Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pxi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N VAL 101.A O no hydrogen 2.846 N/A THR 5.A OG1 VAL 101.A O no hydrogen 3.218 N/A GLN 9.A N THR 5.A O no hydrogen 2.796 N/A LYS 10.A N GLU 6.A O no hydrogen 2.594 N/A LYS 10.A NZ GLU 6.A OE2 no hydrogen 3.225 N/A VAL 11.A N ARG 7.A O no hydrogen 2.948 N/A LEU 12.A N ALA 8.A O no hydrogen 2.923 N/A ALA 13.A N GLN 9.A O no hydrogen 3.002 N/A LEU 14.A N LYS 10.A O no hydrogen 2.754 N/A ALA 15.A N VAL 11.A O no hydrogen 2.994 N/A ALA 15.A N LEU 12.A O no hydrogen 2.890 N/A GLU 17.A N ALA 13.A O no hydrogen 2.980 N/A GLU 18.A N LEU 14.A O no hydrogen 3.064 N/A ALA 19.A N ALA 15.A O no hydrogen 2.592 N/A LEU 20.A N GLN 16.A O no hydrogen 3.125 N/A ARG 21.A N GLU 17.A O no hydrogen 3.147 N/A HIS 24.A ND1 HIS 31.A NE2 no hydrogen 3.241 N/A HIS 24.A NE2 GLY 67.A O no hydrogen 2.649 N/A ILE 27.A N HIS 77.A O no hydrogen 3.313 N/A GLY 28.A N HIS 31.A ND1 no hydrogen 3.258 N/A GLU 30.A N GLU 30.A OE2 no hydrogen 2.526 N/A HIS 31.A N GLY 28.A O no hydrogen 3.189 N/A HIS 31.A NE2 HIS 24.A ND1 no hydrogen 3.241 N/A ILE 32.A N GLY 28.A O no hydrogen 3.452 N/A LEU 33.A N THR 29.A O no hydrogen 3.084 N/A LEU 34.A N GLU 30.A O no hydrogen 3.258 N/A GLY 35.A N HIS 31.A O no hydrogen 2.810 N/A LEU 36.A N ILE 32.A O no hydrogen 3.037 N/A LEU 36.A N LEU 33.A O no hydrogen 3.120 N/A VAL 37.A N LEU 33.A O no hydrogen 3.293 N/A GLY 42.A N GLU 39.A OE1 no hydrogen 3.191 N/A LYS 46.A N GLY 42.A O no hydrogen 2.560 N/A ALA 47.A N ILE 43.A O no hydrogen 2.871 N/A LEU 48.A N ALA 44.A O no hydrogen 3.290 N/A GLN 49.A N ALA 45.A O no hydrogen 3.368 N/A ALA 50.A N ALA 47.A O no hydrogen 2.460 N/A LEU 51.A N ALA 47.A O no hydrogen 3.291 N/A LEU 53.A N LEU 48.A O no hydrogen 3.053 N/A LYS 57.A NZ GLY 52.A O no hydrogen 3.030 N/A ILE 58.A N GLY 54.A O no hydrogen 3.355 N/A GLN 59.A N SER 55.A O no hydrogen 3.045 N/A VAL 62.A N ILE 58.A O no hydrogen 2.974 N/A GLU 63.A N GLN 59.A O no hydrogen 2.805 N/A SER 64.A N LYS 60.A O no hydrogen 3.045 N/A LEU 65.A N VAL 62.A O no hydrogen 2.734 N/A GLY 69.A N GLN 70.A OE1 no hydrogen 3.414 N/A SER 73.A OG GLU 71.A O no hydrogen 2.696 N/A SER 73.A OG MET 72.A O no hydrogen 2.747 N/A THR 75.A N SER 73.A O no hydrogen 2.535 N/A THR 75.A OG1 GLN 74.A O no hydrogen 2.605 N/A TYR 78.A N HIS 77.A ND1 no hydrogen 2.954 N/A THR 79.A N ILE 27.A O no hydrogen 3.076 N/A THR 79.A OG1 ILE 27.A O no hydrogen 3.434 N/A ARG 81.A NE GLU 115.A O no hydrogen 2.693 N/A ALA 82.A N THR 79.A OG1 no hydrogen 2.953 N/A LYS 83.A N THR 79.A O no hydrogen 2.896 N/A LYS 84.A N PRO 80.A O no hydrogen 2.975 N/A VAL 85.A N ARG 81.A O no hydrogen 2.781 N/A ILE 86.A N ALA 82.A O no hydrogen 2.812 N/A GLU 87.A N LYS 83.A O no hydrogen 3.098 N/A LEU 88.A N LYS 84.A O no hydrogen 