Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9mj5_S.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N VAL 165.A O no hydrogen 2.958 N/A PHE 7.A N LEU 163.A O no hydrogen 2.950 N/A TYR 8.A N LYS 28.A O no hydrogen 2.913 N/A LEU 10.A N PHE 26.A O no hydrogen 2.887 N/A ASP 11.A N PHE 26.A O no hydrogen 3.436 N/A ALA 12.A N ASP 11.A OD1 no hydrogen 2.769 N/A TYR 13.A N PHE 24.A O no hydrogen 3.279 N/A TYR 17.A N ASP 15.A OD1 no hydrogen 3.235 N/A VAL 23.A N VAL 44.A O no hydrogen 2.907 N/A PHE 24.A N TYR 13.A O no hydrogen 2.878 N/A LEU 25.A N VAL 42.A O no hydrogen 2.871 N/A PHE 26.A N ASP 11.A O no hydrogen 3.075 N/A GLY 27.A N CYS 40.A O no hydrogen 2.935 N/A LYS 28.A N TYR 8.A O no hydrogen 2.907 N/A VAL 29.A N VAL 38.A O no hydrogen 2.892 N/A TRP 30.A NE1 GLU 32.A OE1 no hydrogen 2.867 N/A ILE 31.A N THR 36.A O no hydrogen 2.928 N/A THR 36.A N ILE 31.A O no hydrogen 3.359 N/A VAL 38.A N VAL 29.A O no hydrogen 2.917 N/A SER 39.A OG ASP 294.A OD2 no hydrogen 3.360 N/A CYS 40.A N GLY 27.A O no hydrogen 2.867 N/A CYS 40.A SG VAL 180.A O no hydrogen 3.840 N/A CYS 41.A N VAL 180.A O no hydrogen 3.176 N/A VAL 42.A N LEU 25.A O no hydrogen 2.896 N/A VAL 44.A N VAL 23.A O no hydrogen 2.902 N/A ARG 49.A N TYR 121.A O no hydrogen 2.916 N/A ARG 49.A NH2 ALA 123.A O no hydrogen 3.119 N/A LEU 51.A N VAL 119.A O no hydrogen 2.897 N/A TYR 52.A N PHE 141.A O no hydrogen 2.964 N/A TYR 52.A OH GLU 118.A OE1 no hydrogen 3.388 N/A PHE 53.A N LEU 117.A O no hydrogen 2.895 N/A LEU 54.A N HIS 139.A O no hydrogen 2.961 N/A ARG 56.A N THR 136.A O no hydrogen 2.876 N/A ASP 61.A N LYS 66.A O no hydrogen 3.331 N/A THR 64.A N ASP 61.A OD2 no hydrogen 3.125 N/A GLY 65.A N ASP 61.A O no hydrogen 2.796 N/A LYS 66.A N THR 64.A OG1 no hydrogen 3.240 N/A LYS 66.A NZ THR 64.A O no hydrogen 2.906 N/A THR 68.A N LYS 59.A O no hydrogen 3.268 N/A THR 68.A OG1 LYS 59.A O no hydrogen 3.357 N/A THR 68.A OG1 THR 70.A OG1 no hydrogen 3.089 N/A THR 70.A OG1 THR 68.A OG1 no hydrogen 3.089 N/A VAL 77.A N SER 73.A O no hydrogen 3.361 N/A TYR 78.A N MET 74.A O no hydrogen 2.930 N/A GLU 79.A N LYS 75.A O no hydrogen 2.899 N/A GLU 80.A N ASP 76.A O no hydrogen 2.899 N/A PHE 81.A N VAL 77.A O no hydrogen 2.920 N/A ASP 82.A N TYR 78.A O no hydrogen 2.920 N/A GLU 83.A N GLU 79.A O no hydrogen 2.898 N/A LYS 84.A N GLU 80.A O no hydrogen 3.342 N/A ALA 86.A N PHE 81.A O no hydrogen 3.163 N/A THR 87.A OG1 GLU 83.A O no hydrogen 2.848 N/A THR 87.A OG1 LYS 84.A O no hydrogen 3.178 N/A LYS 88.A N LYS 84.A O no hydrogen 3.053 N/A TYR 89.A N ILE 85.A O no hydrogen 2.925 N/A ILE 91.A N ALA 86.A O no hydrogen 2.972 N/A LYS 95.A N LYS 120.A O no hydrogen 2.896 N/A LYS 95.A NZ GLU 48.A OE1 no hydrogen 3.495 N/A LYS 97.A N GLU 118.A O no hydrogen 2.960 N/A VAL 99.A N TYR 116.A O no hydrogen 2.927 N/A LYS 101.A NZ ASN 464.A OD1 no hydrogen 3.345 N/A ASN 102.A ND2 ASN 464.A O no hydrogen 3.086 N/A TYR 103.A N GLU 112.A O no hydrogen 2.946 N/A SER 114.A OG GLU 115.A O no hydrogen 3.521 N/A TYR 116.A N VAL 99.A O no hydrogen 2.928 N/A LEU 117.A N PHE 53.A O no hydrogen 3.004 N/A GLU 118.A N LYS 97.A O no hydrogen 2.888 N/A VAL 119.A N LEU 51.A O no hydrogen 2.933 N/A LYS 120.A N LYS 95.A O no hydrogen 2.899 N/A SER 122.A OG