Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8t12_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N THR 1.A O no hydrogen 3.301 N/A TRP 6.A N LEU 2.A O no hydrogen 2.898 N/A LYS 7.A N GLY 3.A O no hydrogen 2.883 N/A LYS 7.A NZ PRO 145.A O no hydrogen 2.590 N/A ASN 8.A N GLU 4.A O no hydrogen 2.911 N/A ARG 9.A N LYS 5.A O no hydrogen 2.897 N/A ARG 9.A NH1 ARG 9.A O no hydrogen 3.166 N/A LEU 10.A N TRP 6.A O no hydrogen 2.914 N/A ASN 11.A N LYS 7.A O no hydrogen 2.881 N/A ALA 12.A N ASN 8.A O no hydrogen 2.921 N/A LEU 13.A N ASN 11.A O no hydrogen 2.952 N/A PHE 18.A N GLY 14.A O no hydrogen 2.757 N/A GLN 19.A N LYS 15.A O no hydrogen 2.930 N/A ILE 20.A N GLU 17.A O no hydrogen 3.338 N/A TYR 21.A N PHE 18.A O no hydrogen 2.915 N/A SER 24.A OG TYR 21.A O no hydrogen 3.218 N/A SER 24.A OG HIS 240.A ND1 no hydrogen 3.405 N/A GLU 28.A N THR 244.A O no hydrogen 3.368 N/A VAL 29.A N GLU 28.A OE1 no hydrogen 3.286 N/A ASP 30.A N GLU 246.A O no hydrogen 3.167 N/A ARG 31.A NH1 ALA 47.A O no hydrogen 3.062 N/A ARG 31.A NH1 ASP 248.A OD2 no hydrogen 2.794 N/A ARG 31.A NH2 ALA 47.A O no hydrogen 3.545 N/A ARG 31.A NH2 VAL 48.A O no hydrogen 3.499 N/A GLU 36.A N GLU 36.A OE1 no hydrogen 2.778 N/A GLY 37.A N LEU 33.A O no hydrogen 2.927 N/A ILE 38.A N ALA 34.A O no hydrogen 2.912 N/A LYS 39.A N LYS 35.A O no hydrogen 2.905 N/A ARG 40.A N GLU 36.A O no hydrogen 3.467 N/A GLY 41.A N ILE 38.A O no hydrogen 3.067 N/A GLU 42.A N GLY 37.A O no hydrogen 3.335 N/A HIS 45.A ND1 ASP 44.A OD1 no hydrogen 2.769 N/A ARG 50.A NH2 GLU 28.A OE1 no hydrogen 2.864 N/A LEU 55.A N GLY 51.A O no hydrogen 2.949 N/A ARG 56.A N SER 52.A O no hydrogen 2.931 N/A ARG 56.A NH1 GLU 60.A OE1 no hydrogen 3.211 N/A TRP 57.A N ALA 53.A O no hydrogen 2.932 N/A VAL 59.A N LEU 55.A O no hydrogen 2.977 N/A GLU 60.A N ARG 56.A O no hydrogen 2.912 N/A ARG 61.A NH1 TRP 57.A O no hydrogen 3.487 N/A ASN 62.A N VAL 59.A O no hydrogen 2.896 N/A LEU 63.A N PHE 58.A O no hydrogen 3.271 N/A THR 65.A N GLN 170.A OE1 no hydrogen 3.389 N/A THR 65.A OG1 GLN 170.A OE1 no hydrogen 3.541 N/A GLY 68.A N ASN 89.A O no hydrogen 3.301 N/A LYS 69.A NZ LYS 132.A O no hydrogen 3.545 N/A VAL 70.A N GLU 92.A O no hydrogen 2.971 N/A VAL 71.A N THR 135.A O no hydrogen 3.116 N/A ASP 72.A N LYS 94.A O no hydrogen 2.751 N/A LEU 73.A N LEU 137.A O no hydrogen 3.143 N/A GLY 74.A N LEU 96.A O no hydrogen 2.758 N/A CYS 75.A N LEU 96.A O no hydrogen 3.442 N/A CYS 75.A SG GLY 76.A O no hydrogen 3.669 N/A CYS 75.A SG THR 97.A OG1 no hydrogen 2.635 N/A SER 81.A OG GLY 78.A O no hydrogen 3.082 N/A TYR 82.A N GLY 78.A O no hydrogen 3.159 N/A TYR 82.A OH ILE 107.A O no hydrogen 3.112 N/A TYR 83.A N GLY 79.A O no hydrogen 2.952 N/A CYS 84.A N TRP 80.A O no hydrogen 2.923 N/A CYS 84.A SG TRP 80.A O no hydrogen 3.545 N/A GLY 85.A N SER 81.A O no hydrogen 2.931 N/A GLY 86.A N TYR 83.A O no hydrogen 3.396 N/A LEU 87.A N CYS 84.A O no hydrogen 3.232 N/A LYS 91.A N GLY 68.A O no hydrogen 2.865 N/A VAL 93.A N LEU 116.A O no hydrogen 3.191 N/A LYS 94.A N VAL 70.A O no hydrogen 3.116 N/A LYS 94.A NZ GLU 131.A OE1 no hydrogen 3.435 N/A LYS 94.A NZ GLU 131.A OE2 no hydrogen 3.228 N/A GLY 95.A N ARG 118.A O no hydrogen 3.078 N/A LEU 96.A N ASP 72.A O no hydrogen 3.212 N/A HIS 103.A N GLY 100.A O