Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6yyt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N PHE 18.A O no hydrogen 2.905 N/A ALA 4.A N ASP 50.A OD1 no hydrogen 3.507 N/A PHE 5.A N ALA 16.A O no hydrogen 2.875 N/A ILE 7.A N GLY 14.A O no hydrogen 2.914 N/A ASN 9.A N VAL 12.A O no hydrogen 2.977 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 2.945 N/A LYS 11.A NZ ASN 637.A OD1 no hydrogen 2.933 N/A VAL 12.A N ASN 9.A OD1 no hydrogen 2.676 N/A GLY 14.A N ILE 7.A O no hydrogen 2.891 N/A ALA 16.A N PHE 5.A O no hydrogen 2.930 N/A PHE 18.A N ARG 3.A O no hydrogen 2.896 N/A LYS 20.A NZ LEU 19.A O no hydrogen 3.422 N/A GLN 25.A N PHE 21.A O no hydrogen 2.952 N/A HIS 26.A N SER 22.A O no hydrogen 2.913 N/A GLU 27.A N ASN 23.A O no hydrogen 2.886 N/A GLU 28.A N TYR 24.A O no hydrogen 2.897 N/A THR 29.A N GLN 25.A O no hydrogen 2.891 N/A THR 29.A OG1 GLN 25.A O no hydrogen 2.932 N/A ILE 30.A N HIS 26.A O no hydrogen 2.918 N/A TYR 31.A N GLU 27.A O no hydrogen 2.910 N/A ASN 32.A N GLU 28.A O no hydrogen 2.885 N/A LEU 33.A N THR 29.A O no hydrogen 2.916 N/A LEU 34.A N TYR 31.A O no hydrogen 2.985 N/A VAL 40.A N CYS 37.A O no hydrogen 3.234 N/A ALA 41.A N TRP 140.A O no hydrogen 2.976 N/A THR 44.A OG1 TYR 46.A O no hydrogen 2.420 N/A LYS 45.A NZ GLU 68.A OE2 no hydrogen 3.096 N/A THR 47.A N ASP 50.A OD2 no hydrogen 3.522 N/A THR 47.A OG1 ASP 50.A OD2 no hydrogen 3.263 N/A MET 48.A N GLN 134.A O no hydrogen 2.907 N/A LEU 51.A N THR 47.A O no hydrogen 3.472 N/A VAL 52.A N MET 48.A O no hydrogen 2.927 N/A TYR 53.A N ALA 49.A O no hydrogen 2.874 N/A ALA 54.A N ASP 50.A O no hydrogen 2.903 N/A LEU 55.A N LEU 51.A O no hydrogen 2.918 N/A ARG 56.A N VAL 52.A O no hydrogen 2.901 N/A ARG 56.A NH1 LEU 164.A O no hydrogen 3.339 N/A HIS 57.A N TYR 53.A O no hydrogen 2.826 N/A CYS 63.A SG ASP 59.A O no hydrogen 3.003 N/A CYS 63.A SG GLU 60.A O no hydrogen 4.001 N/A LYS 67.A N CYS 63.A O no hydrogen 2.869 N/A GLU 68.A N ASP 64.A O no hydrogen 2.894 N/A ILE 69.A N THR 65.A O no hydrogen 2.912 N/A LEU 70.A N LEU 66.A O no hydrogen 2.901 N/A VAL 71.A N LYS 67.A O no hydrogen 2.924 N/A THR 72.A N GLU 68.A O no hydrogen 2.888 N/A THR 72.A OG1 GLU 68.A O no hydrogen 2.347 N/A TYR 73.A N ILE 69.A O no hydrogen 3.452 N/A CYS 75.A N LEU 70.A O no hydrogen 2.945 N/A CYS 75.A SG TYR 73.A O no hydrogen 3.723 N/A CYS 76.A N LEU 70.A O no hydrogen 