GLU 124.A OE1 no hydrogen 3.140 N/A GLN 130.A NE2 ASP 469.A OD2 no hydrogen 3.153 N/A GLN 130.A NE2 LYS 470.A O no hydrogen 3.375 N/A GLY 134.A N PHE 137.A O no hydrogen 3.211 N/A SER 138.A N LEU 54.A O no hydrogen 3.215 N/A HIS 139.A ND1 VAL 140.A O no hydrogen 3.011 N/A VAL 140.A N HIS 139.A ND1 no hydrogen 2.890 N/A PHE 141.A N TYR 52.A O no hydrogen 2.888 N/A LEU 150.A N SER 146.A O no hydrogen 3.271 N/A PHE 151.A N SER 147.A O no hydrogen 2.933 N/A LEU 152.A N LEU 148.A O no hydrogen 2.933 N/A MET 153.A N GLU 149.A O no hydrogen 2.954 N/A ASN 154.A N LEU 150.A O no hydrogen 2.916 N/A ARG 155.A N PHE 151.A O no hydrogen 2.978 N/A ARG 155.A NE VAL 190.A O no hydrogen 3.077 N/A ARG 155.A NH2 VAL 190.A O no hydrogen 2.983 N/A ARG 155.A NH2 ASN 191.A OD1 no hydrogen 2.854 N/A ILE 157.A N LEU 152.A O no hydrogen 3.419 N/A CYS 161.A SG GLY 159.A O no hydrogen 3.358 N/A TRP 162.A NE1 SER 197.A O no hydrogen 3.079 N/A LEU 163.A N PHE 7.A O no hydrogen 2.865 N/A GLU 164.A N ASN 191.A O no hydrogen 3.217 N/A VAL 165.A N PHE 5.A O no hydrogen 2.858 N/A SER 167.A N GLN 3.A O no hydrogen 3.185 N/A GLN 169.A N MET 183.A O no hydrogen 2.901 N/A VAL 175.A N GLU 181.A OE1 no hydrogen 3.392 N/A TRP 177.A N ARG 328.A O no hydrogen 3.296 N/A TRP 177.A NE1 SER 324.A OG no hydrogen 3.119 N/A CYS 178.A N SER 176.A OG no hydrogen 3.094 N/A ALA 182.A N CYS 41.A O no hydrogen 3.089 N/A ALA 184.A N MET 43.A O no hydrogen 3.155 N/A LEU 189.A N LYS 186.A O no hydrogen 3.438 N/A ASN 191.A N GLU 164.A O no hydrogen 3.272 N/A ILE 193.A N TRP 162.A O no hydrogen 3.294 N/A LEU 201.A N PHE 232.A O no hydrogen 3.133 N/A VAL 203.A N HIS 229.A O no hydrogen 2.960 N/A MET 204.A N ILE 297.A O no hydrogen 2.945 N/A ALA 205.A N LEU 227.A O no hydrogen 2.908 N/A PHE 206.A N VAL 299.A O no hydrogen 3.066 N/A SER 207.A N ALA 225.A O no hydrogen 3.403 N/A LYS 209.A N ALA 223.A O no hydrogen 2.952 N/A LYS 209.A NZ HIS 408.A ND1 no hydrogen 3.098 N/A LYS 209.A NZ THR 409.A OG1 no hydrogen 3.077 N/A MET 211.A N GLU 220.A O no hydrogen 3.217 N/A ASN 216.A ND2 GLU 220.A OE2 no hydrogen 3.189 N/A HIS 217.A ND1 LYS 215.A O no hydrogen 3.084 N/A GLU 220.A N MET 211.A O no hydrogen 3.065 N/A ILE 221.A N GLU 279.A OE2 no hydrogen 3.315 N/A ILE 222.A N LYS 209.A O no hydrogen 3.509 N/A MET 224.A N VAL 249.A O no hydrogen 2.963 N/A ALA 225.A N SER 207.A O no hydrogen 2.970 N/A ALA 226.A N PHE 247.A O no hydrogen 2.938 N/A LEU 227.A N ALA 205.A O no hydrogen 2.947 N/A VAL 228.A N SER 245.A O no hydrogen 2.856 N/A HIS 229.A N VAL 203.A O no hydrogen 2.894 N/A SER 231.A N HIS 229.A ND1 no hydrogen 3.042 N/A PHE 232.A N LEU 201.A O no hydrogen 3.067 N/A GLN 244.A N VAL 228.A O no hydrogen 2.966 N/A SER 245.A N VAL 228.A O no hydrogen 2.968 N/A SER 245.A OG VAL 228.A O no hydrogen 3.544 N/A PHE 247.A N ALA 226.A O no hydrogen 2.953 N/A VAL 249.A N MET 224.A O no hydrogen 3.312 N/A VAL 250.A N GLU 274.A O no hydrogen 2.935 N/A SER 251.A N ILE 222.A O no hydrogen 3.117 N/A SER 251.A OG LYS 252.A O no hydrogen 3.292 N/A LYS 252.A NZ ALA 277.A O no hydrogen 3.020 N/A VAL 265.A N ALA 261.A O no hydrogen 3.067 N/A ILE 266.A N PHE 262.A O no hydrogen 2.909 N/A GLU 267.A N LYS 263.A O no hydrogen 2.909 N/A LYS 268.A N GLU 264.A O no