2.967 N/A SER 89.A N VAL 85.A O no hydrogen 3.174 N/A SER 89.A OG ILE 86.A O no hydrogen 3.121 N/A MET 90.A N ILE 86.A O no hydrogen 3.368 N/A ASP 91.A N LEU 88.A O no hydrogen 2.687 N/A GLU 92.A N LEU 88.A O no hydrogen 2.727 N/A ARG 94.A N MET 90.A O no hydrogen 3.187 N/A ARG 94.A NE ASP 91.A OD1 no hydrogen 3.294 N/A ARG 94.A NH2 ASP 91.A OD2 no hydrogen 2.870 N/A LYS 95.A N ASP 91.A O no hydrogen 2.971 N/A LYS 95.A NZ GLU 92.A OE1 no hydrogen 2.739 N/A LEU 96.A N ARG 94.A O no hydrogen 2.766 N/A GLY 97.A N ARG 94.A O no hydrogen 3.294 N/A THR 103.A OG1 GLU 104.A OE1 no hydrogen 3.499 N/A GLU 104.A N GLU 104.A OE1 no hydrogen 2.491 N/A ILE 106.A N GLY 102.A O no hydrogen 3.403 N/A LEU 107.A N THR 103.A O no hydrogen 3.370 N/A LEU 108.A N GLU 104.A O no hydrogen 2.720 N/A GLY 109.A N HIS 105.A O no hydrogen 2.582 N/A LEU 110.A N ILE 106.A O no hydrogen 2.904 N/A ARG 112.A N LEU 108.A O no hydrogen 3.312 N/A GLU 113.A N GLY 109.A O no hydrogen 3.508 N/A ALA 118.A N THR 29.A OG1 no hydrogen 3.145 N/A ARG 120.A N GLY 116.A O no hydrogen 3.411 N/A VAL 121.A N VAL 117.A O no hydrogen 3.051 N/A LEU 122.A N ALA 118.A O no hydrogen 3.380 N/A ASN 123.A N ALA 119.A O no hydrogen 3.003 N/A ASN 124.A ND2 ARG 120.A O no hydrogen 3.295 N/A LEU 125.A N VAL 121.A O no hydrogen 2.686 N/A VAL 127.A N LEU 122.A O no hydrogen 2.859 N/A ARG 133.A N LEU 129.A O no hydrogen 3.351 N/A ARG 133.A NH1 ASN 130.A OD1 no hydrogen 2.580 N/A GLN 134.A N ASN 130.A O no hydrogen 3.045 N/A GLN 135.A N LYS 131.A O no hydrogen 3.440 N/A LEU 137.A N ARG 133.A O no hydrogen 3.206 N/A GLN 138.A N GLN 134.A O no hydrogen 3.060 N/A LEU 139.A N VAL 136.A O no hydrogen 3.014 N/A LEU 140.A N LEU 137.A O no hydrogen 2.898 N/A THR 153.A N ASN 150.A O no hydrogen 2.866 N/A LEU 156.A N ASN 152.A O no hydrogen 2.554 N/A ASP 157.A N THR 153.A O no hydrogen 3.074 N/A SER 158.A N THR 155.A O no hydrogen 2.873 N/A ALA 165.A N ASP 162.A OD2 no hydrogen 3.108 N/A ILE 166.A N ASP 162.A O no hydrogen 3.114 N/A ALA 167.A N THR 164.A O no hydrogen 3.085 N/A LYS 168.A N ALA 165.A O no hydrogen 2.677 N/A SER 171.A OG SER 171.A O no hydrogen 2.644 N/A ILE 182.A N SER 179.A O no hydrogen 3.247 N/A VAL 185.A N ILE 182.A O no hydrogen 3.179 N/A ILE 186.A N GLN 183.A O no hydrogen 2.696 N/A LEU 189.A N ILE 186.A O no hydrogen 3.234 N/A SER 190.A N GLU 187.A O no hydrogen 2.886 N/A LYS 194.A NZ GLU 289.A O no hydrogen 2.809 N/A ASN 195.A N THR 193.A O no hydrogen 2.786 N/A ASN 196.A ND2 LEU 267.A O no hydrogen 3.591 N/A LEU 199.A N GLY 271.A O no hydrogen 2.451 N/A ILE 200.A N ILE 295.A O no hydrogen 3.293 N/A VAL 205.A N GLU 202.A O no hydrogen 2.920 N/A LYS 207.A NZ LEU 199.A O no hydrogen 3.151 N/A ALA 209.A N GLY 206.A O no hydrogen 2.629 N/A ILE 210.A N LYS 207.A O no hydrogen 2.800 N/A GLY 213.A N ILE 210.A O no