3.300 N/A CYS 76.A SG ASP 77.A O no hydrogen 3.668 N/A ASP 77.A N ASP 77.A OD1 no hydrogen 2.447 N/A ASP 79.A N ASP 79.A OD1 no hydrogen 2.512 N/A TYR 80.A N ASP 77.A O no hydrogen 3.221 N/A TYR 80.A OH ASP 94.A OD2 no hydrogen 3.382 N/A PHE 81.A N ASP 78.A O no hydrogen 2.906 N/A ASN 82.A N ASP 79.A O no hydrogen 2.905 N/A LYS 83.A N TYR 80.A O no hydrogen 3.220 N/A LYS 83.A NZ ASN 92.A OD1 no hydrogen 2.588 N/A LYS 84.A NZ ASP 85.A OD2 no hydrogen 3.516 N/A VAL 90.A N ASP 88.A OD1 no hydrogen 2.779 N/A ASN 92.A ND2 TYR 80.A OH no hydrogen 3.015 N/A LEU 96.A N PRO 93.A O no hydrogen 2.909 N/A ARG 97.A N ASP 94.A O no hydrogen 2.899 N/A ARG 97.A NE ASP 94.A OD1 no hydrogen 2.967 N/A ARG 97.A NH2 ASP 94.A OD1 no hydrogen 3.467 N/A ARG 97.A NH2 ASP 94.A OD2 no hydrogen 2.887 N/A VAL 98.A N ASP 94.A O no hydrogen 3.354 N/A TYR 99.A N ILE 95.A O no hydrogen 3.019 N/A TYR 99.A OH TYR 711.A OH no hydrogen 2.839 N/A ALA 100.A N LEU 96.A O no hydrogen 3.371 N/A ASN 101.A N ARG 97.A O no hydrogen 3.238 N/A ASN 101.A N VAL 98.A O no hydrogen 2.915 N/A LEU 102.A N TYR 99.A O no hydrogen 2.903 N/A GLY 103.A N ALA 100.A O no hydrogen 2.909 N/A ARG 105.A NH1 ASN 137.A OD1 no hydrogen 2.841 N/A VAL 106.A N LEU 102.A O no hydrogen 2.731 N/A ARG 107.A N GLY 103.A O no hydrogen 2.643 N/A ARG 107.A NE GLU 104.A OE1 no hydrogen 3.225 N/A ARG 107.A NE GLU 104.A OE2 no hydrogen 3.343 N/A ARG 107.A NH1 GLU 178.A OE1 no hydrogen 3.516 N/A ARG 107.A NH1 TYR 210.A OH no hydrogen 3.417 N/A ARG 107.A NH2 GLU 104.A OE2 no hydrogen 3.247 N/A GLN 108.A N GLU 104.A O no hydrogen 2.634 N/A GLN 108.A NE2 GLU 104.A OE2 no hydrogen 3.429 N/A ALA 109.A N VAL 106.A O no hydrogen 2.918 N/A LEU 110.A N VAL 106.A O no hydrogen 3.104 N/A LYS 112.A NZ ASN 139.A OD1 no hydrogen 2.889 N/A THR 113.A N ALA 109.A O no hydrogen 2.973 N/A THR 113.A OG1 ALA 109.A O no hydrogen 3.467 N/A THR 113.A OG1 TYR 161.A OH no hydrogen 2.860 N/A VAL 114.A N LEU 110.A O no hydrogen 3.009 N/A GLN 115.A N LEU 111.A O no hydrogen 2.830 N/A PHE 116.A N LYS 112.A O no hydrogen 2.697 N/A CYS 117.A N THR 113.A O no hydrogen 2.803 N/A CYS 117.A SG THR 113.A O no hydrogen 3.861 N/A ASP 118.A N VAL 114.A O no hydrogen 2.744 N/A ALA 119.A N GLN 115.A O no hydrogen 2.818 N/A MET 120.A N PHE 116.A O no hydrogen 3.041 N/A ARG 121.A N CYS 117.A O no hydrogen 2.752 N/A ARG 121.A NH2 ASN 122.A OD1 no hydrogen 