hydrogen 2.893 N/A LYS 269.A N VAL 265.A O no hydrogen 2.914 N/A ASN 270.A N GLU 267.A O no hydrogen 3.283 N/A VAL 273.A N VAL 271.A O no hydrogen 2.910 N/A GLU 274.A N CYS 248.A O no hydrogen 2.949 N/A ALA 276.A N VAL 250.A O no hydrogen 2.878 N/A LEU 282.A N THR 278.A O no hydrogen 3.413 N/A LEU 283.A N GLU 279.A O no hydrogen 2.947 N/A GLY 284.A N ARG 280.A O no hydrogen 2.923 N/A PHE 285.A N THR 281.A O no hydrogen 2.914 N/A PHE 286.A N LEU 282.A O no hydrogen 2.912 N/A LEU 287.A N LEU 283.A O no hydrogen 2.945 N/A ALA 288.A N GLY 284.A O no hydrogen 2.946 N/A LYS 289.A N PHE 285.A O no hydrogen 2.910 N/A VAL 290.A N PHE 286.A O no hydrogen 2.938 N/A HIS 291.A N LEU 287.A O no hydrogen 2.982 N/A LYS 292.A N ALA 288.A O no hydrogen 2.907 N/A ILE 293.A N LYS 289.A O no hydrogen 2.903 N/A ASP 294.A N VAL 290.A O no hydrogen 2.951 N/A ASP 296.A N VAL 202.A O no hydrogen 3.128 N/A ILE 297.A N VAL 202.A O no hydrogen 3.339 N/A ILE 298.A N MET 353.A O no hydrogen 2.939 N/A VAL 299.A N MET 204.A O no hydrogen 2.880 N/A GLY 300.A N CYS 355.A O no hydrogen 3.006 N/A ASN 302.A N ASP 356.A OD1 no hydrogen 3.232 N/A ILE 303.A N ASP 356.A OD2 no hydrogen 2.927 N/A PHE 306.A N ASN 302.A O no hydrogen 3.464 N/A GLU 307.A N ASN 302.A O no hydrogen 3.524 N/A LEU 308.A N ILE 303.A O no hydrogen 3.197 N/A VAL 310.A N PHE 306.A O no hydrogen 3.185 N/A LEU 311.A N GLU 307.A O no hydrogen 2.936 N/A LEU 312.A N LEU 308.A O no hydrogen 2.933 N/A GLN 313.A N GLU 309.A O no hydrogen 2.901 N/A ARG 314.A N VAL 310.A O no hydrogen 2.922 N/A ARG 314.A NE GLU 279.A OE1 no hydrogen 3.465 N/A ARG 314.A NE GLU 279.A OE2 no hydrogen 3.479 N/A ARG 314.A NH2 GLU 279.A OE1 no hydrogen 3.047 N/A ILE 315.A N LEU 311.A O no hydrogen 2.934 N/A ASN 316.A N LEU 312.A O no hydrogen 2.918 N/A VAL 317.A N GLN 313.A O no hydrogen 2.912 N/A CYS 318.A N ARG 314.A O no hydrogen 2.904 N/A CYS 318.A SG GLU 279.A OE1 no hydrogen 3.302 N/A LYS 319.A N ASN 316.A O no hydrogen 3.357 N/A ALA 320.A N ILE 315.A O no hydrogen 3.372 N/A TRP 323.A NE1 SER 332.A O no hydrogen 3.289 N/A ILE 326.A N TRP 323.A O no hydrogen 3.508 N/A GLY 327.A N SER 324.A O no hydrogen 2.990 N/A ARG 328.A NH1 ASP 296.A OD1 no hydrogen 3.022 N/A ARG 328.A NH1 GLY 351.A O no hydrogen 3.137 N/A ARG 328.A NH2 ASP 296.A OD1 no hydrogen 3.204 N/A LYS 330.A N VAL 175.A O no hydrogen 3.258 N/A SER 332.A OG ASN 333.A OD1 no hydrogen 2.624 N/A GLY 339.A N LEU 337.A O no hydrogen 2.984 N/A GLU 345.A N GLU 345.A OE1 no hydrogen 2.776 N/A ARG 346.A N GLY 342.A O no hydrogen 3.019 N/A ASN 347.A N PHE 343.A O no hydrogen 2.913 N/A ALA 348.A N GLY 344.A O no hydrogen 2.900 N/A THR 349.A OG1 GLU 345.A O no hydrogen 3.528 N/A ARG 352.A N THR 349.A O no hydrogen 3.167 N/A ARG 352.A NE ILE 326.A O no hydrogen 3.022 N/A ARG 352.A NE GLY 327.A O no hydrogen 3.128 N/A ARG 352.A NH1 ASP 294.A OD1 no hydrogen 3.163 N/A ARG 352.A NH1 PRO 295.A O no hydrogen 2.898 N/A ARG 352.A NH2 LYS 325.A O no hydrogen 3.347 N/A MET 353.A N ASP 296.A O no hydrogen 3.424 N/A CYS 355.A N ILE 298.A O no hydrogen 2.862 N/A VAL 357.A N GLY 300.A O no hydrogen 3.448 N/A GLU 358.A N ASP 356.A OD1 no hydrogen 2.859 N/A ALA 361.A N VAL 357.A O no hydrogen 2.880 N/A LYS 362.A N GLU 358.A O no