hydrogen 2.792 N/A GLN 216.A N GLU 212.A O no hydrogen 3.432 N/A GLN 217.A N GLY 213.A O no hydrogen 3.255 N/A ILE 218.A N LEU 214.A O no hydrogen 2.787 N/A ILE 219.A N ALA 215.A O no hydrogen 3.251 N/A ASN 220.A N GLN 216.A O no hydrogen 3.241 N/A LEU 227.A N PRO 224.A O no hydrogen 2.877 N/A ARG 228.A N PRO 224.A O no hydrogen 3.318 N/A ARG 228.A NE ASN 221.A OD1 no hydrogen 2.978 N/A VAL 232.A N THR 164.A OG1 no hydrogen 2.828 N/A THR 234.A N ALA 160.A O no hydrogen 3.168 N/A THR 234.A OG1 ALA 160.A O no hydrogen 3.237 N/A THR 234.A OG1 ARG 161.A O no hydrogen 3.256 N/A LYS 241.A NZ ASP 237.A O no hydrogen 2.795 N/A ASP 244.A N LYS 240.A O no hydrogen 2.758 N/A ASP 244.A N LYS 241.A O no hydrogen 3.235 N/A GLU 245.A N LYS 241.A O no hydrogen 3.225 N/A ARG 247.A N MET 243.A O no hydrogen 3.307 N/A ILE 252.A N GLY 250.A O no hydrogen 2.665 N/A ILE 253.A N ARG 231.A O no hydrogen 3.083 N/A ILE 256.A N ILE 270.A O no hydrogen 3.090 N/A LYS 259.A NZ TYR 281.A OH no hydrogen 2.731 N/A ARG 264.A N SER 261.A O no hydrogen 3.321 N/A ARG 264.A N LEU 262.A O no hydrogen 2.353 N/A GLN 268.A NE2 LEU 189.A O no hydrogen 3.681 N/A GLN 268.A NE2 ASN 195.A O no hydrogen 3.001 N/A GLN 268.A NE2 ASN 196.A OD1 no hydrogen 3.587 N/A ILE 270.A N LEU 254.A O no hydrogen 2.382 N/A GLY 271.A N PRO 197.A O no hydrogen 2.921 N/A ALA 272.A N ILE 256.A O no hydrogen 3.002 N/A THR 273.A N LEU 199.A O no hydrogen 3.231 N/A ASP 276.A N THR 274.A OG1 no hydrogen 3.250 N/A GLU 277.A N THR 274.A OG1 no hydrogen 2.655 N/A ARG 279.A NE ASP 276.A OD1 no hydrogen 2.796 N/A ARG 279.A NH1 GLU 283.A OE1 no hydrogen 3.331 N/A ARG 279.A NH1 GLU 283.A OE2 no hydrogen 3.068 N/A ARG 279.A NH2 ASP 276.A OD2 no hydrogen 3.213 N/A LYS 280.A N ASP 276.A O no hydrogen 3.076 N/A ILE 282.A N TYR 278.A O no hydrogen 3.164 N/A GLU 283.A N ARG 279.A O no hydrogen 3.194 N/A ASP 285.A N TYR 281.A O no hydrogen 3.081 N/A ARG 290.A N ALA 286.A O no hydrogen 3.275 N/A ARG 291.A N ALA 287.A O no hydrogen 2.872 N/A ILE 295.A N VAL 198.A O no hydrogen 3.027 N/A GLN 296.A NE2 VAL 297.A O no hydrogen 2.924 N/A VAL 297.A N ILE 200.A O no hydrogen 3.207 N/A SER 301.A N GLU 304.A OE1 no hydrogen 3.363 N/A SER 301.A OG GLU 304.A OE2 no hydrogen 3.023 N/A SER 305.A N SER 301.A O no hydrogen 3.122 N/A SER 305.A OG LEU 345.A O no hydrogen 3.407 N/A ILE 306.A N VAL 302.A O no hydrogen 3.486 N/A GLN 307.A N ASP 303.A O no hydrogen 3.346 N/A ILE 308.A N GLU 304.A O no hydrogen 3.192 N/A ILE 308.A N SER 305.A O no hydrogen 2.819 N/A LEU 309.A N SER 305.A O no hydrogen 3.259 N/A GLN 310.A N ILE 306.A O no hydrogen 3.298 N/A GLY 311.A N GLN 307.A O no hydrogen 3.194 N/A LEU 312.A N ILE 308.A O no hydrogen 3.333 N/A LEU 312.A N LEU 309.A O no hydrogen 3.085 N/A ARG 313.A N GLN 310.A O no hydrogen 2.635 N/A ARG 313.A NH2 ASP 326.A OD1 no