A OD1 no hydrogen 3.202 N/A GLN 409.A NE2 LYS 406.A O no hydrogen 3.583 N/A VAL 411.A N LYS 429.A O no hydrogen 2.270 N/A ARG 412.A N THR 470.A O no hydrogen 3.044 N/A ILE 413.A N PHE 427.A O no hydrogen 3.020 N/A GLN 414.A N THR 468.A O no hydrogen 2.742 N/A LYS 423.A NZ ASP 424.A O no hydrogen 2.442 N/A ASP 425.A N ASP 424.A OD1 no hydrogen 2.368 N/A LEU 426.A N ASP 424.A O no hydrogen 2.560 N/A GLN 432.A N VAL 457.A O no hydrogen 3.049 N/A ARG 433.A N VAL 457.A O no hydrogen 2.956 N/A VAL 435.A N GLY 455.A O no hydrogen 2.699 N/A LEU 436.A N GLU 443.A O no hydrogen 2.731 N/A ARG 440.A NE THR 59.A O no hydrogen 2.805 N/A ARG 440.A NH2 THR 59.A O no hydrogen 2.350 N/A GLU 443.A N LEU 436.A O no hydrogen 2.952 N/A ILE 445.A N VAL 434.A O no hydrogen 3.368 N/A CYS 448.A N VAL 405.A O no hydrogen 2.547 N/A CYS 448.A SG PRO 449.A O no hydrogen 3.154 N/A GLY 451.A N VAL 400.A O no hydrogen 2.612 N/A GLY 455.A N VAL 435.A O no hydrogen 2.380 N/A VAL 457.A N ARG 433.A O no hydrogen 2.704 N/A GLN 461.A NE2 GLY 392.A O no hydrogen 2.757 N/A THR 466.A OG1 TYR 381.A OH no hydrogen 2.730 N/A THR 466.A OG1 VAL 382.A O no hydrogen 3.271 N/A GLY 467.A N THR 466.A OG1 no hydrogen 2.579 N/A THR 468.A N GLN 414.A O no hydrogen 2.901 N/A THR 468.A OG1 GLN 414.A OE1 no hydrogen 3.383 N/A THR 468.A OG1 ASN 477.A OD1 no hydrogen 3.563 N/A LEU 469.A N LEU 380.A O no hydrogen 2.721 N/A THR 470.A N ARG 412.A O no hydrogen 3.261 N/A THR 470.A OG1 SER 472.A O no hydrogen 3.485 N/A THR 474.A N SER 472.A OG no hydrogen 3.313 N/A MET 478.A N ASN 477.A OD1 no hydrogen 2.590 N/A VAL 488.A N GLY 532.A O no hydrogen 3.096 N/A VAL 489.A N GLY 532.A O no hydrogen 3.297 N/A VAL 491.A N VAL 530.A O no hydrogen 2.865 N/A ALA 492.A N SER 557.A O no hydrogen 2.417 N/A GLU 494.A N LYS 555.A O no hydrogen 3.142 N/A LYS 496.A NZ LEU 554.A O no hydrogen 2.984 N/A ASP 500.A N ASN 497.A O no hydrogen 3.512 N/A LEU 504.A N ASP 500.A O no hydrogen 3.328 N/A VAL 505.A N LEU 501.A O no hydrogen 3.273 N/A GLU 506.A N PRO 502.A O no hydrogen 2.987 N/A GLY 507.A N LYS 503.A O no hydrogen 2.459 N/A LEU 508.A N LEU 504.A O no hydrogen 2.834 N/A ARG 510.A N GLY 507.A O no hydrogen 2.659 N/A LEU 511.A N GLY 507.A O no hydrogen 3.323 N/A SER 512.A N LEU 508.A O no hydrogen 3.316 N/A SER 512.A OG VAL 518.A O no hydrogen 3.299 N/A LYS 513.A N LYS 509.A O no hydrogen 3.194 N/A SER 514.A N ARG 510.A O no hydrogen 3.079 N/A SER 514.A OG LEU 511.A O no hydrogen 3.055 N/A ASP 515.A N LEU 511.A O no hydrogen 2.797 N/A LEU 519.A N ALA 531.A O no hydrogen 3.006 N/A TYR 521.A N ILE 529.A O no hydrogen 3.374 N/A SER 523.A N GLU 527.A O no hydrogen 3.412 N/A SER 523.A OG GLU 527.A OE2 no hydrogen 3.253 N/A GLY 526.A N SER 523.A O no hydrogen 3.196 N/A ILE 529.A N TYR 521.A O no hydrogen 3.063 N/A VAL 530.A N VAL 491.A O no hydrogen 3.086 N/A ALA 531.A N LEU 519.A O no hydrogen 2.661 N/A GLY 532.A N VAL 489.A O no hydrogen 