3.539 N/A ASN 122.A N ASP 118.A O no hydrogen 2.724 N/A ASN 122.A N ALA 119.A O no hydrogen 2.914 N/A ALA 123.A N MET 120.A O no hydrogen 2.915 N/A ILE 125.A N MET 120.A O no hydrogen 3.349 N/A LEU 129.A N VAL 157.A O no hydrogen 3.334 N/A THR 130.A OG1 ASP 132.A OD1 no hydrogen 3.261 N/A ASN 133.A ND2 THR 130.A OG1 no hydrogen 3.131 N/A GLN 134.A N LEU 131.A O no hydrogen 3.243 N/A GLN 134.A NE2 GLY 138.A O no hydrogen 3.495 N/A ASP 135.A N ASN 139.A O no hydrogen 3.360 N/A GLY 138.A N ASP 135.A OD1 no hydrogen 2.728 N/A ASN 139.A N ASP 135.A OD1 no hydrogen 3.197 N/A TRP 140.A N ALA 39.A O no hydrogen 2.954 N/A TRP 140.A NE1 THR 113.A OG1 no hydrogen 3.194 N/A GLY 144.A N ASP 142.A OD1 no hydrogen 3.330 N/A ILE 147.A N VAL 126.A O no hydrogen 3.402 N/A GLN 148.A NE2 ALA 123.A O no hydrogen 3.237 N/A THR 149.A N GLY 124.A O no hydrogen 3.004 N/A THR 149.A OG1 GLY 124.A O no hydrogen 2.413 N/A SER 153.A N THR 150.A O no hydrogen 3.266 N/A SER 153.A OG THR 150.A O no hydrogen 2.729 N/A VAL 157.A N GLY 127.A O no hydrogen 2.907 N/A TYR 161.A OH GLN 134.A OE1 no hydrogen 2.760 N/A SER 163.A N ASP 159.A O no hydrogen 2.906 N/A SER 163.A OG ASP 159.A O no hydrogen 2.904 N/A SER 163.A OG ASP 159.A OD1 no hydrogen 3.109 N/A LEU 164.A N SER 160.A O no hydrogen 2.887 N/A LEU 165.A N TYR 161.A O no hydrogen 2.943 N/A MET 166.A N TYR 162.A O no hydrogen 2.906 N/A MET 166.A N SER 163.A O no hydrogen 3.297 N/A LEU 169.A N LEU 165.A O no hydrogen 3.317 N/A LEU 169.A N MET 166.A O no hydrogen 3.192 N/A THR 170.A OG1 PRO 167.A O no hydrogen 3.212 N/A LEU 171.A N PRO 167.A O no hydrogen 2.913 N/A THR 172.A N ILE 168.A O no hydrogen 2.995 N/A THR 172.A OG1 ILE 168.A O no hydrogen 2.499 N/A ALA 174.A N LEU 169.A O no hydrogen 3.077 N/A THR 176.A OG1 ARG 173.A O no hydrogen 3.025 N/A GLU 178.A N LEU 175.A O no hydrogen 2.905 N/A SER 179.A N THR 176.A O no hydrogen 2.912 N/A SER 179.A OG THR 176.A O no hydrogen 3.283 N/A HIS 180.A N ALA 177.A O no hydrogen 3.357 N/A HIS 180.A ND1 ASP 184.A O no hydrogen 2.660 N/A VAL 181.A N PRO 188.A O no hydrogen 3.141 N/A THR 183.A N HIS 180.A O no hydrogen 3.288 N/A THR 186.A N ASP 184.A OD1 no hydrogen 3.353 N/A THR 186.A OG1 ASP 184.A OD1 no hydrogen 3.043 N/A LYS 187.A N ASP 184.A O no hydrogen 3.283 N/A ILE 190.A N SER 179.A O no hydrogen 3.021 N/A LYS 196.A N ASP 193.A O no hydrogen 3.196 N/A THR 200.A OG1 ASP 