hydrogen 2.908 N/A GLU 363.A N ILE 359.A O no hydrogen 2.927 N/A LEU 364.A N SER 360.A O no hydrogen 2.906 N/A ILE 365.A N ALA 361.A O no hydrogen 3.083 N/A CYS 367.A SG GLN 378.A OE1 no hydrogen 3.152 N/A LEU 375.A N HIS 371.A O no hydrogen 3.198 N/A VAL 376.A N LEU 372.A O no hydrogen 2.918 N/A GLN 377.A N SER 373.A O no hydrogen 2.913 N/A GLN 377.A NE2 GLU 383.A OE2 no hydrogen 3.327 N/A GLN 378.A N GLU 374.A O no hydrogen 2.912 N/A GLN 378.A NE2 ARG 366.A O no hydrogen 3.615 N/A ILE 379.A N LEU 375.A O no hydrogen 2.943 N/A ARG 384.A NE ASP 412.A OD1 no hydrogen 2.880 N/A ARG 384.A NH1 SER 373.A OG no hydrogen 3.070 N/A GLU 390.A N GLU 390.A OE1 no hydrogen 2.685 N/A ILE 392.A N MET 389.A O no hydrogen 3.306 N/A MET 395.A N ASN 391.A O no hydrogen 3.070 N/A MET 395.A N ILE 392.A O no hydrogen 2.946 N/A TYR 396.A N GLN 393.A O no hydrogen 2.950 N/A SER 397.A OG ASN 394.A O no hydrogen 3.446 N/A SER 400.A OG GLU 398.A OE2 no hydrogen 3.150 N/A LEU 403.A N SER 399.A O no hydrogen 2.941 N/A TYR 404.A N SER 400.A O no hydrogen 2.889 N/A LEU 405.A N GLN 401.A O no hydrogen 2.905 N/A LEU 406.A N LEU 402.A O no hydrogen 2.980 N/A GLU 407.A N LEU 403.A O no hydrogen 2.905 N/A HIS 408.A N TYR 404.A O no hydrogen 2.889 N/A HIS 408.A NE2 VAL 385.A O no hydrogen 2.816 N/A THR 409.A N LEU 405.A O no hydrogen 2.980 N/A THR 409.A OG1 LEU 405.A O no hydrogen 3.264 N/A TRP 410.A N LEU 406.A O no hydrogen 2.969 N/A LYS 411.A N GLU 407.A O no hydrogen 2.895 N/A ASP 412.A N HIS 408.A O no hydrogen 2.910 N/A ALA 413.A N THR 409.A O no hydrogen 3.021 N/A LYS 414.A N TRP 410.A O no hydrogen 2.956 N/A PHE 415.A N LYS 411.A O no hydrogen 2.880 N/A ILE 416.A N ASP 412.A O no hydrogen 2.985 N/A LEU 417.A N ALA 413.A O no hydrogen 3.003 N/A GLN 418.A N LYS 414.A O no hydrogen 2.903 N/A ILE 419.A N PHE 415.A O no hydrogen 2.924 N/A MET 420.A N ILE 416.A O no hydrogen 2.982 N/A CYS 421.A N LEU 417.A O no hydrogen 2.942 N/A CYS 421.A SG LEU 417.A O no hydrogen 3.536 N/A GLU 422.A N GLN 418.A O no hydrogen 2.874 N/A LEU 423.A N ILE 419.A O no hydrogen 2.948 N/A ASN 424.A N CYS 421.A O no hydrogen 3.351 N/A ALA 429.A N VAL 425.A O no hydrogen 2.903 N/A LEU 430.A N LEU 426.A O no hydrogen 2.934 N/A GLN 431.A N PRO 427.A O no hydrogen 2.918 N/A ILE 432.A N LEU 428.A O no hydrogen 2.926 N/A THR 433.A N ALA 429.A O no hydrogen 2.916 N/A THR 433.A OG1 ALA 429.A O no hydrogen 3.079 N/A THR 433.A OG1 THR 443.A OG1 no hydrogen 2.952 N/A ASN 434.A N LEU 430.A O no hydrogen 2.910 N/A ILE 435.A N GLN 431.A O no hydrogen 2.931 N/A ALA 436.A N ILE 432.A O no hydrogen 2.914 N/A GLY 437.A N THR 433.A O no hydrogen 2.773 N/A ARG 442.A NE GLU 450.A OE2 no hydrogen 3.326 N/A THR 443.A N ILE 439.A O no hydrogen 3.335 N/A THR 443.A OG1 THR 433.A OG1 no hydrogen 2.952 N/A THR 443.A OG1 ASN 438.A OD1 no hydrogen 3.106 N/A LEU 444.A N MET 440.A O no hydrogen 2.921 N/A MET 445.A N SER 441.A O no hydrogen 2.932 N/A GLY 446.A N ARG 442.A O no hydrogen 3.298 N/A ARG 451.A NH2 THR 443.A O no hydrogen 3.303 N/A GLU 453.A N SER 449.A O no hydrogen 2.932 N/A PHE 454.A N GLU 450.A O no hydrogen 2.906 N/A LEU 455.A N ARG 451.A O no hydrogen 2.932 N/A LEU 456.A N ASN 452.A O no hydrogen 2.954 N/A LEU 457.A N GLU 453.A O no hydrogen 