Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8d96_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 7.A N LYS 27.A O no hydrogen 3.227 N/A TRP 8.A NE1 GLY 158.A O no hydrogen 3.004 N/A LEU 9.A N PHE 25.A O no hydrogen 2.788 N/A ASP 10.A N PHE 25.A O no hydrogen 3.457 N/A TYR 12.A N PHE 23.A O no hydrogen 3.035 N/A GLN 18.A N ASP 14.A O no hydrogen 3.021 N/A VAL 22.A N VAL 43.A O no hydrogen 3.233 N/A PHE 23.A N TYR 12.A O no hydrogen 2.857 N/A LEU 24.A N VAL 41.A O no hydrogen 3.247 N/A PHE 25.A N ASP 10.A O no hydrogen 3.227 N/A GLY 26.A N CYS 39.A O no hydrogen 2.846 N/A LYS 27.A N TYR 7.A O no hydrogen 3.058 N/A LYS 27.A NZ ASP 295.A OD2 no hydrogen 2.647 N/A VAL 28.A N VAL 37.A O no hydrogen 3.009 N/A TRP 29.A NE1 GLU 31.A OE2 no hydrogen 2.768 N/A GLU 34.A N GLU 31.A O no hydrogen 3.256 N/A VAL 37.A N VAL 28.A O no hydrogen 3.222 N/A SER 38.A OG ASP 293.A OD2 no hydrogen 2.757 N/A CYS 39.A N GLY 26.A O no hydrogen 2.745 N/A CYS 39.A SG CYS 40.A O no hydrogen 3.456 N/A CYS 39.A SG VAL 179.A O no hydrogen 3.364 N/A CYS 40.A N VAL 179.A O no hydrogen 3.076 N/A CYS 40.A SG SER 175.A OG no hydrogen 2.976 N/A CYS 40.A SG GLU 180.A OE1 no hydrogen 3.799 N/A VAL 41.A N LEU 24.A O no hydrogen 2.959 N/A MET 42.A N ALA 181.A O no hydrogen 2.810 N/A VAL 43.A N VAL 22.A O no hydrogen 3.421 N/A LYS 44.A N ALA 183.A O no hydrogen 3.222 N/A ASN 45.A ND2 LEU 184.A O no hydrogen 3.445 N/A ARG 48.A N TYR 120.A O no hydrogen 2.905 N/A ARG 48.A NH1 MET 124.A O no hydrogen 3.549 N/A LEU 50.A N VAL 118.A O no hydrogen 2.978 N/A TYR 51.A N PHE 140.A O no hydrogen 3.298 N/A TYR 51.A OH GLU 117.A OE1 no hydrogen 3.313 N/A PHE 52.A N LEU 116.A O no hydrogen 3.020 N/A LEU 53.A N HIS 138.A O no hydrogen 3.167 N/A ARG 55.A N THR 135.A O no hydrogen 2.656 N/A ARG 55.A NH1 GLY 133.A O no hydrogen 2.527 N/A ARG 55.A NH2 GLY 133.A O no hydrogen 3.132 N/A ASN 62.A N ASP 60.A OD2 no hydrogen 3.175 N/A ASN 62.A ND2 ASP 60.A OD2 no hydrogen 2.436 N/A GLY 64.A N ASP 60.A O no hydrogen 3.065 N/A THR 69.A N THR 67.A OG1 no hydrogen 3.361 N/A SER 72.A N ASP 75.A OD2 no hydrogen 2.558 N/A SER 72.A OG ASP 75.A OD2 no hydrogen 2.856 N/A ASP 75.A N SER 72.A O no hydrogen 3.198 N/A ASP 75.A N SER 72.A OG no hydrogen 3.368 N/A VAL 76.A N SER 72.A O no hydrogen 3.474 N/A TYR 77.A N MET 73.A O no hydrogen 2.952 N/A GLU 78.A N LYS 74.A O no hydrogen 2.875 N/A GLU 79.A N ASP 75.A O no hydrogen 2.898 N/A PHE 80.A N VAL 76.A O no hydrogen 2.930 N/A ASP 81.A N TYR 77.A O no hydrogen 2.880 N/A GLU 82.A N GLU 78.A O no hydrogen 2.913 N/A LYS 83.A N GLU 79.A O no hydrogen 3.234 N/A LYS 83.A NZ GLU 79.A OE2 no hydrogen 3.322 N/A ALA 85.A N PHE 80.A O no hydrogen 3.261 N/A THR 86.A OG1 GLU 82.A O no hydrogen 3.300 N/A THR 86.A OG1 LYS 83.A O no hydrogen 3.166 N/A LYS 87.A N LYS 83.A O no hydrogen 3.412 N/A TYR 88.A N ILE 84.A O no hydrogen 3.204 N/A LYS 89.A NZ THR 86.A O no hydrogen 2.485 N/A LYS 89.A NZ LYS 87.A O no hydrogen 2.680 N/A ILE 90.A N ALA 85.A O no hydrogen 2.940 N/A LYS 94.A N LYS 119.A O no hydrogen 3.008 N/A LYS 96.A N GLU 117.A O no hydrogen 3.025 N/A VAL 98.A N TYR 115.A O no hydrogen 3.258 N/A LYS 100.A N SER 113.A O no hydrogen 3.384 N/A LYS 100.A NZ ASN 459.A OD1 no hydrogen 3.140 N/A TYR 102.A N GLU 111.A O no hydrogen 3.060 N/A GLU 105.A N GLU 105.A OE2 no hydrogen 2.735 N/A LYS 112.A NZ ASN 101.A OD1 no hydrogen 3.094 N/A SER 113.A N LYS 100.A O no hydrogen 3.508 N/A SER 113.A OG GLU 114.A O no hydrogen 3.116 N/A GLU 114.A N GLU 114.A OE1 no hydrogen 2.689 N/A TYR 115.A N VAL 98.A O no hydrogen 3.143 N/A LEU 