no hydrogen 3.144 N/A HIS 103.A ND1 PRO 101.A O no hydrogen 2.954 N/A SER 110.A N THR 43.A O no hydrogen 3.150 N/A SER 110.A OG THR 43.A O no hydrogen 2.442 N/A ASN 115.A ND2 ARG 256.A O no hydrogen 2.787 N/A ARG 118.A N VAL 93.A O no hydrogen 3.090 N/A GLN 120.A N GLY 95.A O no hydrogen 2.974 N/A GLN 120.A NE2 GLY 95.A O no hydrogen 3.672 N/A VAL 123.A N THR 97.A O no hydrogen 2.945 N/A THR 128.A N VAL 125.A O no hydrogen 3.162 N/A THR 128.A OG1 ASP 124.A O no hydrogen 2.684 N/A THR 128.A OG1 VAL 125.A O no hydrogen 3.563 N/A CYS 133.A SG GLU 131.A O no hydrogen 4.020 N/A ASP 134.A N LYS 69.A O no hydrogen 3.192 N/A THR 135.A N LYS 69.A O no hydrogen 3.063 N/A THR 135.A OG1 GLU 67.A O no hydrogen 3.026 N/A LEU 136.A N GLN 170.A O no hydrogen 2.852 N/A LEU 137.A N VAL 71.A O no hydrogen 3.253 N/A CYS 138.A N CYS 172.A O no hydrogen 3.233 N/A SER 144.A N GLU 150.A OE2 no hydrogen 2.720 N/A THR 148.A N ASN 146.A OD1 no hydrogen 2.625 N/A THR 148.A OG1 ASN 146.A OD1 no hydrogen 3.246 N/A ALA 151.A N PRO 147.A O no hydrogen 2.903 N/A GLY 152.A N THR 148.A O no hydrogen 2.915 N/A ARG 153.A N VAL 149.A O no hydrogen 2.902 N/A ARG 153.A NH1 GLU 142.A O no hydrogen 3.220 N/A THR 154.A N GLU 150.A O no hydrogen 2.911 N/A THR 154.A OG1 GLU 150.A O no hydrogen 2.865 N/A LEU 155.A N ALA 151.A O no hydrogen 2.918 N/A ARG 156.A N GLY 152.A O no hydrogen 2.917 N/A VAL 157.A N ARG 153.A O no hydrogen 2.921 N/A LEU 158.A N THR 154.A O no hydrogen 2.922 N/A ASN 159.A N LEU 155.A O no hydrogen 2.913 N/A LEU 160.A N ARG 156.A O no hydrogen 2.911 N/A VAL 161.A N VAL 157.A O no hydrogen 2.907 N/A GLU 162.A N LEU 158.A O no hydrogen 2.927 N/A TRP 164.A N VAL 161.A O no hydrogen 3.109 N/A GLN 170.A N ASP 134.A O no hydrogen 3.275 N/A PHE 171.A N SER 215.A OG no hydrogen 2.752 N/A CYS 172.A N LEU 136.A O no hydrogen 3.046 N/A ILE 173.A N TRP 213.A O no hydrogen 3.110 N/A LYS 174.A N CYS 138.A O no hydrogen 3.163 N/A VAL 175.A N MET 211.A O no hydrogen 3.059 N/A ASN 177.A ND2 GLU 150.A OE1 no hydrogen 2.748 N/A ASN 177.A ND2 TYR 179.A OH no hydrogen 2.765 N/A VAL 183.A N MET 180.A O no hydrogen 3.188 N/A GLU 185.A N PRO 181.A O no hydrogen 2.940 N/A MET 187.A N VAL 183.A O no hydrogen 2.909 N/A GLU 188.A N ILE 184.A O no hydrogen 2.963 N/A GLU 188.A N GLU 185.A O no hydrogen 3.274 N/A LEU 190.A N LYS 186.A O no hydrogen 3.510 N/A GLN 191.A N MET 187.A O no hydrogen 2.902 N/A ARG 192.A N GLU 188.A O no hydrogen 2.936 N/A LYS 193.A N ALA 189.A O no hydrogen 2.909 N/A TYR 194.A N LEU 190.A O no hydrogen 2.911 N/A GLY 195.A N GLN 191.A O no hydrogen 2.840 N/A VAL 199.A N TYR 212.A O no hydrogen 3.255 N/A ASN 201.A ND2 LYS 54.A O no hydrogen 3.310 N/A SER 204.A N ASN 201.A O no hydrogen 3.191 N/A SER 204.A OG ASN 201.A O no hydrogen 2.297 N/A GLU 210.A N THR 208.A OG1 no hydrogen 3.043 N/A MET 211.A N VAL 175.A O no hydrogen 2.887 N/A TYR 212.A N VAL 199.A O no hydrogen 3.308 N/A TRP 213.A N ILE 173.A O no hydrogen 2.691 N/A VAL 214.A N ALA 197.A O no hydrogen 3.223 N/A SER 215.A OG PHE 171.A O no hydrogen 3.066 N/A SER 223.A N ASN 220.A OD1 no hydrogen 2.918 N/A SER 223.A OG ASN 220.A O no hydrogen 3.341 N/A SER 223.A OG ASN 220.A OD1 no hydrogen 2.862 N/A SER 224.A OG ASN 220.A O no hydrogen 2.507 N/A VAL 225.A N ILE 221.A O no