198.A OD1 no hydrogen 3.071 N/A THR 200.A OG1 ASP 198.A OD2 no hydrogen 3.453 N/A ARG 203.A N PHE 199.A O no hydrogen 2.909 N/A LEU 204.A N THR 200.A O no hydrogen 2.925 N/A LYS 205.A N GLU 201.A O no hydrogen 2.898 N/A LEU 206.A N GLU 202.A O no hydrogen 2.907 N/A PHE 207.A N ARG 203.A O no hydrogen 2.906 N/A ASP 208.A N LEU 204.A O no hydrogen 2.903 N/A ARG 209.A N LYS 205.A O no hydrogen 2.909 N/A ARG 209.A N LEU 206.A O no hydrogen 3.288 N/A TYR 210.A N LEU 206.A O no hydrogen 2.912 N/A LYS 212.A NZ ASP 118.A OD1 no hydrogen 3.271 N/A TYR 213.A OH ASP 118.A OD1 no hydrogen 2.496 N/A TYR 218.A OH ASN 238.A OD1 no hydrogen 2.600 N/A ASN 221.A ND2 THR 200.A OG1 no hydrogen 3.225 N/A CYS 222.A N LEU 275.A O no hydrogen 3.010 N/A CYS 222.A SG ILE 231.A O no hydrogen 3.866 N/A CYS 222.A SG GLU 274.A O no hydrogen 3.732 N/A ASN 224.A N ASN 221.A O no hydrogen 3.426 N/A CYS 225.A SG HIS 219.A ND1 no hydrogen 3.571 N/A CYS 225.A SG CYS 222.A O no hydrogen 3.587 N/A ARG 229.A NH2 ARG 659.A O no hydrogen 3.133 N/A CYS 230.A N ASP 227.A O no hydrogen 2.925 N/A ILE 231.A N ASP 227.A O no hydrogen 2.879 N/A LEU 232.A N ASP 228.A O no hydrogen 2.910 N/A CYS 234.A N CYS 230.A O no hydrogen 2.893 N/A CYS 234.A SG HIS 219.A ND1 no hydrogen 3.570 N/A CYS 234.A SG HIS 219.A O no hydrogen 3.529 N/A CYS 234.A SG CYS 230.A O no hydrogen 3.093 N/A ALA 235.A N ILE 231.A O no hydrogen 2.892 N/A ASN 236.A N LEU 232.A O no hydrogen 2.919 N/A ASN 236.A ND2 CYS 388.A O no hydrogen 3.099 N/A ASN 238.A N CYS 234.A O no hydrogen 2.905 N/A ASN 238.A ND2 PRO 220.A O no hydrogen 2.804 N/A ASN 238.A ND2 GLU 274.A O no hydrogen 2.904 N/A VAL 239.A N ALA 235.A O no hydrogen 2.899 N/A PHE 241.A N PHE 237.A O no hydrogen 2.918 N/A SER 242.A N ASN 238.A O no hydrogen 2.886 N/A SER 242.A OG ASN 238.A O no hydrogen 2.518 N/A SER 242.A OG ARG 273.A O no hydrogen 2.465 N/A THR 243.A OG1 LEU 240.A O no hydrogen 3.056 N/A SER 249.A N PRO 246.A O no hydrogen 3.478 N/A SER 249.A OG PRO 246.A O no hydrogen 3.209 N/A GLY 251.A N HIS 271.A O no hydrogen 3.389 N/A LEU 253.A N GLY 269.A O no hydrogen 3.111 N/A ARG 255.A N VAL 266.A O no hydrogen 2.883 N/A ILE 257.A N PHE 264.A O no hydrogen 2.885 N/A VAL 259.A N VAL 262.A O no hydrogen 2.907 N/A ASP 260.A N SER 287.A O no hydrogen 2.624 N/A VAL 262.A N VAL 259.A O no hydrogen 2.915 N/A PHE 264.A N ILE 257.A O no hydrogen 2.872 N/A