116.A N PHE 52.A O no hydrogen 2.895 N/A GLU 117.A N LYS 96.A O no hydrogen 3.144 N/A VAL 118.A N LEU 50.A O no hydrogen 3.216 N/A LYS 119.A N LYS 94.A O no hydrogen 2.794 N/A TYR 120.A N ARG 48.A O no hydrogen 3.362 N/A TYR 120.A OH PRO 125.A O no hydrogen 3.372 N/A GLU 123.A N SER 121.A OG no hydrogen 3.235 N/A GLN 129.A NE2 ASN 143.A OD1 no hydrogen 3.500 N/A LYS 132.A NZ SER 137.A O no hydrogen 3.550 N/A GLY 133.A N PHE 136.A O no hydrogen 3.280 N/A SER 137.A N LEU 53.A O no hydrogen 3.155 N/A PHE 140.A N TYR 51.A O no hydrogen 2.980 N/A GLY 141.A N ASP 464.A OD1 no hydrogen 3.031 N/A GLY 141.A N ASP 464.A OD2 no hydrogen 3.311 N/A LEU 147.A N GLU 13.A OE1 no hydrogen 2.551 N/A LEU 149.A N SER 145.A O no hydrogen 2.973 N/A PHE 150.A N SER 146.A O no hydrogen 2.905 N/A LEU 151.A N LEU 147.A O no hydrogen 2.919 N/A MET 152.A N GLU 148.A O no hydrogen 2.926 N/A ASN 153.A N LEU 149.A O no hydrogen 2.895 N/A ARG 154.A N PHE 150.A O no hydrogen 2.951 N/A ARG 154.A NE VAL 189.A O no hydrogen 3.153 N/A ARG 154.A NH1 ASP 187.A OD1 no hydrogen 3.427 N/A ILE 156.A N LEU 151.A O no hydrogen 3.382 N/A CYS 160.A SG GLY 158.A O no hydrogen 3.505 N/A TRP 161.A NE1 SER 196.A O no hydrogen 3.037 N/A LEU 162.A N PHE 6.A O no hydrogen 2.390 N/A GLU 163.A N ASN 190.A O no hydrogen 2.826 N/A VAL 164.A N PHE 4.A O no hydrogen 3.483 N/A LYS 165.A N LEU 188.A O no hydrogen 3.165 N/A GLN 168.A N MET 182.A O no hydrogen 2.902 N/A TRP 176.A NE1 SER 323.A OG no hydrogen 2.966 N/A CYS 177.A N SER 175.A OG no hydrogen 3.321 N/A CYS 177.A SG SER 175.A OG no hydrogen 3.536 N/A ALA 181.A N CYS 40.A O no hydrogen 3.080 N/A ALA 183.A N MET 42.A O no hydrogen 2.614 N/A LEU 188.A N LYS 185.A O no hydrogen 3.381 N/A VAL 189.A N PRO 186.A O no hydrogen 3.341 N/A ASN 190.A N GLU 163.A O no hydrogen 3.149 N/A ILE 192.A N TRP 161.A O no hydrogen 3.163 N/A SER 196.A OG PRO 197.A O no hydrogen 3.484 N/A LEU 200.A N PHE 231.A O no hydrogen 2.691 N/A VAL 202.A N HIS 228.A O no hydrogen 3.202 N/A MET 203.A N ILE 296.A O no hydrogen 2.889 N/A ALA 204.A N LEU 226.A O no hydrogen 2.868 N/A SER 206.A N ALA 224.A O no hydrogen 3.352 N/A LYS 208.A N ALA 222.A O no hydrogen 3.432 N/A LYS 208.A NZ HIS 403.A ND1 no hydrogen 3.492 N/A ASN 212.A N GLN 217.A O no hydrogen 2.628 N/A LYS 214.A NZ ASN 215.A OD1 no hydrogen 3.303 N/A ASN 215.A N ASN 212.A OD1 no hydrogen 3.404 N/A ASN 215.A ND2 GLN 217.A OE1 no hydrogen 2.883 N/A GLU 219.A N MET 210.A O no hydrogen 2.794 N/A ILE 220.A N GLU 278.A OE2 no hydrogen 3.211 N/A MET 223.A N VAL 248.A O no hydrogen 3.037 N/A ALA 224.A N SER 206.A O no hydrogen 3.461 N/A ALA 225.A N PHE 246.A O no hydrogen 3.023 N/A LEU 226.A N ALA 204.A O no hydrogen 2.684 N/A VAL 227.A N SER 244.A O no hydrogen 2.887 N/A HIS 228.A N VAL 202.A O no hydrogen 3.026 N/A SER 230.A N HIS 228.A ND1 no hydrogen 3.019 N/A PHE 231.A N LEU 200.A O no hydrogen 3.036 N/A GLN 243.A N VAL 227.A O no hydrogen 3.075 N/A SER 244.A N VAL 227.A O no hydrogen 3.096 N/A PHE 246.A N ALA 225.A O no hydrogen 3.301 N/A CYS 247.A SG LYS 271.A O no hydrogen 3.973 N/A VAL 248.A N MET 223.A O no hydrogen 2.903 N/A VAL 249.A N GLU 273.A O no hydrogen 3.393 N/A SER 250.A N ILE 221.A O no hydrogen 2.688 N/A SER 250.A OG LYS 251.A O no hydrogen 3.136 N/A SER 250.A OG ALA 275.A O no hydrogen 3.330 N/A LYS 251.A NZ ALA 276.A O no hydrogen 2.726 N/A CYS 255.A SG GLN 388.A OE1 no hydrogen 3.212 N/A VAL 264.A N ALA 260.A O no hydrogen 3.103 N/A ILE 265.A N PHE 261.A O no hydrogen 2.911 N/A GLU 266.A N LYS 262.A O no hydrogen 2.899 N/A LYS 267.A N GLU 263.A O