hydrogen 3.003 N/A ARG 315.A N LEU 312.A O no hydrogen 3.233 N/A TYR 316.A N LEU 312.A O no hydrogen 3.094 N/A TYR 316.A N ARG 313.A O no hydrogen 2.687 N/A HIS 320.A N GLU 317.A O no hydrogen 3.080 N/A SER 323.A OG GLU 317.A OE1 no hydrogen 3.101 N/A ALA 328.A N THR 325.A O no hydrogen 2.813 N/A ILE 329.A N THR 325.A O no hydrogen 3.041 N/A GLU 330.A N ASP 326.A O no hydrogen 3.199 N/A ALA 332.A N ALA 328.A O no hydrogen 3.142 N/A VAL 333.A N ILE 329.A O no hydrogen 3.016 N/A LYS 334.A N GLU 330.A O no hydrogen 2.723 N/A LYS 334.A NZ GLU 330.A OE1 no hydrogen 3.548 N/A LEU 335.A N ALA 331.A O no hydrogen 3.059 N/A SER 336.A N VAL 333.A O no hydrogen 2.747 N/A SER 336.A OG ALA 332.A O no hydrogen 2.543 N/A SER 336.A OG VAL 333.A O no hydrogen 2.993 N/A TYR 339.A N LEU 335.A O no hydrogen 2.472 N/A LYS 348.A N PHE 344.A O no hydrogen 3.320 N/A LYS 348.A NZ SER 336.A O no hydrogen 2.905 N/A ASP 351.A N ASP 347.A O no hydrogen 3.107 N/A ASP 351.A N LYS 348.A O no hydrogen 2.898 N/A LEU 352.A N LYS 348.A O no hydrogen 3.130 N/A ILE 353.A N ALA 349.A O no hydrogen 3.092 N/A ASP 354.A N ILE 350.A O no hydrogen 2.853 N/A GLU 355.A N ASP 351.A O no hydrogen 2.739 N/A ALA 356.A N LEU 352.A O no hydrogen 3.012 N/A VAL 360.A N ALA 356.A O no hydrogen 3.358 N/A LEU 362.A N LYS 359.A O no hydrogen 3.235 N/A ARG 363.A N LYS 359.A O no hydrogen 3.103 N/A SER 364.A N VAL 360.A O no hydrogen 3.241 N/A PHE 365.A N LEU 362.A O no hydrogen 2.402 N/A GLU 371.A N ASN 368.A O no hydrogen 2.880 N/A LYS 375.A N GLU 371.A O no hydrogen 2.876 N/A LEU 376.A N LEU 372.A O no hydrogen 2.827 N/A ASP 377.A N GLU 373.A O no hydrogen 3.145 N/A ARG 380.A N LEU 376.A O no hydrogen 3.288 N/A ARG 380.A NH1 ASP 384.A OD1 no hydrogen 3.087 N/A GLU 382.A N GLU 378.A O no hydrogen 3.265 N/A LYS 383.A N VAL 379.A O no hydrogen 2.856 N/A LYS 383.A NZ GLU 402.A OE1 no hydrogen 3.151 N/A ASP 384.A N ARG 380.A O no hydrogen 2.255 N/A ALA 385.A N LYS 381.A O no hydrogen 2.474 N/A ALA 386.A N GLU 382.A O no hydrogen 2.717 N/A VAL 387.A N LYS 383.A O no hydrogen 2.719 N/A GLN 388.A N ASP 384.A O no hydrogen 3.023 N/A GLN 388.A N ALA 385.A O no hydrogen 3.116 N/A SER 389.A N ALA 385.A O no hydrogen 3.247 N/A SER 389.A N ALA 386.A O no hydrogen 2.684 N/A SER 389.A OG ALA 385.A O no hydrogen 3.150 N/A GLN 390.A N ALA 386.A O no hydrogen 2.436 N/A ALA 395.A N PHE 392.A O no hydrogen 2.525 N/A ALA 396.A N PHE 392.A O no hydrogen 2.960 N/A ARG 399.A N ALA 395.A O no hydrogen 2.440 N/A ASP 400.A N ALA 396.A O no hydrogen 3.020 N/A THR 401.A N SER 397.A O no hydrogen 2.603 N/A THR 401.A OG1 SER 397.A O no hydrogen 3.213 N/A THR 401.A OG1 LEU 398.A O no hydrogen 2.352 N/A GLU 402.A N LEU 398.A O no hydrogen 2.868 N/A GLN 403.A N ARG 399.A O no hydrogen 3.032 N/A ARG 404.A N ASP 400.A O no hydrogen 3.031 N/A LEU 