hydrogen 2.926 N/A ASN 226.A N VAL 222.A O no hydrogen 2.915 N/A MET 227.A N SER 223.A O no hydrogen 2.928 N/A ILE 228.A N SER 224.A O no hydrogen 2.953 N/A SER 229.A N VAL 225.A O no hydrogen 2.922 N/A SER 229.A OG VAL 225.A O no hydrogen 3.247 N/A SER 229.A OG ASN 226.A O no hydrogen 2.637 N/A ARG 230.A N ASN 226.A O no hydrogen 2.904 N/A MET 231.A N MET 227.A O no hydrogen 2.957 N/A LEU 232.A N ILE 228.A O no hydrogen 2.898 N/A ILE 233.A N SER 229.A O no hydrogen 2.945 N/A ASN 234.A N ARG 230.A O no hydrogen 2.936 N/A ASN 234.A N MET 231.A O no hydrogen 3.249 N/A ARG 235.A N LEU 232.A O no hydrogen 3.288 N/A THR 237.A N ARG 235.A O no hydrogen 2.772 N/A THR 237.A OG1 ASN 234.A O no hydrogen 2.567 N/A LYS 241.A NZ LYS 242.A O no hydrogen 2.975 N/A GLU 246.A N GLU 28.A O no hydrogen 2.725 N/A THR 255.A OG1 ASP 290.A O no hydrogen 3.155 N/A ARG 256.A N ASN 115.A OD1 no hydrogen 3.228 N/A ARG 256.A NH1 VAL 90.A O no hydrogen 3.508 N/A ILE 269.A N ASN 266.A O no hydrogen 3.353 N/A GLY 271.A N LEU 267.A O no hydrogen 2.909 N/A LYS 272.A NZ GLU 441.A OE1 no hydrogen 2.370 N/A ARG 273.A NH1 CYS 443.A O no hydrogen 3.030 N/A ARG 273.A NH2 LEU 564.A O no hydrogen 3.380 N/A ILE 274.A N ILE 270.A O no hydrogen 3.012 N/A GLU 275.A N GLY 271.A O no hydrogen 2.912 N/A LYS 276.A N LYS 272.A O no hydrogen 2.946 N/A ILE 277.A N ARG 273.A O no hydrogen 3.013 N/A LYS 278.A N ILE 274.A O no hydrogen 2.944 N/A GLN 279.A N GLU 275.A O no hydrogen 2.932 N/A GLU 280.A N LYS 276.A O no hydrogen 2.993 N/A GLU 280.A N ILE 277.A O no hydrogen 3.236 N/A HIS 286.A N SER 301.A O no hydrogen 3.302 N/A ASP 290.A N ASP 288.A OD1 no hydrogen 3.248 N/A TYR 293.A OH ASP 584.A OD2 no hydrogen 2.585 N/A THR 295.A OG1 ASP 353.A OD1 no hydrogen 2.486 N/A ALA 297.A N SER 587.A O no hydrogen 3.426 N/A SER 301.A N HIS 286.A O no hydrogen 3.366 N/A SER 301.A OG TYR 298.A OH no hydrogen 3.225 N/A TYR 302.A N MET 583.A O no hydrogen 3.204 N/A THR 304.A N THR 581.A O no hydrogen 3.383 N/A SER 311.A N THR 337.A O no hydrogen 3.132 N/A SER 311.A OG ALA 310.A O no hydrogen 2.316 N/A SER 312.A OG MET 313.A O no hydrogen 3.352 N/A SER 312.A OG SER 734.A O no hydrogen 2.955 N/A ASN 315.A N ARG 732.A O no hydrogen 2.748 N/A ARG 319.A N ASN 315.A O no hydrogen 3.172 N/A THR 322.A OG1 THR 322.A O no hydrogen 2.383 N/A TRP 325.A N THR 322.A O no hydrogen 3.266 N/A ASP 326.A N LYS 323.A O no hydrogen 3.301 N/A THR 332.A OG1 PRO 329.A O no hydrogen 3.406 N/A GLN 333.A N PRO 329.A O no hydrogen 2.842 N/A ALA 335.A N THR 332.A O no hydrogen 3.252 N/A THR 339.A N SER 309.A O no hydrogen 3.083 N/A THR 339.A OG1 THR 339.A O no hydrogen 2.446 N/A THR 339.A OG1 GLY 449.A O no hydrogen 3.385 N/A THR 340.A N ASP 338.A OD1 no hydrogen 2.746 N/A THR 340.A OG1 ASP 338.A OD1 no hydrogen 2.692 N/A THR 340.A OG1 ASP 338.A OD2 no hydrogen 3.242 N/A GLN 344.A N THR 340.A O no hydrogen 2.969 N/A GLN 344.A NE2 THR 339.A O no hydrogen 3.039 N/A GLN 345.A N PRO 341.A O no hydrogen 2.920 N/A GLN 345.A NE2 GLN 574.A O no hydrogen 2.749 N/A ARG 346.A N PHE 342.A O no hydrogen 2.943 N/A VAL 347.A N GLY 343.A O no hydrogen 2.953 N/A PHE 348.A N GLN 344.A O no hydrogen 2.928 N/A LYS 349.A N GLN 345.A O no hydrogen 2.924 N/A GLU 350.A N ARG 346.A O no hydrogen 2.943 N/A LYS 351.A N VAL 347.A