no hydrogen 2.888 N/A LYS 268.A N VAL 264.A O no hydrogen 2.906 N/A LYS 268.A NZ GLU 402.A OE2 no hydrogen 3.078 N/A ASN 269.A N ILE 265.A O no hydrogen 2.812 N/A VAL 272.A N VAL 270.A O no hydrogen 2.644 N/A GLU 273.A N CYS 247.A O no hydrogen 3.280 N/A ALA 275.A N VAL 249.A O no hydrogen 2.942 N/A THR 277.A N THR 280.A OG1 no hydrogen 3.212 N/A THR 280.A OG1 THR 277.A O no hydrogen 2.665 N/A LEU 281.A N THR 277.A O no hydrogen 3.432 N/A LEU 282.A N GLU 278.A O no hydrogen 2.919 N/A GLY 283.A N ARG 279.A O no hydrogen 2.903 N/A PHE 284.A N THR 280.A O no hydrogen 2.895 N/A PHE 285.A N LEU 281.A O no hydrogen 2.933 N/A LEU 286.A N LEU 282.A O no hydrogen 2.903 N/A ALA 287.A N GLY 283.A O no hydrogen 2.914 N/A LYS 288.A N PHE 284.A O no hydrogen 2.896 N/A VAL 289.A N PHE 285.A O no hydrogen 2.927 N/A HIS 290.A N LEU 286.A O no hydrogen 3.203 N/A LYS 291.A N ALA 287.A O no hydrogen 2.917 N/A ILE 292.A N LYS 288.A O no hydrogen 2.889 N/A ASP 293.A N VAL 289.A O no hydrogen 2.796 N/A ASP 295.A N VAL 201.A O no hydrogen 3.357 N/A ILE 296.A N VAL 201.A O no hydrogen 3.221 N/A ILE 297.A N MET 348.A O no hydrogen 2.767 N/A VAL 298.A N MET 203.A O no hydrogen 2.939 N/A GLY 299.A N CYS 350.A O no hydrogen 3.159 N/A ASN 301.A N ASP 351.A OD1 no hydrogen 3.111 N/A TYR 303.A OH ILE 349.A O no hydrogen 3.409 N/A PHE 305.A N ASN 301.A O no hydrogen 3.207 N/A GLU 306.A N ASN 301.A O no hydrogen 3.217 N/A LEU 307.A N ILE 302.A O no hydrogen 2.947 N/A VAL 309.A N PHE 305.A O no hydrogen 3.125 N/A LEU 310.A N GLU 306.A O no hydrogen 2.923 N/A LEU 311.A N LEU 307.A O no hydrogen 2.910 N/A GLN 312.A N GLU 308.A O no hydrogen 2.904 N/A ARG 313.A N VAL 309.A O no hydrogen 2.892 N/A ARG 313.A NE GLU 278.A OE1 no hydrogen 3.195 N/A ARG 313.A NE GLU 278.A OE2 no hydrogen 3.430 N/A ARG 313.A NH2 GLU 278.A OE1 no hydrogen 2.376 N/A ILE 314.A N LEU 310.A O no hydrogen 2.927 N/A ASN 315.A N LEU 311.A O no hydrogen 2.904 N/A VAL 316.A N GLN 312.A O no hydrogen 2.912 N/A CYS 317.A N ARG 313.A O no hydrogen 2.903 N/A LYS 318.A N ASN 315.A O no hydrogen 3.249 N/A LYS 318.A NZ VAL 316.A O no hydrogen 3.297 N/A ALA 319.A N ILE 314.A O no hydrogen 3.292 N/A TRP 322.A NE1 SER 331.A O no hydrogen 2.521 N/A SER 323.A OG LEU 328.A O no hydrogen 3.507 N/A LYS 324.A N HIS 321.A O no hydrogen 3.306 N/A LYS 324.A NZ HIS 290.A ND1 no hydrogen 3.075 N/A ILE 325.A N TRP 322.A O no hydrogen 3.512 N/A GLY 326.A N SER 323.A O no hydrogen 3.040 N/A ARG 327.A N CYS 345.A O no hydrogen 2.850 N/A ARG 327.A NH1 ASP 295.A OD1 no hydrogen 3.403 N/A ARG 327.A NH2 ASP 293.A OD1 no hydrogen 3.169 N/A ARG 327.A NH2 ASP 295.A OD1 no hydrogen 3.073 N/A LYS 329.A N VAL 174.A O no hydrogen 3.120 N/A ARG 330.A NH1 ASN 342.A O no hydrogen 2.307 N/A LYS 335.A NZ GLU 308.A OE1 no hydrogen 2.864 N/A LYS 335.A NZ GLU 308.A OE2 no hydrogen 3.157 N/A GLU 340.A N GLU 340.A OE1 no hydrogen 2.748 N/A ARG 341.A NH2 ASP 10.A OD2 no hydrogen 2.587 N/A ASN 342.A N PHE 338.A O no hydrogen 2.918 N/A ALA 343.A N GLY 339.A O no hydrogen 2.894 N/A THR 344.A N GLU 340.A O no hydrogen 2.918 N/A ARG 347.A N THR 344.A O no hydrogen 3.235 N/A ARG 347.A NE ILE 325.A O no hydrogen 2.764 N/A ARG 347.A NH1 ASP 293.A OD1 no hydrogen 2.980 N/A ARG 347.A NH1 PRO 294.A O no hydrogen 3.160 N/A ARG 347.A NH2 LYS 324.A O no hydrogen 3.115 N/A MET 348.A N ASP 295.A O no hydrogen 3.263 N/A CYS 350.A N ILE 297.A O no hydrogen 2.771 N/A VAL 352.A N GLY 299.A O no hydrogen 3.081 N/A GLU 353.A N ASP 351.A OD1 no hydrogen 3.033 N/A SER 355.A N ASP 351.A O no hydrogen 3.291 N/A SER 355.A OG ASP 