VAL 266.A N ARG 255.A O no hydrogen 2.941 N/A SER 267.A OG ASP 301.A OD1 no hydrogen 2.945 N/A THR 268.A N LEU 253.A O no hydrogen 2.565 N/A TYR 270.A N VAL 278.A O no hydrogen 2.897 N/A HIS 271.A N GLY 251.A O no hydrogen 2.981 N/A PHE 272.A N GLY 276.A O no hydrogen 2.878 N/A ARG 273.A NH2 SER 242.A O no hydrogen 3.255 N/A GLY 276.A N PHE 272.A O no hydrogen 2.922 N/A VAL 277.A N ASN 221.A OD1 no hydrogen 2.892 N/A VAL 278.A N TYR 270.A O no hydrogen 2.907 N/A ASN 280.A N THR 268.A O no hydrogen 3.508 N/A GLN 281.A N ASN 458.A OD1 no hydrogen 2.978 N/A GLN 281.A NE2 ARG 457.A O no hydrogen 2.755 N/A ASP 282.A N ASN 458.A OD1 no hydrogen 3.120 N/A LEU 295.A N SER 291.A O no hydrogen 2.824 N/A LEU 296.A N PHE 292.A O no hydrogen 2.909 N/A VAL 297.A N LYS 293.A O no hydrogen 2.922 N/A TYR 298.A N GLU 294.A O no hydrogen 2.904 N/A ALA 299.A N LEU 295.A O no hydrogen 2.885 N/A ALA 300.A N LEU 296.A O no hydrogen 2.921 N/A ASP 301.A N VAL 297.A O no hydrogen 3.224 N/A ALA 303.A N ASP 301.A OD2 no hydrogen 3.197 N/A HIS 305.A NE2 ALA 299.A O no hydrogen 3.040 N/A ALA 306.A N PRO 302.A O no hydrogen 2.901 N/A ALA 307.A N ALA 303.A O no hydrogen 2.906 N/A SER 308.A N MET 304.A O no hydrogen 2.899 N/A SER 308.A OG MET 304.A O no hydrogen 3.127 N/A SER 308.A OG HIS 305.A O no hydrogen 3.201 N/A GLY 309.A N HIS 305.A O no hydrogen 2.958 N/A ARG 316.A N ASP 314.A OD1 no hydrogen 3.073 N/A ARG 316.A NE ASP 314.A OD1 no hydrogen 3.301 N/A SER 321.A OG LEU 312.A O no hydrogen 3.113 N/A VAL 322.A N LEU 597.A O no hydrogen 2.785 N/A ALA 324.A N ASN 310.A O no hydrogen 2.840 N/A LEU 325.A N GLY 595.A O no hydrogen 3.059 N/A THR 326.A OG1 ASN 328.A O no hydrogen 3.026 N/A ASN 338.A N VAL 768.A O no hydrogen 3.234 N/A ASN 340.A N CYS 766.A O no hydrogen 2.777 N/A ASN 340.A ND2 TYR 811.A OH no hydrogen 3.544 N/A TYR 344.A N ASN 340.A O no hydrogen 3.328 N/A ASP 345.A N LYS 341.A O no hydrogen 2.894 N/A PHE 346.A N ASP 342.A O no hydrogen 2.908 N/A ALA 347.A N PHE 343.A O no hydrogen 2.893 N/A VAL 348.A N TYR 344.A O no hydrogen 2.901 N/A SER 349.A N ASP 345.A O no hydrogen 2.906 N/A SER 349.A OG ASP 345.A O no hydrogen 2.959 N/A SER 349.A OG PHE 346.A O no hydrogen 2.577 N/A LYS 350.A N ALA 347.A O no hydrogen 3.098 N/A GLY 351.A N VAL 348.A O no hydrogen 3.180 N/A PHE 352.A N ALA 347.A O no hydrogen 3.219 N/A GLY 356.A N GLU 355.A OE1 no hydrogen 2.686 