O no hydrogen 2.960 N/A ASP 353.A N PHE 348.A O no hydrogen 3.207 N/A ARG 355.A NH2 SER 262.A OG no hydrogen 2.372 N/A GLU 358.A N GLU 358.A OE2 no hydrogen 2.196 N/A THR 363.A OG1 LYS 360.A O no hydrogen 2.614 N/A LYS 364.A N LYS 360.A O no hydrogen 3.137 N/A LYS 365.A N GLU 361.A O no hydrogen 2.963 N/A LEU 366.A N GLY 362.A O no hydrogen 2.952 N/A MET 367.A N THR 363.A O no hydrogen 2.936 N/A LYS 368.A N LYS 364.A O no hydrogen 2.960 N/A ILE 369.A N LYS 365.A O no hydrogen 2.990 N/A THR 370.A N LEU 366.A O no hydrogen 2.970 N/A THR 370.A OG1 LEU 366.A O no hydrogen 2.734 N/A ALA 371.A N MET 367.A O no hydrogen 2.912 N/A GLU 372.A N LYS 368.A O no hydrogen 3.010 N/A TRP 373.A N ILE 369.A O no hydrogen 3.010 N/A LEU 374.A N THR 370.A O no hydrogen 2.914 N/A TRP 375.A N ALA 371.A O no hydrogen 2.941 N/A LYS 376.A N GLU 372.A O no hydrogen 3.021 N/A LYS 376.A NZ GLU 372.A OE2 no hydrogen 3.490 N/A GLU 377.A N TRP 373.A O no hydrogen 2.903 N/A LEU 378.A N LEU 374.A O no hydrogen 2.957 N/A LYS 380.A NZ GLU 377.A OE2 no hydrogen 2.817 N/A THR 393.A N ARG 389.A O no hydrogen 2.922 N/A THR 393.A OG1 ARG 389.A O no hydrogen 3.502 N/A ARG 394.A N GLU 390.A O no hydrogen 2.905 N/A LYS 395.A N GLU 391.A O no hydrogen 2.897 N/A VAL 396.A N PHE 392.A O no hydrogen 2.938 N/A ARG 397.A N THR 393.A O no hydrogen 2.918 N/A SER 398.A N ARG 394.A O no hydrogen 3.224 N/A SER 398.A OG SER 398.A O no hydrogen 2.338 N/A ASN 399.A N VAL 396.A O no hydrogen 3.450 N/A ALA 400.A N LYS 395.A O no hydrogen 3.166 N/A LEU 402.A N ALA 400.A O no hydrogen 2.714 N/A THR 407.A OG1 LYS 413.A O no hydrogen 3.551 N/A TRP 412.A N ASP 408.A O no hydrogen 3.359 N/A GLU 417.A N SER 414.A OG no hydrogen 3.231 N/A ALA 418.A N SER 414.A O no hydrogen 2.987 N/A VAL 419.A N ALA 415.A O no hydrogen 2.925 N/A PHE 424.A N ASP 421.A OD1 no hydrogen 3.217 N/A TRP 425.A NE1 VAL 419.A O no hydrogen 2.940 N/A GLU 426.A N SER 422.A O no hydrogen 2.941 N/A LEU 427.A N GLY 423.A O no hydrogen 2.938 N/A VAL 428.A N PHE 424.A O no hydrogen 2.967 N/A ASP 429.A N TRP 425.A O no hydrogen 2.899 N/A LYS 430.A N GLU 426.A O no hydrogen 2.956 N/A GLU 431.A N LEU 427.A O no hydrogen 2.996 N/A ARG 432.A N VAL 428.A O no hydrogen 2.918 N/A ARG 432.A NE GLU 480.A OE2 no hydrogen 3.235 N/A ASN 433.A N ASP 429.A O no hydrogen 2.948 N/A LEU 434.A N LYS 430.A O no hydrogen 2.986 N/A HIS 435.A N GLU 431.A O no hydrogen 2.866 N/A LEU 436.A N ARG 432.A O no hydrogen 2.970 N/A GLU 437.A N LEU 434.A O no hydrogen 3.252 N/A GLY 438.A N HIS 435.A O no hydrogen 2.944 N/A LYS 439.A N LEU 434.A O no hydrogen 3.377 N/A CYS 440.A SG HIS 435.A NE2 no hydrogen 2.608 N/A GLU 441.A N GLU 431.A OE2 no hydrogen 3.237 N/A THR 442.A N GLU 431.A OE2 no hydrogen 2.942 N/A THR 442.A OG1 GLU 431.A OE2 no hydrogen 2.925 N/A CYS 443.A SG HIS 435.A NE2 no hydrogen 3.843 N/A TYR 445.A N VAL 570.A O no hydrogen 3.072 N/A TYR 445.A OH GLY 593.A O no hydrogen 3.045 N/A ASN 446.A N TYR 469.A O no hydrogen 3.030 N/A MET 447.A N ARG 572.A O no hydrogen 3.267 N/A MET 448.A N ILE 467.A O no hydrogen 3.292 N/A LYS 453.A NZ GLU 452.A O no hydrogen 3.041 N/A SER 464.A OG GLY 463.A O no hydrogen 2.543 N/A TYR 469.A N ASN 446.A O no hydrogen 2.696 N/A ARG 475.A N TRP 471.A O no hydrogen 3.174 N/A ARG 475.A NH2 