3.002 N/A THR 533.A OG1 ASP 110.A O no hydrogen 2.908 N/A THR 533.A OG1 HIS 537.A ND1 no hydrogen 2.894 N/A HIS 537.A ND1 ASP 110.A O no hydrogen 2.963 N/A LEU 538.A N GLY 534.A O no hydrogen 2.902 N/A GLU 539.A N GLU 535.A O no hydrogen 2.991 N/A ILE 540.A N LEU 536.A O no hydrogen 3.271 N/A CYS 541.A N HIS 537.A O no hydrogen 3.074 N/A CYS 541.A SG ASP 515.A OD2 no hydrogen 3.870 N/A CYS 541.A SG HIS 537.A O no hydrogen 3.198 N/A LEU 542.A N LEU 538.A O no hydrogen 2.676 N/A GLN 543.A N GLU 539.A O no hydrogen 2.992 N/A ASP 544.A N CYS 541.A O no hydrogen 3.127 N/A LEU 545.A N LEU 542.A O no hydrogen 3.113 N/A ASP 548.A N ASP 544.A O no hydrogen 2.800 N/A HIS 549.A N ASP 544.A O no hydrogen 3.191 N/A ALA 550.A N LEU 545.A O no hydrogen 2.830 N/A LYS 555.A N GLU 494.A O no hydrogen 2.833 N/A LYS 555.A NZ GLU 494.A OE2 no hydrogen 3.497 N/A SER 557.A N ALA 492.A O no hydrogen 2.376 N/A SER 557.A OG PRO 558.A O no hydrogen 3.441 N/A ARG 564.A N GLN 724.A O no hydrogen 3.001 N/A ARG 564.A NH1 TYR 563.A O no hydrogen 2.323 N/A THR 566.A N LYS 722.A O no hydrogen 2.853 N/A THR 566.A OG1 GLU 565.A O no hydrogen 2.557 N/A THR 566.A OG1 ARG 682.A O no hydrogen 2.955 N/A THR 566.A OG1 SER 683.A OG no hydrogen 2.568 N/A THR 566.A OG1 GLN 724.A OE1 no hydrogen 2.550 N/A SER 571.A OG ALA 590.A O no hydrogen 3.408 N/A SER 571.A OG GLY 715.A O no hydrogen 3.271 N/A ALA 575.A N LEU 588.A O no hydrogen 3.299 N/A SER 577.A OG TYR 837.A O no hydrogen 3.380 N/A SER 579.A OG ASN 581.A OD1 no hydrogen 2.187 N/A LYS 582.A N SER 579.A O no hydrogen 2.771 N/A LYS 582.A NZ PRO 580.A O no hydrogen 2.332 N/A HIS 583.A N ASN 581.A OD1 no hydrogen 3.074 N/A ASN 584.A N SER 579.A OG no hydrogen 3.136 N/A ASN 584.A ND2 SER 579.A OG no hydrogen 3.075 N/A TYR 587.A N ASP 690.A O no hydrogen 3.316 N/A LYS 589.A N ASN 687.A OD1 no hydrogen 3.152 N/A ALA 590.A N SER 571.A OG no hydrogen 3.114 N/A ILE 593.A N SER 683.A O no hydrogen 2.889 N/A GLU 596.A N GLU 596.A OE1 no hydrogen 2.938 N/A VAL 597.A N ASP 594.A O no hydrogen 3.036 N/A SER 598.A N GLU 595.A O no hydrogen 2.761 N/A SER 598.A OG GLU 595.A O no hydrogen 2.278 N/A ILE 601.A N VAL 597.A O no hydrogen 3.383 N/A GLU 602.A N SER 598.A O no hydrogen 2.702 N/A ASN 603.A N LEU 599.A O no hydrogen 3.104 N/A GLY 604.A N ALA 600.A O no hydrogen 2.843 N/A ILE 605.A N ASN 603.A OD1 no hydrogen 3.351 N/A ILE 606.A N ALA 600.A O no hydrogen 3.327 N/A ASP 610.A N ASN 607.A O no hydrogen 2.936 N/A ARG 615.A N ASP 611.A O no hydrogen 3.435 N/A ARG 615.A NH2 ASP 610.A O no hydrogen 2.512 N/A MET 619.A N ARG 615.A O no hydrogen 3.064 N/A ASP 621.A N ARG 617.A O no hydrogen 3.439 N/A ASP 622.A N ILE 618.A O no hydrogen 3.131 N/A ASP 622.A N MET 619.A O no hydrogen 3.236 N/A TYR 623.A N MET 619.A O no hydrogen 3.089 N/A GLY 624.A N ALA 620.A O no hydrogen 2.818 N/A ALA 630.A N VAL 627.A O no hydrogen 3.140 N/A ARG 631.A N THR 628.A O no hydrogen 