405.A N THR 401.A O no hydrogen 3.396 N/A ARG 406.A N GLU 402.A O no hydrogen 2.898 N/A ARG 406.A NH1 GLU 410.A OE2 no hydrogen 3.381 N/A ARG 406.A NH2 GLN 403.A OE1 no hydrogen 3.046 N/A GLU 407.A N GLN 403.A O no hydrogen 3.166 N/A GLN 408.A N ARG 404.A O no hydrogen 3.472 N/A VAL 409.A N LEU 405.A O no hydrogen 2.863 N/A GLU 410.A N ARG 406.A O no hydrogen 2.794 N/A ASP 411.A N GLU 407.A O no hydrogen 2.839 N/A THR 412.A N GLN 408.A O no hydrogen 3.192 N/A THR 412.A N VAL 409.A O no hydrogen 2.695 N/A LYS 413.A N VAL 409.A O no hydrogen 2.713 N/A LYS 413.A N GLU 410.A O no hydrogen 3.240 N/A LYS 414.A N GLU 410.A O no hydrogen 2.921 N/A GLU 418.A N SER 415.A O no hydrogen 3.215 N/A GLN 420.A N LYS 417.A O no hydrogen 3.154 N/A GLN 420.A NE2 TRP 416.A O no hydrogen 3.223 N/A GLY 421.A N LYS 417.A O no hydrogen 3.056 N/A GLN 422.A N GLU 418.A O no hydrogen 3.019 N/A ASP 428.A N THR 425.A O no hydrogen 2.941 N/A ALA 430.A N VAL 426.A O no hydrogen 2.914 N/A MET 431.A N ASP 427.A O no hydrogen 3.190 N/A VAL 432.A N ASP 428.A O no hydrogen 3.297 N/A VAL 433.A N ILE 429.A O no hydrogen 2.885 N/A SER 434.A N ALA 430.A O no hydrogen 2.948 N/A SER 435.A N MET 431.A O no hydrogen 2.922 N/A SER 435.A OG MET 431.A O no hydrogen 3.468 N/A SER 435.A OG VAL 432.A O no hydrogen 2.773 N/A TRP 436.A N VAL 433.A O no hydrogen 2.830 N/A THR 437.A N SER 434.A O no hydrogen 3.396 N/A GLN 439.A NE2 ASP 443.A OD2 no hydrogen 2.857 N/A GLU 441.A N ALA 438.A O no hydrogen 2.614 N/A THR 442.A N ALA 438.A O no hydrogen 3.094 N/A THR 442.A N GLN 439.A O no hydrogen 3.289 N/A ASP 443.A N GLN 439.A O no hydrogen 2.852 N/A LYS 444.A NZ SER 507.A O no hydrogen 3.382 N/A LEU 446.A N THR 442.A O no hydrogen 2.758 N/A ASN 447.A N ASP 443.A O no hydrogen 2.923 N/A MET 448.A N LEU 445.A O no hydrogen 3.069 N/A GLU 449.A N GLU 449.A OE1 no hydrogen 3.080 N/A ILE 451.A N ASN 447.A O no hydrogen 3.159 N/A ILE 451.A N MET 448.A O no hydrogen 2.910 N/A LEU 452.A N MET 448.A O no hydrogen 2.643 N/A HIS 453.A N GLU 449.A O no hydrogen 2.780 N/A HIS 453.A ND1 GLU 449.A O no hydrogen 2.848 N/A HIS 453.A NE2 ASP 460.A OD1 no hydrogen 2.479 N/A SER 454.A OG ILE 451.A O no hydrogen 2.723 N/A ARG 455.A N LEU 452.A O no hydrogen 3.256 N/A ARG 455.A NE GLU 506.A OE2 no hydrogen 3.046 N/A ARG 455.A NH2 GLU 506.A OE2 no hydrogen 3.331 N/A VAL 456.A N LEU 452.A O no hydrogen 2.820 N/A GLN 459.A NE2 HIS 615.A O no hydrogen 2.711 N/A VAL 463.A N GLN 459.A O no hydrogen 3.086 N/A VAL 464.A N ASP 460.A O no hydrogen 3.190 N/A VAL 466.A N ALA 462.A O no hydrogen 3.075 N/A ALA 467.A N VAL 463.A O no hydrogen 2.746 N/A LYS 468.A N VAL 464.A O no hydrogen 3.161 N/A ALA 469.A N ALA 465.A O no hydrogen 3.108 N/A VAL 470.A N VAL 466.A O no hydrogen 2.940 N/A ARG 471.A N ALA 467.A O no hydrogen 2.963 N/A ARG 471.A NE LEU 