2.899 N/A HIS 458.A N PHE 454.A O no hydrogen 2.925 N/A ALA 459.A N LEU 455.A O no hydrogen 2.977 N/A PHE 460.A N LEU 456.A O no hydrogen 2.916 N/A TYR 461.A N LEU 457.A O no hydrogen 2.902 N/A GLU 462.A N HIS 458.A O no hydrogen 2.965 N/A ASN 463.A N PHE 460.A O no hydrogen 3.294 N/A ASN 464.A N TYR 461.A O no hydrogen 3.427 N/A TYR 465.A OH THR 519.A OG1 no hydrogen 3.191 N/A ILE 466.A N ASN 102.A O no hydrogen 3.159 N/A GLN 471.A N GLN 471.A OE1 no hydrogen 2.727 N/A LEU 487.A N GLY 630.A O no hydrogen 3.140 N/A GLY 492.A N LEU 678.A O no hydrogen 3.224 N/A TYR 494.A N LEU 676.A O no hydrogen 2.874 N/A TYR 494.A OH LYS 490.A O no hydrogen 3.245 N/A ILE 498.A N PHE 673.A O no hydrogen 2.930 N/A LEU 499.A N ILE 637.A O no hydrogen 2.890 N/A LEU 500.A N GLY 671.A O no hydrogen 3.162 N/A LEU 501.A N ILE 635.A O no hydrogen 2.940 N/A ASP 502.A N ASP 668.A O no hydrogen 2.939 N/A SER 509.A N SER 505.A O no hydrogen 2.969 N/A SER 509.A OG ASN 504.A O no hydrogen 3.400 N/A SER 509.A OG SER 505.A O no hydrogen 2.705 N/A ILE 510.A N LEU 506.A O no hydrogen 2.899 N/A ILE 511.A N TYR 507.A O no hydrogen 2.957 N/A GLN 512.A N PRO 508.A O no hydrogen 2.920 N/A GLU 513.A N SER 509.A O no hydrogen 2.828 N/A PHE 514.A N ILE 510.A O no hydrogen 2.989 N/A ASN 515.A ND2 ASN 515.A O no hydrogen 2.913 N/A ASN 515.A ND2 GLU 536.A O no hydrogen 3.425 N/A ILE 516.A N ILE 511.A O no hydrogen 3.468 N/A THR 519.A OG1 TYR 465.A OH no hydrogen 3.191 N/A VAL 521.A N CYS 517.A O no hydrogen 3.364 N/A ILE 527.A N GLN 526.A OE1 no hydrogen 2.946 N/A LEU 530.A N GLU 529.A OE2 no hydrogen 2.841 N/A SER 534.A N ASP 532.A O no hydrogen 2.856 N/A SER 534.A OG ASP 532.A OD2 no hydrogen 2.758 N/A ARG 542.A N GLY 538.A O no hydrogen 3.493 N/A GLU 543.A N ILE 539.A O no hydrogen 2.968 N/A ILE 544.A N LEU 540.A O no hydrogen 2.933 N/A ARG 545.A N PRO 541.A O no hydrogen 2.873 N/A LYS 546.A N ARG 542.A O no hydrogen 2.957 N/A LEU 547.A N GLU 543.A O no hydrogen 2.977 N/A VAL 548.A N ILE 544.A O no hydrogen 2.890 N/A GLU 549.A N ARG 545.A O no hydrogen 2.889 N/A ARG 550.A N LYS 546.A O no hydrogen 2.981 N/A ARG 551.A N VAL 548.A O no hydrogen 3.459 N/A LYS 555.A N ARG 551.A O no hydrogen 2.965 N/A GLN 556.A N LYS 552.A O no hydrogen 2.871 N/A LEU 557.A N GLN 553.A O no hydrogen 2.934 N/A MET 558.A N VAL 554.A O no hydrogen 2.902 N/A LYS 559.A N LYS 555.A O no hydrogen 2.936 N/A LYS 559.A NZ GLN 556.A OE1 no hydrogen 2.950 N/A GLN 560.A N LEU 557.A O no hydrogen 3.350 N/A GLN 561.A NE2 ASP 562.A OD2 no hydrogen 3.379 N/A LEU 567.A N ASP 566.A OD1 no hydrogen 2.682 N/A ILE 568.A N ASN 564.A O no hydrogen 3.238 N/A LEU 569.A N PRO 565.A O no hydrogen 2.918 N/A GLN 570.A N ASP 566.A O no hydrogen 2.936 N/A TYR 571.A N LEU 567.A O no hydrogen 2.932 N/A ASP 572.A N ILE 568.A O no hydrogen 2.905 N/A ILE 573.A N LEU 569.A O no hydrogen 2.946 N/A ARG 574.A N GLN 570.A O no hydrogen 2.944 N/A GLN 575.A N TYR 571.A O no hydrogen 2.940 N/A LYS 576.A N ASP 572.A O no hydrogen 2.949 N/A ALA 577.A N ILE 573.A O no hydrogen 2.922 N/A LEU 578.A N ARG 574.A O no hydrogen 2.998 N/A LYS 579.A N GLN 575.A O no hydrogen 2.983 N/A LEU 580.A N LYS 576.A O no hydrogen 2.918 N/A THR 581.A N ALA 577.A O no hydrogen 2.927 N/A THR 581.A