ALA 404.A O no hydrogen 2.885 N/A PHE 476.A N LEU 472.A O no hydrogen 2.943 N/A LEU 477.A N GLY 473.A O no hydrogen 2.941 N/A GLU 478.A N ALA 474.A O no hydrogen 2.950 N/A PHE 479.A N ARG 475.A O no hydrogen 2.925 N/A GLU 480.A N PHE 476.A O no hydrogen 2.882 N/A ALA 481.A N LEU 477.A O no hydrogen 2.972 N/A LEU 482.A N GLU 478.A O no hydrogen 2.938 N/A ASN 486.A N GLY 483.A O no hydrogen 3.264 N/A GLU 487.A N GLY 483.A O no hydrogen 2.924 N/A ASP 488.A N PHE 484.A O no hydrogen 3.278 N/A HIS 489.A N ASN 486.A O no hydrogen 3.424 N/A TRP 490.A N LEU 485.A O no hydrogen 3.203 N/A SER 492.A OG HIS 489.A O no hydrogen 3.402 N/A ASN 495.A ND2 LEU 378.A O no hydrogen 3.368 N/A ASN 495.A ND2 TRP 490.A O no hydrogen 2.873 N/A SER 496.A N SER 492.A O no hydrogen 3.046 N/A SER 496.A OG SER 492.A O no hydrogen 3.211 N/A SER 498.A OG LEU 648.A O no hydrogen 2.543 N/A GLU 503.A N VAL 500.A O no hydrogen 3.227 N/A LYS 507.A N GLY 504.A O no hydrogen 3.423 N/A LEU 512.A N LEU 508.A O no hydrogen 2.967 N/A ARG 513.A N GLY 509.A O no hydrogen 2.909 N/A ASP 514.A N TYR 510.A O no hydrogen 2.927 N/A VAL 515.A N ILE 511.A O no hydrogen 2.971 N/A SER 516.A N LEU 512.A O no hydrogen 3.313 N/A SER 516.A N ARG 513.A O no hydrogen 3.094 N/A SER 516.A OG ARG 513.A O no hydrogen 2.816 N/A LYS 517.A N ASP 514.A O no hydrogen 3.315 N/A LYS 518.A N VAL 515.A O no hydrogen 3.456 N/A GLY 521.A N PRO 662.A O no hydrogen 3.481 N/A MET 523.A N TRP 693.A O.A no hydrogen 3.350 N/A MET 523.A N TRP 693.A O.B no hydrogen 3.351 N/A TYR 524.A N VAL 660.A O no hydrogen 2.998 N/A THR 533.A OG1 GLY 530.A O no hydrogen 3.296 N/A ARG 534.A N TRP 531.A O no hydrogen 3.203 N/A LYS 541.A N LEU 537.A O no hydrogen 2.957 N/A ASN 542.A N GLU 538.A O no hydrogen 2.918 N/A GLU 543.A N ASP 539.A O no hydrogen 2.916 N/A GLU 544.A N LEU 540.A O no hydrogen 2.948 N/A MET 545.A N ASN 542.A O no hydrogen 3.315 N/A THR 547.A N GLU 544.A O no hydrogen 3.448 N/A THR 547.A OG1 GLU 544.A O no hydrogen 3.552 N/A HIS 549.A N VAL 546.A O no hydrogen 3.280 N/A MET 550.A N THR 547.A O no hydrogen 3.140 N/A LYS 556.A N GLY 552.A O no hydrogen 2.948 N/A LEU 557.A N GLU 553.A O no hydrogen 2.903 N/A ALA 558.A N HIS 554.A O no hydrogen 2.961 N/A GLU 559.A N LYS 555.A O no hydrogen 2.939 N/A ALA 560.A N LYS 556.A O no hydrogen 2.943 N/A ILE 561.A N LEU 557.A O no hydrogen 2.958 N/A PHE 562.A N ALA 558.A O no hydrogen 2.935 N/A LYS 563.A N GLU 559.A O no hydrogen 2.929 N/A LEU 564.A N ALA 560.A O no hydrogen 2.942 N/A LYS 569.A N ARG 588.A O no hydrogen 3.162 N/A LYS 569.A NZ ASP 590.A O no hydrogen 2.625 N/A VAL 571.A N ILE 586.A O no hydrogen 3.038 N/A ARG 572.A N TYR 445.A O no hydrogen 3.444 N/A ARG 572.A NE ASN 446.A OD1 no hydrogen 3.429 N/A VAL 573.A N ASP 584.A O no hydrogen 3.135 N/A ARG 575.A N VAL 582.A O no hydrogen 3.025 N/A THR 577.A N GLY 580.A O no hydrogen 3.223 N/A GLY 580.A N THR 577.A O no hydrogen 3.182 N/A VAL 582.A N ARG 575.A O no hydrogen 3.228 N/A MET 583.A N TYR 302.A O no hydrogen 3.054 N/A ASP 584.A N VAL 573.A O no hydrogen 2.890 N/A ILE 585.A N GLY 300.A O no hydrogen 3.334 N/A ILE 586.A N VAL 571.A O no hydrogen 3.076 N/A ARG 588.A N LYS 569.A O no hydrogen 3.413 N/A ARG 588.A NE ASP 590.A OD1 no hydrogen 3.031 N/A ARG 588.A NH2 ASP 590.A OD2 no