N/A SER 357.A N LYS 354.A O no hydrogen 3.363 N/A SER 357.A OG LYS 354.A O no hydrogen 3.269 N/A SER 357.A OG VAL 359.A O no hydrogen 2.808 N/A LYS 362.A NZ GLU 360.A O no hydrogen 3.133 N/A PHE 364.A N SER 473.A O no hydrogen 3.376 N/A GLN 368.A NE2 ASN 476.A O no hydrogen 2.662 N/A ASP 369.A N ASP 369.A OD1 no hydrogen 2.517 N/A SER 375.A OG ALA 372.A O no hydrogen 2.372 N/A ASP 376.A N ALA 372.A O no hydrogen 2.942 N/A TYR 377.A N ALA 373.A O no hydrogen 3.373 N/A TYR 377.A OH VAL 599.A O no hydrogen 3.134 N/A ASP 378.A N ILE 374.A O no hydrogen 2.865 N/A TYR 379.A N ASP 376.A O no hydrogen 2.914 N/A TYR 380.A N TYR 377.A O no hydrogen 2.913 N/A TYR 382.A N TYR 379.A O no hydrogen 2.916 N/A ASN 383.A N TYR 380.A O no hydrogen 3.252 N/A ASN 383.A ND2 ARG 548.A O no hydrogen 3.022 N/A ASN 383.A ND2 MET 550.A O no hydrogen 2.977 N/A THR 386.A OG1 LEU 384.A O no hydrogen 3.084 N/A MET 387.A N THR 170.A OG1 no hydrogen 2.797 N/A CYS 388.A N ASN 236.A OD1 no hydrogen 3.309 N/A ARG 391.A NE ASP 159.A OD1 no hydrogen 3.203 N/A ARG 391.A NE ASP 159.A OD2 no hydrogen 3.080 N/A ARG 391.A NH1 GLN 216.A OE1 no hydrogen 2.783 N/A ARG 391.A NH2 ASP 159.A OD2 no hydrogen 3.274 N/A ARG 391.A NH2 GLN 216.A OE1 no hydrogen 3.296 N/A LEU 393.A N ASP 389.A O no hydrogen 2.793 N/A LEU 394.A N ILE 390.A O no hydrogen 2.868 N/A PHE 395.A N ARG 391.A O no hydrogen 2.951 N/A VAL 396.A N GLN 392.A O no hydrogen 2.873 N/A VAL 397.A N LEU 393.A O no hydrogen 2.885 N/A VAL 399.A N PHE 395.A O no hydrogen 2.960 N/A VAL 400.A N VAL 396.A O no hydrogen 2.865 N/A ASP 401.A N VAL 397.A O no hydrogen 2.874 N/A LYS 402.A N GLU 398.A O no hydrogen 2.947 N/A TYR 403.A N VAL 400.A O no hydrogen 2.815 N/A PHE 404.A N ASP 401.A O no hydrogen 3.061 N/A CYS 406.A SG TYR 403.A O no hydrogen 3.953 N/A ASP 408.A N SER 502.A OG no hydrogen 3.204 N/A CYS 411.A SG HIS 566.A ND1 no hydrogen 3.127 N/A ILE 412.A N GLN 494.A O no hydrogen 3.496 N/A GLN 416.A N ASN 413.A O no hydrogen 3.237 N/A VAL 417.A N ALA 414.A O no hydrogen 3.290 N/A ILE 418.A N GLN 497.A OE1 no hydrogen 2.879 N/A LYS 424.A N LEU 422.A O no hydrogen 2.824 N/A ALA 436.A N LYS 424.A O no hydrogen 2.810 N/A ARG 437.A NE ASP 423.A OD1 no hydrogen 3.261 N/A ARG 437.A NE ASP 423.A OD2 no hydrogen 3.285 N/A ARG 437.A NH2 ASP 423.A OD2 no hydrogen 2.598 N/A TYR 439.A OH PHE 430.A O no hydrogen 2.692 N/A TYR 440.A N