351.A O no hydrogen 3.312 N/A ALA 356.A N VAL 352.A O no hydrogen 2.888 N/A LYS 357.A N GLU 353.A O no hydrogen 2.909 N/A GLU 358.A N ILE 354.A O no hydrogen 2.907 N/A LEU 359.A N SER 355.A O no hydrogen 2.915 N/A ILE 360.A N ALA 356.A O no hydrogen 2.872 N/A CYS 362.A SG ILE 360.A O no hydrogen 3.674 N/A CYS 362.A SG GLN 373.A OE1 no hydrogen 3.205 N/A SER 364.A OG HIS 366.A ND1 no hydrogen 2.715 N/A HIS 366.A N SER 364.A OG no hydrogen 3.274 N/A HIS 366.A ND1 SER 364.A OG no hydrogen 2.715 N/A LEU 370.A N HIS 366.A O no hydrogen 2.989 N/A VAL 371.A N LEU 367.A O no hydrogen 2.920 N/A GLN 372.A N SER 368.A O no hydrogen 2.885 N/A GLN 373.A N GLU 369.A O no hydrogen 2.915 N/A ILE 374.A N LEU 370.A O no hydrogen 2.896 N/A LEU 375.A N VAL 371.A O no hydrogen 3.228 N/A THR 377.A N VAL 371.A O no hydrogen 3.212 N/A THR 377.A OG1 LEU 375.A O no hydrogen 3.120 N/A ARG 379.A NE ASP 407.A OD1 no hydrogen 2.451 N/A ARG 379.A NE ASP 407.A OD2 no hydrogen 3.324 N/A ARG 379.A NH1 SER 368.A OG no hydrogen 3.127 N/A ARG 379.A NH2 ASP 407.A OD2 no hydrogen 2.761 N/A GLU 385.A N GLU 385.A OE1 no hydrogen 2.534 N/A ILE 387.A N MET 384.A O no hydrogen 3.327 N/A MET 390.A N ASN 386.A O no hydrogen 3.201 N/A TYR 391.A N GLN 388.A O no hydrogen 3.305 N/A SER 392.A OG GLU 393.A OE2 no hydrogen 2.630 N/A LEU 397.A N GLU 393.A O no hydrogen 3.152 N/A LEU 398.A N SER 394.A O no hydrogen 2.918 N/A TYR 399.A N SER 395.A O no hydrogen 2.882 N/A LEU 400.A N GLN 396.A O no hydrogen 2.890 N/A LEU 401.A N LEU 397.A O no hydrogen 2.928 N/A GLU 402.A N LEU 398.A O no hydrogen 2.899 N/A HIS 403.A N TYR 399.A O no hydrogen 2.855 N/A HIS 403.A NE2 VAL 380.A O no hydrogen 2.930 N/A THR 404.A N LEU 400.A O no hydrogen 2.933 N/A THR 404.A OG1 LEU 400.A O no hydrogen 3.108 N/A TRP 405.A N LEU 401.A O no hydrogen 2.949 N/A LYS 406.A N GLU 402.A O no hydrogen 2.852 N/A ASP 407.A N HIS 403.A O no hydrogen 2.873 N/A ALA 408.A N THR 404.A O no hydrogen 2.972 N/A LYS 409.A N TRP 405.A O no hydrogen 2.911 N/A PHE 410.A N LYS 406.A O no hydrogen 2.840 N/A ILE 411.A N ASP 407.A O no hydrogen 2.939 N/A LEU 412.A N ALA 408.A O no hydrogen 2.955 N/A GLN 413.A N LYS 409.A O no hydrogen 2.863 N/A ILE 414.A N PHE 410.A O no hydrogen 2.889 N/A MET 415.A N ILE 411.A O no hydrogen 2.951 N/A CYS 416.A N LEU 412.A O no hydrogen 2.914 N/A CYS 416.A SG LEU 412.A O no hydrogen 3.408 N/A GLU 417.A N GLN 413.A O no hydrogen 2.871 N/A LEU 418.A N ILE 414.A O no hydrogen 2.924 N/A ALA 424.A N VAL 420.A O no hydrogen 2.896 N/A LEU 425.A N LEU 421.A O no hydrogen 2.915 N/A GLN 426.A N PRO 422.A O no hydrogen 2.909 N/A ILE 427.A N LEU 423.A O no hydrogen 2.910 N/A THR 428.A N ALA 424.A O no hydrogen 2.900 N/A THR 428.A OG1 ALA 424.A O no hydrogen 3.037 N/A THR 428.A OG1 THR 438.A OG1 no hydrogen 2.949 N/A ASN 429.A N LEU 425.A O no hydrogen 2.899 N/A ILE 430.A N GLN 426.A O no hydrogen 2.923 N/A ALA 431.A N ILE 427.A O no hydrogen 2.899 N/A GLY 432.A N THR 428.A O no hydrogen 2.544 N/A SER 436.A OG ASP 10.A OD1 no hydrogen 2.831 N/A ARG 437.A N ILE 434.A O no hydrogen 3.307 N/A THR 438.A N MET 435.A O no hydrogen 2.994 N/A THR 438.A OG1 THR 428.A OG1 no hydrogen 2.949 N/A THR 438.A OG1 ILE 434.A O no hydrogen 3.431 N/A MET 440.A N ARG 437.A O no hydrogen 3.167 N/A GLY 441.A N THR 438.A O no hydrogen 3.143 N/A ARG 446.A NH1 GLU 358.A OE2 no hydrogen 3.390 N/A ARG 446.A NH2 GLU 358.A OE1 no hydrogen 3.512 N/A ARG 446.A NH2 GLU 358.A OE2 no hydrogen 3.182 N/A ARG 446.A NH2 THR 438.A O no hydrogen 3.164 N/A ASN 447.A N ARG 443.A O no hydrogen 3.323 N/A GLU 448.A N