445.A O no hydrogen 3.186 N/A ARG 471.A NH2 GLU 449.A OE2 no hydrogen 2.432 N/A ARG 472.A N LYS 468.A O no hydrogen 2.799 N/A ARG 472.A NH2 GLU 610.A OE2 no hydrogen 2.895 N/A ALA 473.A N ALA 469.A O no hydrogen 3.082 N/A ARG 474.A N VAL 470.A O no hydrogen 2.632 N/A ALA 475.A N ARG 472.A O no hydrogen 3.045 N/A GLY 476.A N ALA 473.A O no hydrogen 3.291 N/A LYS 481.A N ASP 479.A OD1 no hydrogen 3.040 N/A LYS 481.A NZ ASP 565.A OD1 no hydrogen 3.475 N/A ARG 482.A N ASP 479.A O no hydrogen 3.191 N/A ARG 482.A NH2 ARG 607.A O no hydrogen 3.124 N/A ARG 482.A NH2 ASP 609.A OD1 no hydrogen 3.161 N/A ILE 484.A N THR 576.A O no hydrogen 3.066 N/A SER 486.A N ASP 609.A OD2 no hydrogen 3.129 N/A SER 486.A OG ASP 609.A OD2 no hydrogen 3.440 N/A PHE 487.A N LEU 578.A O no hydrogen 2.883 N/A ILE 488.A N GLU 610.A O no hydrogen 3.315 N/A PHE 489.A N MET 580.A O no hydrogen 2.737 N/A LEU 490.A N ILE 612.A O no hydrogen 2.957 N/A LYS 497.A NZ GLY 491.A O no hydrogen 3.424 N/A LEU 500.A N GLY 496.A O no hydrogen 2.806 N/A LEU 500.A N LYS 497.A O no hydrogen 3.259 N/A ALA 501.A N LYS 497.A O no hydrogen 3.428 N/A ARG 502.A N THR 498.A O no hydrogen 2.948 N/A ARG 502.A NH1 GLU 499.A OE1 no hydrogen 3.430 N/A ALA 503.A N GLU 499.A O no hydrogen 3.162 N/A LEU 504.A N LEU 500.A O no hydrogen 2.876 N/A ALA 505.A N ALA 501.A O no hydrogen 3.067 N/A GLU 506.A N ARG 502.A O no hydrogen 2.833 N/A SER 507.A N ALA 503.A O no hydrogen 2.996 N/A ILE 508.A N LEU 504.A O no hydrogen 2.666 N/A PHE 509.A N ALA 505.A O no hydrogen 2.770 N/A GLU 513.A N ASP 511.A O no hydrogen 2.275 N/A SER 514.A N ASP 511.A O no hydrogen 2.764 N/A SER 514.A OG ASP 511.A O no hydrogen 2.797 N/A ILE 516.A N VAL 542.A O no hydrogen 3.013 N/A ARG 517.A NE ILE 518.A O no hydrogen 3.544 N/A ILE 518.A N LEU 544.A O no hydrogen 3.004 N/A MET 520.A N ASP 546.A O no hydrogen 3.389 N/A SER 521.A N ASP 519.A OD1 no hydrogen 3.203 N/A SER 521.A OG ASP 519.A OD1 no hydrogen 2.718 N/A GLU 522.A N ASP 519.A O no hydrogen 2.881 N/A TYR 523.A N MET 520.A O no hydrogen 2.983 N/A SER 528.A OG ASP 554.A OD2 no hydrogen 3.453 N/A VAL 535.A N LEU 531.A O no hydrogen 3.065 N/A ARG 536.A N THR 532.A O no hydrogen 2.947 N/A ARG 537.A N GLU 533.A O no hydrogen 2.700 N/A LYS 538.A N LYS 534.A O no hydrogen 3.034 N/A SER 541.A OG LYS 538.A O no hydrogen 2.849 N/A VAL 542.A N SER 514.A O no hydrogen 3.251 N/A VAL 543.A N ILE 577.A O no hydrogen 3.112 N/A LEU 544.A N ILE 516.A O no hydrogen 2.840 N/A LEU 545.A N ILE 579.A O no hydrogen 2.896 N/A ASP 546.A N ILE 518.A O no hydrogen 3.002 N/A ALA 547.A N THR 581.A OG1 no hydrogen 2.850 N/A ILE 548.A N THR 581.A O no hydrogen 3.032 N/A ALA 551.A N ILE 548.A O no hydrogen 3.328 N/A HIS 552.A N TYR 523.A O no hydrogen 3.328 N/A HIS 552.A ND1 MET 524.A O no hydrogen 3.221 N/A VAL 555.A N HIS 