hydrogen 3.460 N/A GLN 591.A N ILE 535.A O no hydrogen 3.414 N/A GLN 591.A NE2 VAL 352.A O no hydrogen 3.482 N/A ARG 592.A NE ASN 603.A OD1 no hydrogen 3.329 N/A ARG 592.A NH1 GLU 543.A OE1 no hydrogen 3.058 N/A ARG 592.A NH2 GLU 543.A OE1 no hydrogen 3.373 N/A ARG 592.A NH2 GLU 543.A OE2 no hydrogen 3.151 N/A ARG 592.A NH2 ASN 603.A OD1 no hydrogen 3.414 N/A SER 594.A OG GLY 593.A O no hydrogen 2.539 N/A THR 599.A N GLY 595.A O no hydrogen 3.024 N/A THR 599.A OG1 GLY 595.A O no hydrogen 2.377 N/A TYR 600.A N GLN 596.A O no hydrogen 2.905 N/A GLY 601.A N VAL 597.A O no hydrogen 2.973 N/A LEU 602.A N VAL 598.A O no hydrogen 2.966 N/A ASN 603.A N THR 599.A O no hydrogen 2.900 N/A THR 604.A N TYR 600.A O no hydrogen 2.987 N/A THR 604.A OG1 TYR 600.A O no hydrogen 2.930 N/A THR 604.A OG1 SER 654.A O no hydrogen 3.003 N/A PHE 605.A N GLY 601.A O no hydrogen 3.017 N/A THR 606.A N LEU 602.A O no hydrogen 2.971 N/A THR 606.A OG1 GLU 543.A OE2 no hydrogen 2.339 N/A THR 606.A OG1 LEU 602.A O no hydrogen 3.436 N/A ASN 607.A N ASN 603.A O no hydrogen 2.938 N/A ASN 607.A ND2 GLY 655.A O no hydrogen 3.584 N/A MET 608.A N THR 604.A O no hydrogen 2.988 N/A GLU 609.A N PHE 605.A O no hydrogen 3.028 N/A ALA 610.A N THR 606.A O no hydrogen 2.965 N/A GLN 611.A N ASN 607.A O no hydrogen 2.978 N/A LEU 612.A N MET 608.A O no hydrogen 2.989 N/A ILE 613.A N GLU 609.A O no hydrogen 3.011 N/A ARG 614.A N ALA 610.A O no hydrogen 2.970 N/A ARG 614.A NE ALA 670.A O no hydrogen 3.334 N/A GLN 615.A N GLN 611.A O no hydrogen 2.954 N/A MET 616.A N LEU 612.A O no hydrogen 2.906 N/A GLU 617.A N ILE 613.A O no hydrogen 2.959 N/A GLY 618.A N ARG 614.A O no hydrogen 2.959 N/A GLU 619.A N GLN 615.A O no hydrogen 3.334 N/A GLU 619.A N MET 616.A O no hydrogen 3.274 N/A GLY 620.A N GLU 617.A O no hydrogen 3.139 N/A THR 629.A OG1 VAL 630.A O no hydrogen 2.821 N/A THR 629.A OG1 GLU 632.A OE1 no hydrogen 3.141 N/A THR 631.A OG1 VAL 630.A O no hydrogen 2.235 N/A GLU 632.A N THR 629.A O no hydrogen 3.417 N/A VAL 636.A N GLU 632.A O no hydrogen 2.825 N/A LYS 637.A N GLU 633.A O no hydrogen 3.081 N/A ASN 638.A N ILE 634.A O no hydrogen 2.874 N/A TRP 639.A N ALA 635.A O no hydrogen 3.059 N/A LEU 640.A N VAL 636.A O no hydrogen 3.204 N/A VAL 641.A N LYS 637.A O no hydrogen 3.250 N/A ARG 642.A N ASN 638.A O no hydrogen 3.014 N/A VAL 643.A N TRP 639.A O no hydrogen 3.232 N/A ARG 645.A NE GLU 377.A OE1 no hydrogen 3.378 N/A ARG 647.A N VAL 643.A O no hydrogen 3.338 N/A ARG 647.A NH2 GLU 619.A OE2 no hydrogen 2.754 N/A LEU 648.A N GLY 644.A O no hydrogen 3.396 N/A SER 649.A N GLU 646.A O no hydrogen 3.359 N/A SER 649.A OG GLU 646.A O no hydrogen 2.900 N/A ARG 650.A N ARG 647.A O no hydrogen 3.334 N/A ARG 650.A NH1 GLU 519.A O no hydrogen 3.091 N/A ARG 650.A NH1 LYS 661.A O no hydrogen 3.238 N/A ARG 650.A NH2 GLU 519.A O no hydrogen 3.093 N/A ALA 652.A N VAL 659.A O no hydrogen 3.283 N/A ILE 653.A N SER 498.A O no hydrogen 3.266 N/A SER 654.A N ASP 657.A O no hydrogen 3.363 N/A ASP 656.A N ASP 656.A OD1 no hydrogen 2.477 N/A CYS 658.A SG ASP 526.A O no hydrogen 3.748 N/A VAL 660.A N TYR 524.A O no hydrogen 3.158 N/A LYS 661.A N ARG 650.A O no hydrogen 3.445 N/A LYS 661.A NZ LYS 518.A O no hydrogen 3.471 N/A ASP 665.A N ASP 664.A OD1 no hydrogen 2.618 N/A PHE 