SER 444.A O no hydrogen 2.897 N/A PHE 449.A N GLU 445.A O no hydrogen 2.912 N/A LEU 450.A N ARG 446.A O no hydrogen 2.916 N/A LEU 451.A N ASN 447.A O no hydrogen 2.923 N/A LEU 452.A N GLU 448.A O no hydrogen 2.882 N/A HIS 453.A N PHE 449.A O no hydrogen 2.909 N/A ALA 454.A N LEU 450.A O no hydrogen 2.931 N/A PHE 455.A N LEU 451.A O no hydrogen 2.915 N/A TYR 456.A N LEU 452.A O no hydrogen 2.891 N/A GLU 457.A N HIS 453.A O no hydrogen 2.929 N/A ASN 458.A N PHE 455.A O no hydrogen 3.326 N/A ASN 459.A N TYR 456.A O no hydrogen 3.358 N/A ASN 459.A ND2 GLU 99.A O no hydrogen 3.677 N/A TYR 460.A N PHE 455.A O no hydrogen 3.238 N/A ILE 461.A N ASN 101.A O no hydrogen 3.194 N/A LEU 476.A N GLY 619.A O no hydrogen 3.285 N/A LYS 479.A NZ VAL 616.A O no hydrogen 3.432 N/A TYR 483.A N LEU 665.A O no hydrogen 3.169 N/A TYR 483.A OH LYS 479.A O no hydrogen 3.098 N/A LYS 485.A NZ ASN 629.A OD1 no hydrogen 3.028 N/A PHE 486.A N SER 630.A O no hydrogen 3.489 N/A ILE 487.A N PHE 662.A O no hydrogen 3.177 N/A LEU 488.A N ILE 626.A O no hydrogen 3.058 N/A LEU 490.A N ILE 624.A O no hydrogen 3.198 N/A ASP 491.A N ASP 657.A O no hydrogen 3.008 N/A ASN 493.A ND2 ASP 657.A OD2 no hydrogen 3.062 N/A SER 498.A N SER 494.A O no hydrogen 2.903 N/A SER 498.A OG ASN 493.A O no hydrogen 3.203 N/A SER 498.A OG SER 494.A O no hydrogen 2.627 N/A ILE 499.A N LEU 495.A O no hydrogen 2.888 N/A ILE 500.A N TYR 496.A O no hydrogen 2.920 N/A GLN 501.A N PRO 497.A O no hydrogen 2.918 N/A GLN 501.A NE2 PRO 497.A O no hydrogen 3.200 N/A GLU 502.A N SER 498.A O no hydrogen 2.871 N/A PHE 503.A N ILE 499.A O no hydrogen 2.922 N/A ASN 504.A ND2 GLU 525.A O no hydrogen 2.607 N/A ILE 505.A N ILE 500.A O no hydrogen 3.163 N/A THR 509.A OG1 ASN 504.A O no hydrogen 2.842 N/A THR 509.A OG1 CYS 506.A O no hydrogen 3.328 N/A VAL 510.A N CYS 506.A O no hydrogen 3.276 N/A SER 523.A N ASP 521.A OD2 no hydrogen 3.307 N/A LEU 524.A N ASP 521.A O no hydrogen 3.393 N/A GLY 527.A N ASN 504.A OD1 no hydrogen 2.885 N/A ARG 531.A N GLY 527.A O no hydrogen 3.445 N/A ARG 531.A NE GLY 527.A O no hydrogen 3.418 N/A GLU 532.A N ILE 528.A O no hydrogen 2.911 N/A GLU 532.A N LEU 529.A O no hydrogen 3.240 N/A ILE 533.A N LEU 529.A O no hydrogen 2.925 N/A ARG 534.A N PRO 530.A O no hydrogen 2.905 N/A VAL 537.A N ILE 533.A O no hydrogen 2.958 N/A GLU 538.A N ARG 534.A O no hydrogen 2.870 N/A ARG 539.A N LYS 535.A O no hydrogen 2.904 N/A ARG 540.A N LEU 536.A O no hydrogen 2.935 N/A ARG 540.A NE GLN 564.A OE1 no hydrogen 3.526 N/A LYS 541.A N VAL 537.A O no hydrogen 2.908 N/A GLN 542.A N GLU 538.A O no hydrogen 2.877 N/A VAL 543.A N ARG 539.A O no hydrogen 2.940 N/A LYS 544.A N ARG 540.A O no hydrogen 2.916 N/A GLN 545.A N LYS 541.A O no hydrogen 2.872 N/A LEU 546.A N GLN 542.A O no hydrogen 2.926 N/A MET 547.A N VAL 543.A O no hydrogen 2.878 N/A LYS 548.A N LYS 544.A O no hydrogen 2.926 N/A GLN 549.A N LEU 546.A O no hydrogen 3.347 N/A GLN 550.A N GLN 549.A OE1 no hydrogen 3.314 N/A ILE 557.A N ASN 553.A O no hydrogen 3.091 N/A LEU 558.A N PRO 554.A O no hydrogen 3.368 N/A GLN 559.A N ASP 555.A O no hydrogen 2.920 N/A TYR 560.A N LEU 556.A O no hydrogen 2.890 N/A ASP 561.A N ILE 557.A O no hydrogen 2.884 N/A ILE 562.A N LEU 558.A O no hydrogen 2.922 N/A ARG 563.A N GLN 559.A O no hydrogen 2.924 N/A GLN 564.A N TYR 560.A O no hydrogen 2.878 N/A GLN 564.A NE2 ASP 561.A OD1 no hydrogen 3.275 N/A LYS 565.A N ASP 561.A O no hydrogen 2.903 N/A ALA 566.A N ILE 562.A O no hydrogen 2.924 N/A LEU 567.A N ARG 563.A O no hydrogen 2.920 N/A LYS 568.A N GLN 564.A O no hydrogen 