OG1 ALA 577.A O no hydrogen 2.979 N/A ALA 582.A N LEU 578.A O no hydrogen 3.019 N/A ASN 583.A N LYS 579.A O no hydrogen 2.963 N/A SER 584.A N LEU 580.A O no hydrogen 2.866 N/A SER 584.A OG ARG 448.A O no hydrogen 3.535 N/A MET 585.A N THR 581.A O no hydrogen 2.934 N/A TYR 586.A N ALA 582.A O no hydrogen 3.022 N/A GLY 587.A N ASN 583.A O no hydrogen 2.880 N/A CYS 588.A N SER 584.A O no hydrogen 2.935 N/A CYS 588.A SG SER 584.A O no hydrogen 3.318 N/A LEU 589.A N TYR 586.A O no hydrogen 3.364 N/A GLY 590.A N GLY 587.A O no hydrogen 3.067 N/A PHE 591.A N CYS 588.A O no hydrogen 3.298 N/A SER 594.A N PHE 591.A O no hydrogen 3.470 N/A ARG 595.A NE PRO 468.A O no hydrogen 3.067 N/A ARG 595.A NH2 PRO 468.A O no hydrogen 2.978 N/A PHE 596.A N SER 594.A OG no hydrogen 3.036 N/A ALA 598.A N LEU 589.A O no hydrogen 3.254 N/A ALA 602.A N LYS 599.A O no hydrogen 3.098 N/A ALA 603.A N LYS 599.A O no hydrogen 3.218 N/A LEU 604.A N PRO 600.A O no hydrogen 2.947 N/A THR 606.A N ALA 602.A O no hydrogen 2.976 N/A THR 606.A OG1 ALA 482.A O no hydrogen 3.332 N/A THR 606.A OG1 ALA 602.A O no hydrogen 3.200 N/A THR 606.A OG1 ALA 603.A O no hydrogen 2.774 N/A TYR 607.A N ALA 603.A O no hydrogen 2.920 N/A LYS 608.A N LEU 604.A O no hydrogen 2.952 N/A LYS 608.A NZ GLU 611.A OE1 no hydrogen 3.474 N/A LYS 608.A NZ GLU 611.A OE2 no hydrogen 3.113 N/A GLY 609.A N VAL 605.A O no hydrogen 2.938 N/A ARG 610.A N THR 606.A O no hydrogen 2.968 N/A ARG 610.A NH1 GLY 483.A O no hydrogen 2.937 N/A GLU 611.A N TYR 607.A O no hydrogen 2.978 N/A ILE 612.A N LYS 608.A O no hydrogen 2.909 N/A LEU 613.A N GLY 609.A O no hydrogen 2.971 N/A MET 614.A N ARG 610.A O no hydrogen 2.965 N/A HIS 615.A N GLU 611.A O no hydrogen 2.954 N/A THR 616.A N ILE 612.A O no hydrogen 2.899 N/A THR 616.A OG1 ILE 612.A O no hydrogen 2.982 N/A LYS 617.A N LEU 613.A O no hydrogen 2.938 N/A GLU 618.A N MET 614.A O no hydrogen 2.975 N/A MET 619.A N HIS 615.A O no hydrogen 2.924 N/A VAL 620.A N THR 616.A O no hydrogen 2.917 N/A GLN 621.A N LYS 617.A O no hydrogen 2.928 N/A LYS 622.A N GLU 618.A O no hydrogen 2.939 N/A LYS 622.A N MET 619.A O no hydrogen 3.265 N/A MET 623.A N VAL 620.A O no hydrogen 3.173 N/A ILE 628.A N MET 636.A O no hydrogen 3.448 N/A ASP 631.A N SER 634.A OG no hydrogen 3.341 N/A ASP 633.A N ASP 631.A O no hydrogen 2.689 N/A ILE 635.A N LEU 501.A O no hydrogen 2.917 N/A MET 636.A N TYR 629.A O no hydrogen 2.912 N/A ILE 637.A N LEU 499.A O no hydrogen 2.904 N/A ASN 638.A N GLU 626.A O no hydrogen 3.231 N/A ASN 638.A ND2 GLU 626.A OE1 no hydrogen 2.937 N/A SER 641.A OG GLU 646.A OE2 no hydrogen 2.946 N/A GLU 645.A N GLU 645.A OE1 no hydrogen 2.691 N/A GLU 646.A N ASN 643.A OD1 no hydrogen 2.950 N/A PHE 648.A N LEU 644.A O no hydrogen 2.928 N/A LYS 649.A N GLU 645.A O no hydrogen 2.900 N/A LEU 650.A N GLU 646.A O no hydrogen 2.909 N/A GLY 651.A N VAL 647.A O no hydrogen 2.914 N/A ASN 652.A N PHE 648.A O no hydrogen 2.927 N/A LYS 653.A N LYS 649.A O no hydrogen 2.907 N/A VAL 654.A N LEU 650.A O no hydrogen 2.945 N/A LYS 655.A N GLY 651.A O no hydrogen 2.926 N/A LYS 655.A NZ ASP 668.A OD1 no hydrogen 3.188 N/A SER 656.A N ASN 652.A O no hydrogen 2.910 N/A SER 656.A OG ASN 652.A O no hydrogen 3.027 N/A SER 656.A OG ASN 652.A