3.171 N/A LYS 632.A NZ ASP 629.A OD1 no hydrogen 2.267 N/A LYS 632.A NZ ASP 648.A O no hydrogen 2.949 N/A CYS 635.A SG PHE 636.A O no hydrogen 3.830 N/A GLY 637.A N ASN 644.A O no hydrogen 2.963 N/A ASP 639.A N GLN 668.A OE1 no hydrogen 2.848 N/A ASN 644.A N GLY 637.A O no hydrogen 3.112 N/A ASN 644.A ND2 GLY 637.A O no hydrogen 3.481 N/A ILE 647.A N VAL 686.A O no hydrogen 3.234 N/A ASP 648.A N LYS 632.A O no hydrogen 3.489 N/A GLN 649.A N ILE 688.A O no hydrogen 3.142 N/A THR 650.A OG1 ASP 648.A OD1 no hydrogen 3.056 N/A THR 650.A OG1 ASP 648.A OD2 no hydrogen 2.266 N/A THR 650.A OG1 LYS 651.A O no hydrogen 3.300 N/A VAL 663.A N ILE 659.A O no hydrogen 2.578 N/A VAL 664.A N LYS 660.A O no hydrogen 3.184 N/A ALA 665.A N ASP 661.A O no hydrogen 3.446 N/A ALA 666.A N SER 662.A O no hydrogen 3.218 N/A PHE 667.A N VAL 663.A O no hydrogen 2.689 N/A GLN 668.A N VAL 664.A O no hydrogen 2.768 N/A TRP 669.A N ALA 665.A O no hydrogen 3.283 N/A ALA 670.A N ALA 666.A O no hydrogen 3.074 N/A THR 671.A N PHE 667.A O no hydrogen 3.026 N/A THR 671.A N GLN 668.A O no hydrogen 3.210 N/A THR 671.A OG1 PHE 667.A O no hydrogen 2.892 N/A LYS 672.A N GLN 668.A O no hydrogen 2.880 N/A GLU 673.A N TRP 669.A O no hydrogen 3.209 N/A ILE 676.A N GLU 565.A OE2 no hydrogen 3.055 N/A GLU 679.A N GLU 679.A OE1 no hydrogen 2.934 N/A MET 681.A N THR 671.A O no hydrogen 2.651 N/A ARG 682.A N GLU 565.A O no hydrogen 3.246 N/A ARG 682.A NH1 MET 681.A O no hydrogen 3.348 N/A SER 683.A OG ARG 682.A O no hydrogen 2.548 N/A VAL 684.A N ASN 644.A OD1 no hydrogen 2.887 N/A ARG 685.A N GLU 591.A O no hydrogen 2.670 N/A ARG 685.A NE GLU 591.A OE1 no hydrogen 3.460 N/A ARG 685.A NH2 GLU 591.A OE1 no hydrogen 3.399 N/A VAL 686.A N LEU 645.A O no hydrogen 2.819 N/A ILE 688.A N ILE 647.A O no hydrogen 3.141 N/A LEU 689.A N TYR 587.A O no hydrogen 2.239 N/A THR 692.A N ARG 585.A O no hydrogen 3.517 N/A THR 692.A OG1 ARG 585.A O no hydrogen 3.476 N/A ARG 709.A N ILE 705.A O no hydrogen 3.117 N/A ARG 710.A N PRO 706.A O no hydrogen 2.650 N/A ARG 710.A NE LYS 578.A O no hydrogen 3.017 N/A ARG 710.A NH2 LYS 578.A O no hydrogen 2.370 N/A ALA 711.A N THR 707.A O no hydrogen 2.936 N/A THR 712.A N MET 708.A O no hydrogen 2.691 N/A TYR 713.A N ARG 709.A O no hydrogen 2.929 N/A ALA 714.A N ARG 710.A O no hydrogen 2.752 N/A GLY 715.A N ALA 711.A O no hydrogen 2.385 N/A PHE 716.A N THR 712.A O no hydrogen 2.970 N/A LEU 717.A N TYR 713.A O no hydrogen 3.115 N/A LEU 718.A N ALA 714.A O no hydrogen 2.786 N/A LYS 722.A N THR 566.A O no hydrogen 2.469 N/A LYS 722.A NZ GLU 568.A OE2 no hydrogen 2.944 N/A LYS 722.A NZ ASP 806.A OD1 no hydrogen 3.108 N/A GLN 724.A N ARG 564.A O no hydrogen 2.845 N/A GLN 724.A NE2 GLU 565.A O no hydrogen 2.813 N/A GLN 724.A NE2 THR 566.A OG1 no hydrogen 2.593 N/A GLU 725.A N SER 801.A O no hydrogen 2.902 N/A PHE 728.A N LEU 771.A O no hydrogen 3.154 N/A LEU 729.A N VAL 796.A O no