552.A O no hydrogen 2.771 N/A PHE 556.A N PRO 553.A O no hydrogen 3.271 N/A ASN 557.A N ASP 554.A O no hydrogen 2.743 N/A ILE 558.A N VAL 555.A O no hydrogen 2.935 N/A LEU 559.A N VAL 555.A O no hydrogen 2.945 N/A LEU 560.A N PHE 556.A O no hydrogen 2.696 N/A GLN 561.A N ASN 557.A O no hydrogen 3.392 N/A VAL 562.A N ILE 558.A O no hydrogen 3.056 N/A LEU 563.A N LEU 559.A O no hydrogen 2.760 N/A GLU 564.A N LEU 560.A O no hydrogen 2.929 N/A ASP 565.A N GLN 561.A O no hydrogen 2.952 N/A LEU 568.A N VAL 571.A O no hydrogen 3.071 N/A THR 570.A OG1 THR 570.A O no hydrogen 2.345 N/A PHE 573.A N GLY 566.A O no hydrogen 3.100 N/A ARG 574.A N ASP 572.A OD1 no hydrogen 3.447 N/A THR 576.A N PHE 573.A O no hydrogen 2.572 N/A THR 576.A OG1 PHE 573.A O no hydrogen 2.545 N/A LEU 578.A N GLY 485.A O no hydrogen 2.853 N/A ILE 579.A N VAL 543.A O no hydrogen 2.937 N/A MET 580.A N PHE 487.A O no hydrogen 3.098 N/A THR 581.A N LEU 545.A O no hydrogen 2.988 N/A THR 581.A OG1 ASP 546.A OD1 no hydrogen 2.936 N/A SER 582.A N PHE 489.A O no hydrogen 3.149 N/A ASN 583.A N GLU 549.A OE2 no hydrogen 3.216 N/A SER 587.A OG GLY 585.A O no hydrogen 3.257 N/A GLU 588.A N GLY 585.A O no hydrogen 3.014 N/A MET 593.A N LYS 589.A O no hydrogen 3.351 N/A LEU 596.A N VAL 592.A O no hydrogen 3.090 N/A LYS 597.A N MET 593.A O no hydrogen 3.368 N/A ARG 598.A N GLY 594.A O no hydrogen 3.257 N/A ALA 599.A N GLU 595.A O no hydrogen 3.088 N/A ALA 599.A N LEU 596.A O no hydrogen 3.045 N/A PHE 600.A N LEU 596.A O no hydrogen 3.001 N/A ARG 601.A NE GLU 603.A OE2 no hydrogen 3.085 N/A ARG 601.A NH2 GLU 603.A OE2 no hydrogen 3.117 N/A PHE 604.A N ARG 601.A O no hydrogen 3.274 N/A ILE 605.A N ARG 601.A O no hydrogen 3.360 N/A ASN 606.A N PRO 602.A O no hydrogen 3.081 N/A ARG 607.A N PHE 604.A O no hydrogen 2.903 N/A ARG 607.A NH1 GLU 603.A O no hydrogen 2.414 N/A GLU 610.A N SER 486.A O no hydrogen 3.213 N/A ILE 612.A N ILE 488.A O no hydrogen 2.884 N/A PHE 614.A N LEU 490.A O no hydrogen 2.772 N/A HIS 615.A NE2 GLU 461.A OE1 no hydrogen 1.782 N/A HIS 619.A N GLU 616.A O no hydrogen 2.694 N/A LEU 620.A N GLU 616.A O no hydrogen 3.130 N/A THR 621.A N LYS 617.A O no hydrogen 3.082 N/A GLU 622.A N LYS 618.A O no hydrogen 3.124 N/A ILE 623.A N HIS 619.A O no hydrogen 2.849 N/A VAL 624.A N LEU 620.A O no hydrogen 2.872 N/A SER 625.A N THR 621.A O no hydrogen 3.305 N/A LEU 626.A N GLU 622.A O no hydrogen 3.187 N/A MET 627.A N ILE 623.A O no hydrogen 2.942 N/A SER 628.A N VAL 624.A O no hydrogen 2.764 N/A ASP 629.A N SER 625.A O no hydrogen 2.765 N/A ASP 629.A N LEU 626.A O no hydrogen 3.121 N/A GLN 630.A N LEU 626.A O no hydrogen 3.051 N/A LEU 631.A N MET 627.A O no hydrogen 3.181 N/A THR 632.A N SER 628.A O no hydrogen 2.972 N/A THR 632.A OG1 ASP 629.A O no hydrogen 3.273 N/A LYS 633.A N ASP 629.A O no hydrogen 