2.890 N/A LEU 569.A N LYS 565.A O no hydrogen 2.905 N/A THR 570.A N ALA 566.A O no hydrogen 2.907 N/A THR 570.A OG1 ALA 566.A O no hydrogen 2.973 N/A ALA 571.A N LEU 567.A O no hydrogen 2.908 N/A ASN 572.A N LYS 568.A O no hydrogen 2.898 N/A SER 573.A N LEU 569.A O no hydrogen 2.898 N/A MET 574.A N ALA 571.A O no hydrogen 3.398 N/A TYR 575.A N ASN 572.A O no hydrogen 3.189 N/A GLY 576.A N ASN 572.A O no hydrogen 3.507 N/A CYS 577.A N SER 573.A O no hydrogen 2.901 N/A CYS 577.A SG SER 573.A O no hydrogen 3.417 N/A CYS 577.A SG SER 573.A OG no hydrogen 3.764 N/A LEU 578.A N TYR 575.A O no hydrogen 3.095 N/A GLY 579.A N GLY 576.A O no hydrogen 3.052 N/A PHE 580.A N CYS 577.A O no hydrogen 3.339 N/A SER 583.A N PHE 580.A O no hydrogen 3.068 N/A SER 583.A OG CYS 577.A O no hydrogen 3.569 N/A ARG 584.A NE PRO 463.A O no hydrogen 2.803 N/A ARG 584.A NH1 GLU 148.A OE1 no hydrogen 3.366 N/A ARG 584.A NH1 GLU 148.A OE2 no hydrogen 3.559 N/A ARG 584.A NH1 GLU 448.A OE2 no hydrogen 3.370 N/A ARG 584.A NH2 GLU 148.A OE2 no hydrogen 3.478 N/A ARG 584.A NH2 PRO 463.A O no hydrogen 2.695 N/A PHE 585.A N SER 583.A OG no hydrogen 3.012 N/A ALA 587.A N LEU 578.A O no hydrogen 2.863 N/A ALA 592.A N LYS 588.A O no hydrogen 2.940 N/A LEU 593.A N PRO 589.A O no hydrogen 2.861 N/A VAL 594.A N LEU 590.A O no hydrogen 2.940 N/A THR 595.A N ALA 591.A O no hydrogen 2.953 N/A THR 595.A OG1 ALA 471.A O no hydrogen 3.117 N/A THR 595.A OG1 ALA 591.A O no hydrogen 2.822 N/A THR 595.A OG1 ALA 592.A O no hydrogen 2.577 N/A TYR 596.A N ALA 592.A O no hydrogen 2.918 N/A LYS 597.A N LEU 593.A O no hydrogen 2.899 N/A LYS 597.A NZ GLU 600.A OE1 no hydrogen 3.065 N/A GLY 598.A N VAL 594.A O no hydrogen 2.921 N/A ARG 599.A N THR 595.A O no hydrogen 2.937 N/A ARG 599.A NH1 GLY 472.A O no hydrogen 2.643 N/A GLU 600.A N TYR 596.A O no hydrogen 2.913 N/A ILE 601.A N LYS 597.A O no hydrogen 2.894 N/A LEU 602.A N GLY 598.A O no hydrogen 2.929 N/A MET 603.A N ARG 599.A O no hydrogen 2.927 N/A HIS 604.A N GLU 600.A O no hydrogen 2.905 N/A THR 605.A N ILE 601.A O no hydrogen 2.906 N/A THR 605.A OG1 ILE 601.A O no hydrogen 2.518 N/A LYS 606.A N LEU 602.A O no hydrogen 2.908 N/A GLU 607.A N MET 603.A O no hydrogen 2.917 N/A MET 608.A N HIS 604.A O no hydrogen 2.935 N/A VAL 609.A N THR 605.A O no hydrogen 2.913 N/A GLN 610.A N LYS 606.A O no hydrogen 2.893 N/A LYS 611.A N GLU 607.A O no hydrogen 2.936 N/A MET 612.A N VAL 609.A O no hydrogen 3.058 N/A ASN 613.A N GLN 610.A O no hydrogen 3.250 N/A ILE 617.A N MET 625.A O no hydrogen 3.151 N/A THR 621.A OG1 ASP 620.A O no hydrogen 2.513 N/A SER 623.A OG LEU 490.A O no hydrogen 3.386 N/A ILE 624.A N LEU 490.A O no hydrogen 3.281 N/A MET 625.A N TYR 618.A O no hydrogen 3.018 N/A ASN 627.A N GLU 615.A O no hydrogen 2.996 N/A ASN 627.A ND2 GLU 615.A OE1 no hydrogen 3.204 N/A THR 628.A OG1 PHE 486.A O no hydrogen 2.972 N/A ASN 632.A N SER 630.A OG no hydrogen 3.178 N/A VAL 636.A N ASN 632.A O no hydrogen 3.513 N/A PHE 637.A N LEU 633.A O no hydrogen 2.905 N/A LYS 638.A N GLU 634.A O no hydrogen 2.923 N/A LEU 639.A N GLU 635.A O no hydrogen 2.923 N/A GLY 640.A N VAL 636.A O no hydrogen 2.883 N/A ASN 641.A N PHE 637.A O no hydrogen 2.924 N/A LYS 642.A N LYS 638.A O no hydrogen 2.931 N/A VAL 643.A N LEU 639.A O no hydrogen 2.929 N/A LYS 644.A N GLY 640.A O no hydrogen 2.877 N/A SER 645.A N ASN 641.A O no hydrogen 2.926 N/A GLU 646.A N LYS 642.A O no hydrogen 2.933 N/A VAL 647.A N VAL 643.A O no hydrogen 2.905 N/A ASN 648.A N LYS 644.A O no hydrogen 2.906 N/A ASN 648.A ND2 ILE 656.A O no hydrogen 3.450 N/A