OD1 no hydrogen 3.465 N/A GLU 657.A N LYS 653.A O no hydrogen 2.921 N/A VAL 658.A N VAL 654.A O no hydrogen 2.940 N/A ASN 659.A N LYS 655.A O no hydrogen 2.919 N/A LYS 660.A N SER 656.A O no hydrogen 3.241 N/A LEU 661.A N VAL 658.A O no hydrogen 3.316 N/A LYS 663.A NZ GLU 513.A OE2 no hydrogen 3.292 N/A ILE 667.A N ASN 659.A OD1 no hydrogen 3.074 N/A ASP 668.A N ASP 502.A O no hydrogen 2.918 N/A ASP 670.A N LEU 500.A O no hydrogen 2.940 N/A PHE 673.A N ILE 498.A O no hydrogen 2.839 N/A LYS 674.A N LEU 687.A O no hydrogen 3.166 N/A LEU 676.A N TYR 494.A O no hydrogen 2.928 N/A LEU 677.A N ALA 685.A O no hydrogen 2.896 N/A LEU 678.A N GLY 492.A O no hydrogen 2.954 N/A LEU 679.A N LYS 683.A O no hydrogen 2.975 N/A LYS 680.A N LYS 683.A O no hydrogen 3.475 N/A LYS 682.A N TYR 629.A OH no hydrogen 2.779 N/A LYS 682.A NZ ASP 631.A OD1 no hydrogen 2.982 N/A LYS 682.A NZ ASP 631.A OD2 no hydrogen 2.850 N/A LYS 683.A NZ GLY 705.A O no hydrogen 2.827 N/A TYR 684.A N LYS 704.A O no hydrogen 2.959 N/A ALA 685.A N LEU 677.A O no hydrogen 2.946 N/A ALA 686.A N GLU 702.A O no hydrogen 2.914 N/A LEU 687.A N SER 675.A O no hydrogen 3.422 N/A VAL 688.A N LYS 700.A O no hydrogen 2.870 N/A VAL 689.A N VAL 672.A O no hydrogen 3.129 N/A GLU 690.A N VAL 698.A O no hydrogen 2.827 N/A THR 692.A OG1 SER 693.A O no hydrogen 3.444 N/A THR 692.A OG1 ASN 696.A O no hydrogen 2.946 N/A THR 692.A OG1 ASN 696.A OD1 no hydrogen 2.785 N/A SER 693.A OG ASP 694.A OD1 no hydrogen 3.563 N/A ASP 694.A N SER 693.A OG no hydrogen 2.646 N/A ASN 696.A N SER 693.A O no hydrogen 3.113 N/A ASN 696.A ND2 ASP 694.A O no hydrogen 3.222 N/A VAL 698.A N GLU 690.A O no hydrogen 2.971 N/A LYS 700.A N VAL 688.A O no hydrogen 2.940 N/A LYS 700.A NZ GLU 690.A OE2 no hydrogen 3.420 N/A GLU 702.A N ALA 686.A O no hydrogen 2.911 N/A LYS 704.A N TYR 684.A O no hydrogen 2.923 N/A ARG 711.A NE LYS 368.A O no hydrogen 3.077 N/A ARG 711.A NH2 CYS 367.A O no hydrogen 3.270 N/A LYS 718.A N CYS 714.A O no hydrogen 3.286 N/A LYS 718.A NZ ARG 710.A O no hydrogen 3.556 N/A ASP 719.A N ASP 715.A O no hydrogen 2.910 N/A THR 720.A N LEU 716.A O no hydrogen 2.963 N/A THR 720.A OG1 LEU 716.A O no hydrogen 3.278 N/A GLY 721.A N ALA 717.A O no hydrogen 2.900 N/A ASN 722.A N LYS 718.A O no hydrogen 2.914 N/A PHE 723.A N ASP 719.A O no hydrogen 2.955 N/A VAL 724.A N THR 720.A O no hydrogen 2.943 N/A ILE 725.A N GLY 721.A O no hydrogen 2.922 N/A GLY 726.A N ASN 722.A O no hydrogen 2.907 N/A GLN 727.A N PHE 723.A O no hydrogen 2.948 N/A ILE 728.A N VAL 724.A O no hydrogen 2.918 N/A LEU 729.A N ILE 725.A O no hydrogen 3.312 N/A SER 730.A N GLN 727.A O no hydrogen 3.270 N/A SER 730.A OG GLN 732.A OE1 no hydrogen 3.483 N/A SER 733.A OG THR 736.A OG1 no hydrogen 2.710 N/A THR 736.A N SER 733.A OG no hydrogen 3.363 N/A THR 736.A OG1 SER 733.A OG no hydrogen 2.710 N/A ILE 737.A N SER 733.A O no hydrogen 3.208 N/A VAL 738.A N ARG 734.A O no hydrogen 2.931 N/A GLU 739.A N ASP 735.A O no hydrogen 2.923 N/A ASN 740.A N THR 736.A O no hydrogen 2.908 N/A ILE 741.A N ILE 737.A O no hydrogen 2.929 N/A GLN 742.A N VAL 738.A O no hydrogen 2.924 N/A LYS 743.A N GLU 739.A O no hydrogen 2.926 N/A ARG 744.A N ASN 740.A O no hydrogen 2.923 N/A ARG 744.A NH1 GLU 747.A