ALA 436.A O no hydrogen 2.915 N/A ASP 441.A N ARG 437.A O no hydrogen 2.901 N/A SER 442.A N LEU 438.A O no hydrogen 2.904 N/A SER 442.A OG LEU 438.A O no hydrogen 2.455 N/A MET 443.A N TYR 439.A O no hydrogen 3.207 N/A SER 444.A OG ASP 447.A OD1 no hydrogen 3.435 N/A GLN 448.A N SER 444.A O no hydrogen 3.070 N/A ASP 449.A N TYR 445.A O no hydrogen 2.908 N/A ALA 450.A N GLU 446.A O no hydrogen 2.890 N/A LEU 451.A N ASP 447.A O no hydrogen 2.905 N/A PHE 452.A N GLN 448.A O no hydrogen 2.903 N/A ALA 453.A N ASP 449.A O no hydrogen 2.899 N/A TYR 454.A N ALA 450.A O no hydrogen 2.889 N/A THR 455.A N LEU 451.A O no hydrogen 2.916 N/A THR 455.A OG1 LEU 451.A O no hydrogen 3.132 N/A THR 455.A OG1 PHE 452.A O no hydrogen 2.611 N/A LYS 456.A N PHE 452.A O no hydrogen 2.911 N/A ARG 457.A N TYR 454.A O no hydrogen 3.164 N/A ASN 458.A N TYR 454.A O no hydrogen 2.871 N/A VAL 459.A N ASN 280.A OD1 no hydrogen 3.400 N/A ILE 460.A N ASN 581.A OD1 no hydrogen 3.071 N/A THR 464.A N MET 590.A O no hydrogen 3.164 N/A THR 464.A OG1 GLU 589.A OE2 no hydrogen 2.659 N/A GLN 465.A N GLY 483.A O no hydrogen 2.930 N/A ASN 467.A N VAL 481.A O no hydrogen 2.908 N/A LYS 469.A N ARG 479.A O no hydrogen 2.921 N/A TYR 470.A OH LYS 335.A O no hydrogen 3.106 N/A SER 473.A OG LYS 475.A O no hydrogen 3.282 N/A LYS 475.A N SER 473.A OG no hydrogen 2.995 N/A THR 480.A OG1 ASP 376.A OD2 no hydrogen 2.625 N/A VAL 481.A N ASN 467.A O no hydrogen 2.893 N/A GLY 483.A N GLN 465.A O no hydrogen 2.874 N/A CYS 487.A SG LEU 296.A O no hydrogen 3.729 N/A SER 488.A N SER 485.A O no hydrogen 3.230 N/A SER 488.A OG GLN 585.A OE1 no hydrogen 3.390 N/A THR 489.A N SER 485.A O no hydrogen 3.335 N/A THR 489.A OG1 ILE 486.A O no hydrogen 2.891 N/A MET 490.A N ILE 486.A O no hydrogen 2.919 N/A THR 491.A OG1 CYS 487.A O no hydrogen 3.141 N/A THR 491.A OG1 SER 488.A O no hydrogen 2.724 N/A ASN 492.A N SER 488.A O no hydrogen 2.903 N/A ASN 492.A ND2 SER 488.A O no hydrogen 2.564 N/A ASN 492.A ND2 THR 491.A OG1 no hydrogen 3.408 N/A ARG 493.A N THR 489.A O no hydrogen 2.912 N/A ARG 493.A NH1 TYR 440.A OH no hydrogen 2.755 N/A PHE 495.A N THR 491.A O no hydrogen 2.932 N/A HIS 496.A N ASN 492.A O no hydrogen 2.907 N/A GLN 497.A N ARG 493.A O no hydrogen 2.860 N/A GLN 497.A NE2 ILE 418.A O no hydrogen 3.617 N/A LEU 500.A N HIS 496.A O no hydrogen 2.921 N/A LYS 501.A N GLN 497.A O no hydrogen 2.883 