LYS 649.A N SER 645.A O no hydrogen 2.942 N/A LEU 650.A N VAL 647.A O no hydrogen 3.368 N/A LEU 653.A N GLU 502.A OE1 no hydrogen 3.018 N/A ASP 657.A N ASP 491.A O no hydrogen 3.112 N/A ASP 659.A N LEU 489.A O no hydrogen 2.909 N/A PHE 662.A N ILE 487.A O no hydrogen 2.839 N/A LYS 663.A N LEU 676.A O no hydrogen 3.106 N/A SER 664.A OG LYS 663.A O no hydrogen 2.818 N/A LEU 665.A N TYR 483.A O no hydrogen 3.423 N/A LEU 666.A N ALA 674.A O no hydrogen 2.894 N/A LEU 667.A N GLY 481.A O no hydrogen 3.467 N/A LEU 668.A N LYS 672.A O no hydrogen 3.180 N/A LYS 669.A N LYS 672.A O no hydrogen 3.427 N/A LYS 671.A N TYR 618.A OH no hydrogen 2.723 N/A LYS 671.A NZ ASP 620.A OD1 no hydrogen 3.027 N/A LYS 671.A NZ ASP 620.A OD2 no hydrogen 2.657 N/A LYS 672.A N LYS 669.A O no hydrogen 3.342 N/A LYS 672.A NZ ASP 696.A OD1 no hydrogen 3.201 N/A TYR 673.A N LYS 693.A O no hydrogen 2.982 N/A ALA 674.A N LEU 666.A O no hydrogen 3.093 N/A ALA 675.A N GLU 691.A O no hydrogen 3.462 N/A LEU 676.A N SER 664.A O no hydrogen 3.156 N/A VAL 677.A N LYS 689.A O no hydrogen 3.055 N/A VAL 678.A N VAL 661.A O no hydrogen 3.051 N/A GLU 679.A N VAL 687.A O no hydrogen 2.829 N/A THR 681.A N ASN 685.A O no hydrogen 2.997 N/A SER 682.A OG THR 681.A O no hydrogen 2.445 N/A ASN 685.A N SER 682.A O no hydrogen 2.841 N/A VAL 687.A N GLU 679.A O no hydrogen 2.897 N/A LYS 689.A N VAL 677.A O no hydrogen 3.046 N/A LYS 689.A NZ GLU 679.A OE2 no hydrogen 3.450 N/A GLN 690.A NE2 ASN 711.A OD1 no hydrogen 3.494 N/A GLU 691.A N ALA 675.A O no hydrogen 3.367 N/A LYS 693.A N TYR 673.A O no hydrogen 3.022 N/A ARG 699.A N ASP 696.A O no hydrogen 3.466 N/A ARG 699.A NE ASP 701.A OD1 no hydrogen 3.140 N/A ARG 699.A NE ASP 701.A OD2 no hydrogen 3.457 N/A ARG 699.A NH2 ASP 701.A OD2 no hydrogen 2.878 N/A CYS 703.A N GLN 833.A OE1 no hydrogen 3.064 N/A CYS 703.A SG GLN 833.A OE1 no hydrogen 3.380 N/A LYS 707.A N CYS 703.A O no hydrogen 3.166 N/A LYS 707.A NZ ASP 704.A OD1 no hydrogen 3.494 N/A ASP 708.A N ASP 704.A O no hydrogen 2.893 N/A THR 709.A N LEU 705.A O no hydrogen 2.944 N/A THR 709.A OG1 LEU 705.A O no hydrogen 3.123 N/A THR 709.A OG1 ALA 706.A O no hydrogen 2.683 N/A GLY 710.A N ALA 706.A O no hydrogen 2.891 N/A ASN 711.A N LYS 707.A O no hydrogen 2.892 N/A PHE 712.A N ASP 708.A O no hydrogen 2.927 N/A VAL 713.A N THR 709.A O no hydrogen 2.919 N/A ILE 714.A N GLY 710.A O no hydrogen 2.890 N/A GLY 715.A N ASN 711.A O no hydrogen 2.908 N/A GLN 716.A N PHE 712.A O no hydrogen 2.910 N/A ILE 717.A N VAL 713.A O no hydrogen 2.899 N/A LEU 718.A N ILE 714.A O no hydrogen 3.098 N/A SER 719.A OG GLN 721.A OE1 no hydrogen 3.233 N/A GLN 721.A N SER 719.A OG no hydrogen 3.386 N/A THR 725.A N SER 722.A O no hydrogen 3.281 N/A THR 725.A OG1 SER 722.A OG no hydrogen 2.868 N/A ASN 729.A N THR 725.A O no hydrogen 2.922 N/A ASN 729.A ND2 GLN 716.A OE1 no hydrogen 3.421 N/A ILE 730.A N ILE 726.A O no hydrogen 2.889 N/A GLN 731.A N VAL 727.A O no hydrogen 2.911 N/A LYS 732.A N GLU 728.A O no hydrogen 2.908 N/A ARG 733.A N ASN 729.A O no hydrogen 2.922 N/A LEU 734.A N ILE 730.A O no hydrogen 2.887 N/A ILE 735.A N GLN 731.A O no hydrogen 2.912 N/A GLU 736.A N LYS 732.A O no hydrogen 2.927 N/A ILE 737.A N ARG 733.A O no hydrogen 2.896 N/A GLY 738.A N LEU 734.A O no hydrogen 2.894 N/A GLU 739.A N ILE 735.A O no hydrogen 2.919 N/A ASN 740.A N GLU 736.A O no hydrogen 2.899 N/A VAL 741.A N ILE 737.A O no hydrogen 2.913 N/A LEU 742.A N GLY 738.A O no hydrogen 3.324 N/A ASN 743.A N GLU 739.A O no hydrogen 2.904 N/A GLY 744.A N ASN 740.A O no hydrogen 3.062 N/A GLN 