667.A N ASP 664.A O no hydrogen 3.337 N/A ALA 668.A N ASP 665.A O no hydrogen 3.410 N/A SER 669.A N ARG 666.A O no hydrogen 3.279 N/A SER 669.A OG ARG 666.A O no hydrogen 3.033 N/A THR 672.A OG1 GLU 617.A OE2 no hydrogen 2.532 N/A ALA 673.A N GLU 617.A OE1 no hydrogen 3.316 N/A ASN 675.A N LEU 671.A O no hydrogen 3.371 N/A ASN 675.A ND2 GLN 686.A O no hydrogen 3.518 N/A ASP 676.A N THR 672.A O no hydrogen 2.929 N/A MET 677.A N ALA 673.A O no hydrogen 3.236 N/A GLY 678.A N ASN 675.A O no hydrogen 3.297 N/A LYS 679.A NZ ASP 539.A OD2 no hydrogen 3.439 N/A VAL 680.A N GLY 678.A O no hydrogen 2.754 N/A ARG 681.A NH1 GLU 688.A O no hydrogen 3.033 N/A ARG 681.A NH1 SER 690.A OG no hydrogen 3.318 N/A ARG 681.A NH2 GLN 686.A O no hydrogen 2.938 N/A ARG 681.A NH2 GLU 688.A O no hydrogen 3.247 N/A GLU 688.A N GLN 685.A O no hydrogen 3.229 N/A SER 690.A OG ASP 526.A OD1 no hydrogen 3.268 N/A SER 690.A OG ASP 526.A OD2 no hydrogen 2.327 N/A TRP 693.A N.A MET 523.A O no hydrogen 3.245 N/A TRP 693.A N.B MET 523.A O no hydrogen 3.253 N/A THR 697.A OG1 ASP 695.A OD2 no hydrogen 2.890 N/A PHE 701.A N HIS 704.A O no hydrogen 3.140 N/A HIS 704.A ND1 CYS 702.A O no hydrogen 2.705 N/A HIS 704.A NE2 TYR 759.A OH no hydrogen 3.169 N/A HIS 705.A N CYS 721.A O no hydrogen 3.363 N/A LEU 709.A N LEU 717.A O no hydrogen 2.894 N/A MET 711.A N ARG 715.A O no hydrogen 2.921 N/A LYS 712.A NZ GLU 828.A O no hydrogen 3.363 N/A ARG 715.A N ASP 713.A OD1 no hydrogen 2.866 N/A ARG 715.A NE ASP 713.A OD2 no hydrogen 2.866 N/A ARG 715.A NH1 THR 821.A O no hydrogen 2.895 N/A ARG 715.A NH2 THR 821.A O no hydrogen 2.717 N/A LEU 717.A N LEU 709.A O no hydrogen 3.011 N/A VAL 719.A N HIS 707.A O no hydrogen 3.242 N/A CYS 721.A SG HIS 705.A NE2 no hydrogen 3.018 N/A CYS 721.A SG HIS 707.A NE2 no hydrogen 3.490 N/A CYS 721.A SG ARG 722.A O no hydrogen 3.559 N/A ARG 722.A NE GLU 726.A OE1 no hydrogen 3.262 N/A ARG 722.A NH2 GLU 726.A OE1 no hydrogen 2.619 N/A GLN 724.A N CYS 840.A O no hydrogen 3.393 N/A GLN 724.A NE2 ASP 764.A OD2 no hydrogen 2.876 N/A GLU 726.A N ASN 723.A O no hydrogen 3.003 N/A ILE 728.A N GLN 724.A O no hydrogen 2.964 N/A GLY 729.A N ASP 725.A O no hydrogen 2.888 N/A ARG 730.A N GLU 726.A O no hydrogen 2.922 N/A ALA 731.A N LEU 727.A O no hydrogen 2.941 N/A ARG 732.A NE THR 322.A OG1 no hydrogen 2.860 N/A ARG 732.A NH2 THR 322.A O no hydrogen 3.152 N/A ARG 732.A NH2 THR 322.A OG1 no hydrogen 2.912 N/A ARG 732.A NH2 ASP 326.A OD1 no hydrogen 2.572 N/A ILE 733.A N ARG 730.A O no hydrogen 3.244 N/A SER 734.A N MET 313.A O no hydrogen 3.089 N/A GLY 736.A N SER 734.A OG no hydrogen 3.291 N/A SER 740.A OG GLU 743.A OE1 no hydrogen 3.103 N/A ARG 742.A N SER 740.A OG no hydrogen 3.057 N/A ALA 745.A N LEU 741.A O no hydrogen 2.929 N/A CYS 746.A N ARG 742.A O no hydrogen 2.889 N/A CYS 746.A SG VAL 781.A O no hydrogen 3.272 N/A LEU 747.A N GLU 743.A O no hydrogen 2.938 N/A GLY 748.A N THR 744.A O no hydrogen 2.932 N/A LYS 749.A N ALA 745.A O no hydrogen 2.949 N/A SER 750.A N CYS 746.A O no hydrogen 2.818 N/A SER 750.A OG PRO 782.A O no hydrogen 3.493 N/A TYR 751.A N LEU 747.A O no hydrogen 3.069 N/A TYR 751.A OH ALA 731.A O no hydrogen 2.251 N/A GLN 753.A NE2 LYS 749.A O no hydrogen 3.285 N/A LEU 757.A N GLN 753.A O no hydrogen 2.955 N/A