3.167 N/A ARG 634.A N GLN 630.A O no hydrogen 3.320 N/A LEU 635.A N LEU 631.A O no hydrogen 3.016 N/A LYS 636.A N THR 632.A O no hydrogen 3.304 N/A GLU 637.A N LYS 633.A O no hydrogen 3.418 N/A ASP 639.A N LYS 636.A O no hydrogen 3.143 N/A LEU 640.A N LEU 635.A O no hydrogen 2.917 N/A SER 641.A OG HIS 692.A ND1 no hydrogen 2.860 N/A GLU 643.A N ILE 693.A O no hydrogen 2.969 N/A THR 645.A N LEU 695.A O no hydrogen 3.098 N/A THR 645.A OG1 LEU 695.A O no hydrogen 3.275 N/A THR 645.A OG1 ASP 696.A OD2 no hydrogen 2.991 N/A ALA 648.A N THR 645.A O no hydrogen 2.842 N/A ALA 648.A N THR 645.A OG1 no hydrogen 3.002 N/A LYS 649.A N THR 645.A O no hydrogen 3.219 N/A ALA 650.A N ASP 646.A O no hydrogen 3.154 N/A LYS 651.A N ALA 647.A O no hydrogen 3.349 N/A VAL 652.A N ALA 648.A O no hydrogen 2.997 N/A ALA 653.A N LYS 649.A O no hydrogen 2.962 N/A GLU 654.A N ALA 650.A O no hydrogen 3.106 N/A GLU 655.A N VAL 652.A O no hydrogen 2.948 N/A GLY 656.A N ALA 653.A O no hydrogen 2.912 N/A GLU 660.A N ASP 658.A OD2 no hydrogen 3.024 N/A TYR 661.A N ASP 658.A O no hydrogen 3.054 N/A GLY 662.A N ASP 658.A O no hydrogen 3.138 N/A LEU 666.A N ALA 663.A O no hydrogen 3.479 N/A ARG 667.A N ARG 664.A O no hydrogen 3.399 N/A ARG 667.A NH2 GLN 630.A OE1 no hydrogen 3.481 N/A ARG 668.A NH2 GLN 671.A OE1 no hydrogen 3.281 N/A ALA 669.A N PRO 665.A O no hydrogen 2.956 N/A ILE 670.A N LEU 666.A O no hydrogen 2.798 N/A GLN 671.A N ARG 667.A O no hydrogen 3.142 N/A LYS 672.A N ARG 668.A O no hydrogen 2.908 N/A HIS 673.A N ALA 669.A O no hydrogen 3.025 N/A VAL 674.A N ILE 670.A O no hydrogen 2.862 N/A GLU 675.A N ILE 670.A O no hydrogen 3.402 N/A ASP 676.A N GLN 671.A O no hydrogen 2.611 N/A LEU 678.A N VAL 674.A O no hydrogen 2.838 N/A SER 679.A N GLU 675.A O no hydrogen 3.029 N/A GLU 680.A N ASP 676.A O no hydrogen 3.112 N/A GLU 681.A N LEU 678.A O no hydrogen 3.076 N/A LEU 682.A N LEU 678.A O no hydrogen 2.675 N/A LEU 683.A N SER 679.A O no hydrogen 2.775 N/A ARG 684.A N GLU 680.A O no hydrogen 3.198 N/A GLY 685.A N LEU 682.A O no hydrogen 3.063 N/A ASN 686.A N GLU 681.A O no hydrogen 3.078 N/A LYS 689.A NZ GLN 638.A O no hydrogen 3.307 N/A GLN 691.A N HIS 688.A O no hydrogen 3.260 N/A HIS 692.A ND1 SER 641.A OG no hydrogen 2.860 N/A HIS 692.A NE2 GLU 643.A OE1 no hydrogen 3.145 N/A ILE 693.A N SER 641.A O no hydrogen 3.003 N/A VAL 694.A N LYS 705.A O no hydrogen 2.923 N/A LEU 695.A N GLU 643.A O no hydrogen 2.923 N/A ASP 696.A N VAL 703.A O no hydrogen 2.931 N/A VAL 697.A N ASP 696.A OD2 no hydrogen 2.769 N/A GLU 698.A N GLU 701.A O no hydrogen 2.689 N/A VAL 703.A N ASP 696.A O no hydrogen 2.677 N/A LYS 705.A N VAL 694.A O no hydrogen 2.906 N/A LYS 705.A NZ ASP 696.A OD1 no hydrogen 3.556 N/A LYS 705.A NZ GLU 698.A OE1 no hydrogen 3.476 N/A THR 707.A N HIS 692.A O no hydrogen 3.131 N/A