750.A N PRO 747.A O no hydrogen 3.331 N/A GLN 750.A NE2 ASP 704.A OD2 no hydrogen 3.489 N/A PHE 751.A N VAL 748.A O no hydrogen 3.145 N/A ILE 753.A N TYR 795.A O no hydrogen 3.055 N/A LYS 755.A N VAL 793.A O no hydrogen 3.066 N/A LEU 757.A N ASP 791.A O no hydrogen 2.969 N/A THR 758.A N TYR 764.A OH no hydrogen 3.306 N/A LYS 759.A N TYR 764.A OH no hydrogen 3.300 N/A LYS 759.A NZ ASP 763.A O no hydrogen 3.341 N/A ASP 763.A N ASP 760.A O no hydrogen 2.968 N/A LYS 768.A NZ LYS 768.A O no hydrogen 3.535 N/A SER 769.A N ASP 766.A O no hydrogen 2.993 N/A LEU 770.A N ASP 766.A O no hydrogen 3.198 N/A HIS 774.A N LEU 770.A O no hydrogen 3.305 N/A VAL 775.A N PRO 771.A O no hydrogen 2.932 N/A ALA 776.A N HIS 772.A O no hydrogen 2.912 N/A LEU 777.A N VAL 773.A O no hydrogen 2.868 N/A TRP 778.A N HIS 774.A O no hydrogen 2.935 N/A ILE 779.A N VAL 775.A O no hydrogen 2.911 N/A ASN 780.A N ALA 776.A O no hydrogen 2.904 N/A ASN 780.A ND2 VAL 787.A O no hydrogen 3.312 N/A SER 781.A N LEU 777.A O no hydrogen 2.906 N/A GLN 782.A N TRP 778.A O no hydrogen 2.914 N/A VAL 787.A N ASN 780.A OD1 no hydrogen 2.944 N/A LYS 788.A N ASP 791.A OD2 no hydrogen 2.477 N/A LYS 788.A NZ ASP 791.A OD1 no hydrogen 3.206 N/A LYS 788.A NZ ASP 791.A OD2 no hydrogen 3.244 N/A GLY 790.A N LEU 757.A O no hydrogen 2.855 N/A ASP 791.A N LYS 788.A O no hydrogen 3.280 N/A THR 792.A OG1 LYS 755.A O no hydrogen 3.360 N/A VAL 793.A N LYS 755.A O no hydrogen 2.833 N/A SER 794.A OG GLU 752.A OE1 no hydrogen 2.472 N/A TYR 795.A N ILE 753.A O no hydrogen 3.023 N/A VAL 796.A N TYR 811.A O no hydrogen 2.907 N/A CYS 798.A N ARG 809.A O no hydrogen 3.364 N/A CYS 798.A SG VAL 796.A O no hydrogen 3.808 N/A GLN 799.A N THR 823.A O no hydrogen 2.650 N/A GLN 799.A NE2 ASP 825.A OD1 no hydrogen 3.347 N/A SER 802.A OG ASP 800.A OD2 no hydrogen 3.315 N/A GLN 808.A N THR 805.A O no hydrogen 3.344 N/A ARG 809.A N ALA 806.A O no hydrogen 3.179 N/A ARG 809.A NE LEU 804.A O no hydrogen 3.066 N/A ARG 809.A NE THR 805.A O no hydrogen 3.067 N/A ARG 809.A NH1 ASP 825.A OD2 no hydrogen 2.946 N/A ARG 809.A NH2 LEU 804.A O no hydrogen 3.556 N/A TYR 811.A N VAL 796.A O no hydrogen 3.010 N/A GLN 815.A N ALA 812.A O no hydrogen 2.938 N/A LEU 816.A N PRO 813.A O no hydrogen 3.359 N/A GLN 817.A N GLN 817.A OE1 no hydrogen 2.523 N/A TYR 829.A OH PHE 751.A O no hydrogen 2.578 N/A LEU 830.A N THR 826.A O no hydrogen 2.901 N/A ALA 831.A N GLN 827.A O no hydrogen 2.911 N/A GLN 832.A N TYR 828.A O no hydrogen 2.882 N/A GLN 833.A N TYR 829.A O no hydrogen 3.351 N/A ILE 834.A N TYR 829.A O no hydrogen 3.197 N/A VAL 838.A N ILE 834.A O no hydrogen 3.209 N/A ALA 839.A N HIS 835.A O no hydrogen 2.896 N/A ARG 840.A N PRO 836.A O no hydrogen 2.911 N/A ARG 840.A NE ASP 696.A OD2 no hydrogen 3.078 N/A ARG 840.A NH2 ASP 696.A OD2 no hydrogen 3.254 N/A ILE 841.A N VAL 837.A O no hydrogen 2.917 N/A CYS 842.A N VAL 838.A O no hydrogen 3.018 N/A CYS 842.A SG VAL 838.A O no hydrogen 3.245 N/A GLU 843.A N ARG 840.A O no hydrogen 3.454 N/A ILE 853.A N ASP 849.A O no hydrogen 2.968 N/A ALA 854.A N ALA 850.A O no hydrogen 2.895 N/A THR 855.A N VAL 851.A O no hydrogen 2.917 N/A THR 855.A OG1 VAL 851.A O no hydrogen 3.106 N/A THR 855.A OG1 LEU 852.A O no hydrogen 2.558 N/A TRP 856.A N LEU 852.A O no hydrogen 2.908 N/A LEU 857.A N ILE 853.A O no hydrogen 2.899 N/A GLY 858.A N THR 855.A O no hydrogen 3.322 N/A LEU 859.A N ALA 854.A O no hydrogen 3.084 N/A THR 862.A OG1 ASP 860.A OD2 no hydrogen 2.852 N/A GLN 863.A NE2 ASP 860.A O no hydrogen 3.629 N/A HIS 868.A N VAL 866.A O no hydrogen 2.504 N/A