LEU 757.A N MET 754.A O no hydrogen 3.268 N/A MET 758.A N MET 754.A O no hydrogen 2.888 N/A TYR 759.A OH HIS 704.A NE2 no hydrogen 3.169 N/A HIS 761.A NE2 PRO 720.A O no hydrogen 2.854 N/A ARG 762.A NH2 ASP 837.A OD1 no hydrogen 3.372 N/A ARG 763.A N ASP 837.A OD2 no hydrogen 3.214 N/A ARG 763.A NH1 GLY 833.A O no hydrogen 2.648 N/A ARG 763.A NH1 ASP 837.A OD2 no hydrogen 3.299 N/A ARG 763.A NH2 GLY 833.A O no hydrogen 2.617 N/A ARG 766.A N ARG 762.A O no hydrogen 3.427 N/A ARG 766.A NE PHE 760.A O no hydrogen 3.306 N/A ARG 766.A NH2 PHE 760.A O no hydrogen 3.514 N/A CYS 773.A SG ALA 769.A O no hydrogen 3.942 N/A CYS 773.A SG ASN 770.A O no hydrogen 3.253 N/A SER 774.A N ASN 770.A O no hydrogen 2.903 N/A SER 774.A OG ASN 770.A O no hydrogen 3.200 N/A ALA 775.A N ILE 772.A O no hydrogen 3.252 N/A VAL 776.A N ILE 772.A O no hydrogen 3.384 N/A HIS 779.A ND1 HIS 779.A O no hydrogen 3.157 N/A THR 783.A N VAL 781.A O no hydrogen 3.093 N/A SER 784.A OG THR 783.A O no hydrogen 2.609 N/A THR 793.A N HIS 791.A O no hydrogen 2.914 N/A THR 798.A OG1 GLU 800.A OE1 no hydrogen 2.208 N/A GLU 800.A N GLU 800.A OE1 no hydrogen 2.545 N/A THR 804.A OG1 ASP 801.A OD1 no hydrogen 2.488 N/A THR 804.A OG1 ASP 801.A OD2 no hydrogen 3.416 N/A TRP 806.A N MET 802.A O no hydrogen 2.906 N/A ASN 807.A N LEU 803.A O no hydrogen 2.958 N/A ASN 807.A ND2 LEU 803.A O no hydrogen 3.550 N/A ASN 807.A ND2 VAL 823.A O no hydrogen 2.965 N/A ARG 808.A N THR 804.A O no hydrogen 2.909 N/A VAL 809.A N VAL 805.A O no hydrogen 2.906 N/A TRP 810.A N TRP 806.A O no hydrogen 2.948 N/A ILE 811.A N ASN 807.A O no hydrogen 3.312 N/A ASN 814.A ND2 TYR 510.A OH no hydrogen 3.494 N/A MET 817.A N ASN 814.A O no hydrogen 3.101 N/A LYS 820.A NZ ILE 811.A O no hydrogen 3.420 N/A LYS 820.A NZ GLN 812.A O no hydrogen 3.129 N/A THR 821.A OG1 ASP 819.A OD1 no hydrogen 3.399 N/A VAL 823.A N ASN 807.A OD1 no hydrogen 3.377 N/A SER 825.A OG GLU 828.A OE2 no hydrogen 3.230 N/A GLU 827.A N SER 825.A OG no hydrogen 3.403 N/A LYS 834.A NZ LYS 834.A O no hydrogen 2.318 N/A LYS 834.A NZ GLN 838.A OE1 no hydrogen 3.377 N/A TRP 839.A N ARG 835.A O no hydrogen 2.913 N/A CYS 840.A N GLU 836.A O no hydrogen 3.142 N/A CYS 840.A SG HIS 705.A NE2 no hydrogen 3.719 N/A CYS 840.A SG HIS 707.A NE2 no hydrogen 3.822 N/A CYS 840.A SG GLU 836.A O no hydrogen 3.638 N/A GLY 841.A N GLN 838.A O no hydrogen 3.294 N/A SER 842.A N ASP 837.A O no hydrogen 3.053 N/A ARG 849.A N LEU 846.A O no hydrogen 2.257 N/A THR 851.A N THR 847.A O no hydrogen 2.937 N/A THR 851.A N SER 848.A O no hydrogen 3.223 N/A TRP 852.A N SER 848.A O no hydrogen 2.883 N/A ALA 853.A N ARG 849.A O no hydrogen 2.829 N/A ASN 855.A N TRP 852.A O no hydrogen 2.338 N/A THR 858.A N ILE 856.A O no hydrogen 2.299 N/A THR 858.A OG1 GLN 857.A OE1 no hydrogen 2.591 N/A GLN 862.A N ALA 859.A O no hydrogen 3.357 N/A VAL 863.A N ALA 859.A O no hydrogen 2.869 N/A ARG 864.A N ILE 860.A O no hydrogen 3.061 N/A ARG 864.A NH1 ASN 861.A OD1 no hydrogen 2.681 N/A ARG 864.A NH2 ASN 861.A OD1 no hydrogen 2.956 N/A LEU 866.A N GLN 862.A O no hydrogen 2.937 N/A GLY 868.A N SER 865.A O no hydrogen 3.191 N/A GLU 870.A N GLU 870.A OE1 no hydrogen 2.538 N/A THR 873.A OG1 TYR 872.A O no hydrogen 2.845 N/A MET 876.A N ASP 874.A OD1 no hydrogen 2.987 N/A