hydrogen 2.475 N/A GLU 731.A N GLN 794.A O no hydrogen 3.150 N/A ILE 732.A N VAL 767.A O no hydrogen 3.344 N/A GLN 733.A N PHE 792.A O no hydrogen 3.066 N/A CYS 734.A SG ALA 738.A O no hydrogen 3.511 N/A ALA 738.A N PRO 735.A O no hydrogen 3.266 N/A SER 744.A N GLY 740.A O no hydrogen 3.321 N/A LEU 746.A N ILE 742.A O no hydrogen 3.008 N/A ASN 747.A N TYR 743.A O no hydrogen 2.761 N/A LYS 748.A N VAL 745.A O no hydrogen 3.108 N/A LYS 749.A N VAL 745.A O no hydrogen 3.099 N/A GLY 751.A N LEU 746.A O no hydrogen 2.853 N/A GLN 752.A N TYR 770.A O no hydrogen 2.912 N/A SER 755.A N LYS 768.A O no hydrogen 3.209 N/A GLN 758.A NE2 GLU 756.A OE2 no hydrogen 2.420 N/A PHE 765.A N CYS 734.A O no hydrogen 2.454 N/A THR 766.A N GLU 757.A O no hydrogen 3.128 N/A THR 766.A OG1 GLU 757.A O no hydrogen 2.597 N/A THR 766.A OG1 GLU 757.A OE1 no hydrogen 2.738 N/A LYS 768.A N SER 755.A O no hydrogen 2.677 N/A LYS 768.A NZ GLU 731.A OE1 no hydrogen 3.302 N/A TYR 770.A N GLN 752.A O no hydrogen 3.301 N/A VAL 773.A N PRO 726.A O no hydrogen 3.016 N/A GLU 775.A N ASN 774.A OD1 no hydrogen 2.460 N/A SER 776.A OG VAL 773.A O no hydrogen 2.213 N/A GLY 781.A N GLY 778.A O no hydrogen 2.622 N/A GLU 782.A N GLU 782.A OE1 no hydrogen 2.907 N/A LEU 783.A N PHE 779.A O no hydrogen 2.661 N/A ARG 784.A N THR 780.A O no hydrogen 2.793 N/A GLN 785.A N GLY 781.A O no hydrogen 2.607 N/A ALA 786.A N GLU 782.A O no hydrogen 2.979 N/A THR 787.A N LEU 783.A O no hydrogen 3.254 N/A THR 787.A N ARG 784.A O no hydrogen 3.255 N/A THR 787.A OG1 LEU 783.A O no hydrogen 2.504 N/A THR 787.A OG1 ARG 784.A O no hydrogen 3.531 N/A GLY 789.A N ARG 784.A O no hydrogen 3.351 N/A GLN 790.A N THR 787.A O no hydrogen 3.336 N/A GLN 794.A N GLU 731.A O no hydrogen 3.260 N/A VAL 796.A N LEU 729.A O no hydrogen 3.018 N/A ASP 798.A N VAL 727.A O no hydrogen 2.912 N/A THR 802.A OG1 ILE 723.A O no hydrogen 3.027 N/A THR 802.A OG1 LEU 803.A O no hydrogen 3.287 N/A LEU 803.A N ILE 723.A O no hydrogen 2.260 N/A THR 811.A N ASP 809.A OD1 no hydrogen 3.206 N/A SER 812.A OG ASP 806.A O no hydrogen 3.075 N/A ALA 814.A N SER 812.A OG no hydrogen 3.231 N/A GLY 815.A N SER 812.A O no hydrogen 3.171 N/A GLU 816.A N SER 812.A O no hydrogen 3.122 N/A ILE 817.A N LYS 813.A O no hydrogen 3.285 N/A VAL 818.A N ALA 814.A O no hydrogen 3.443 N/A LEU 819.A N GLY 815.A O no hydrogen 3.163 N/A ALA 820.A N GLU 816.A O no hydrogen 2.652 N/A ALA 821.A N ILE 817.A O no hydrogen 2.564 N/A ARG 822.A N VAL 818.A O no hydrogen 2.328 N/A LYS 823.A N LEU 819.A O no hydrogen 2.563 N/A ARG 824.A N ALA 820.A O no hydrogen 2.658 N/A HIS 825.A N ALA 821.A O no hydrogen 2.741 N/A MET 827.A N ARG 822.A O no hydrogen 3.078 N/A GLY 833.A N GLU 836.A OE2 no hydrogen 2.944 N/A GLU 836.A N GLU 836.A OE1 no hydrogen 3.126 N/A TYR 837.A N TRP 834.A O no hydrogen 2.848 N/A TYR 838.A N TRP 834.A O no hydrogen 2.348 N/A LYS 840.A NZ GLN 835.A O no hydrogen 2.512 N/A