OE1 no hydrogen 3.091 N/A LEU 745.A N ILE 741.A O no hydrogen 2.925 N/A ILE 746.A N GLN 742.A O no hydrogen 2.930 N/A GLU 747.A N LYS 743.A O no hydrogen 2.954 N/A ILE 748.A N ARG 744.A O no hydrogen 2.906 N/A GLY 749.A N LEU 745.A O no hydrogen 2.915 N/A GLU 750.A N ILE 746.A O no hydrogen 2.953 N/A ASN 751.A N GLU 747.A O no hydrogen 2.909 N/A VAL 752.A N ILE 748.A O no hydrogen 2.914 N/A LEU 753.A N GLY 749.A O no hydrogen 2.947 N/A ASN 754.A N GLU 750.A O no hydrogen 2.916 N/A GLY 755.A N VAL 752.A O no hydrogen 3.179 N/A ILE 764.A N TYR 806.A O no hydrogen 2.909 N/A LYS 766.A N VAL 804.A O no hydrogen 2.954 N/A LYS 770.A N TYR 775.A OH no hydrogen 3.126 N/A GLN 773.A N GLN 773.A OE1 no hydrogen 2.778 N/A ASP 774.A N ASP 771.A O no hydrogen 3.179 N/A SER 780.A N ASP 777.A O no hydrogen 3.362 N/A HIS 785.A N LEU 781.A O no hydrogen 3.142 N/A VAL 786.A N PRO 782.A O no hydrogen 2.955 N/A LEU 788.A N VAL 784.A O no hydrogen 2.894 N/A TRP 789.A N HIS 785.A O no hydrogen 2.956 N/A ILE 790.A N VAL 786.A O no hydrogen 2.914 N/A ASN 791.A N ALA 787.A O no hydrogen 2.913 N/A ASN 791.A ND2 VAL 798.A O no hydrogen 3.430 N/A SER 792.A N LEU 788.A O no hydrogen 2.907 N/A SER 792.A OG TRP 789.A O no hydrogen 3.298 N/A GLN 793.A N TRP 789.A O no hydrogen 2.933 N/A GLY 794.A N ILE 790.A O no hydrogen 3.461 N/A LYS 797.A NZ GLY 794.A O no hydrogen 3.545 N/A GLY 801.A N LEU 768.A O no hydrogen 3.159 N/A ASP 802.A N LYS 799.A O no hydrogen 3.326 N/A VAL 804.A N LYS 766.A O no hydrogen 2.836 N/A TYR 806.A N ILE 764.A O no hydrogen 2.908 N/A VAL 807.A N TYR 822.A O no hydrogen 3.132 N/A CYS 809.A N ARG 820.A O no hydrogen 3.129 N/A GLN 810.A N THR 834.A O no hydrogen 2.945 N/A THR 816.A OG1 GLN 819.A OE1 no hydrogen 2.842 N/A GLN 819.A N THR 816.A O no hydrogen 3.275 N/A ARG 820.A NE LEU 815.A O no hydrogen 3.446 N/A ARG 820.A NE THR 816.A O no hydrogen 3.361 N/A ARG 820.A NH1 CYS 809.A O no hydrogen 2.772 N/A TYR 822.A N VAL 807.A O no hydrogen 3.014 N/A LEU 827.A N ALA 823.A O no hydrogen 3.223 N/A GLN 828.A N PRO 824.A O no hydrogen 2.933 N/A LYS 829.A N GLU 825.A O no hydrogen 2.893 N/A GLN 830.A N GLN 826.A O no hydrogen 3.019 N/A ASP 836.A N ILE 808.A O no hydrogen 3.461 N/A TYR 840.A OH PHE 762.A O no hydrogen 2.709 N/A LEU 841.A N THR 837.A O no hydrogen 2.923 N/A ALA 842.A N GLN 838.A O no hydrogen 2.917 N/A ALA 842.A N TYR 839.A O no hydrogen 3.252 N/A GLN 843.A N TYR 839.A O no hydrogen 2.904 N/A VAL 849.A N ILE 845.A O no hydrogen 3.075 N/A ALA 850.A N HIS 846.A O no hydrogen 2.927 N/A ARG 851.A N PRO 847.A O no hydrogen 2.895 N/A ARG 851.A NE ASP 707.A OD2 no hydrogen 3.354 N/A ARG 851.A NH2 ASP 707.A OD2 no hydrogen 3.528 N/A ILE 852.A N VAL 848.A O no hydrogen 2.936 N/A CYS 853.A N VAL 849.A O no hydrogen 2.904 N/A ILE 856.A N CYS 853.A O no hydrogen 3.298 N/A ILE 864.A N ASP 860.A O no hydrogen 2.989 N/A ALA 865.A N ALA 861.A O no hydrogen 2.909 N/A THR 866.A N VAL 862.A O no hydrogen 2.913 N/A THR 866.A OG1 VAL 862.A O no hydrogen 3.185 N/A THR 866.A OG1 LEU 863.A O no hydrogen 2.739 N/A TRP 867.A N LEU 863.A O no hydrogen 2.910 N/A LEU 868.A N ILE 864.A O no hydrogen 3.176 N/A GLY 869.A N THR 866.A O no hydrogen 3.027 N/A LEU 870.A N ALA 865.A O no hydrogen 3.338 N/A