N/A SER 502.A N LYS 498.A O no hydrogen 2.912 N/A SER 502.A OG ASP 408.A OD2 no hydrogen 3.341 N/A ILE 503.A N LEU 499.A O no hydrogen 2.908 N/A ALA 504.A N LEU 500.A O no hydrogen 3.172 N/A THR 506.A N ILE 503.A O no hydrogen 3.476 N/A THR 506.A OG1 SER 502.A O no hydrogen 2.610 N/A ARG 507.A NH1 ALA 504.A O no hydrogen 3.192 N/A ARG 507.A NH2 ALA 504.A O no hydrogen 2.982 N/A VAL 512.A N ILE 681.A O no hydrogen 3.263 N/A LYS 517.A NZ ASP 789.A OD1 no hydrogen 3.462 N/A PHE 518.A N SER 516.A OG no hydrogen 3.205 N/A TYR 519.A N MET 848.A O no hydrogen 3.013 N/A GLY 521.A N PHE 518.A O no hydrogen 3.115 N/A ASN 524.A N GLY 520.A O no hydrogen 3.161 N/A MET 525.A N GLY 521.A O no hydrogen 2.918 N/A LEU 526.A N TRP 522.A O no hydrogen 2.913 N/A LYS 527.A N HIS 523.A O no hydrogen 2.915 N/A THR 528.A N ASN 524.A O no hydrogen 2.888 N/A THR 528.A OG1 ASN 524.A O no hydrogen 2.579 N/A VAL 529.A N MET 525.A O no hydrogen 2.934 N/A TYR 530.A N LEU 526.A O no hydrogen 3.213 N/A SER 531.A OG SER 531.A O no hydrogen 2.379 N/A HIS 537.A N PHE 690.A O no hydrogen 2.915 N/A HIS 537.A ND1 PRO 536.A O no hydrogen 2.556 N/A LEU 538.A N GLU 726.A O no hydrogen 2.922 N/A MET 539.A N VAL 688.A O no hydrogen 2.882 N/A GLY 540.A N TRP 724.A O no hydrogen 2.927 N/A TYR 543.A OH ASN 619.A OD1 no hydrogen 2.588 N/A CYS 546.A SG ASP 684.A OD1 no hydrogen 3.167 N/A CYS 546.A SG ASP 684.A OD2 no hydrogen 3.227 N/A ALA 549.A N LYS 545.A O no hydrogen 2.949 N/A ARG 555.A NH1 ARG 555.A O no hydrogen 3.061 N/A ILE 556.A N ASN 552.A O no hydrogen 2.911 N/A MET 557.A N MET 553.A O no hydrogen 2.898 N/A ALA 558.A N LEU 554.A O no hydrogen 2.890 N/A SER 559.A N ARG 555.A O no hydrogen 2.915 N/A SER 559.A OG ARG 555.A O no hydrogen 3.461 N/A LEU 560.A N ILE 556.A O no hydrogen 2.899 N/A VAL 561.A N MET 557.A O no hydrogen 2.895 N/A LEU 562.A N ALA 558.A O no hydrogen 2.917 N/A ALA 563.A N SER 559.A O no hydrogen 2.901 N/A ARG 564.A N LEU 560.A O no hydrogen 2.894 N/A ARG 564.A NH1 GLU 398.A OE2 no hydrogen 2.759 N/A ARG 564.A NH2 GLU 398.A OE1 no hydrogen 3.048 N/A ARG 564.A NH2 GLU 398.A OE2 no hydrogen 2.802 N/A LYS 565.A NZ PHE 404.A O no hydrogen 2.509 N/A LYS 565.A NZ TYR 407.A O no hydrogen 3.370 N/A HIS 566.A N ALA 563.A O no hydrogen 3.086 N/A CYS 569.A SG HIS 566.A ND1 no hydrogen 3.484 N/A CYS 570.A SG HIS 566.A ND1 no hydrogen 3.609 N/A ARG 575.A N SER 571.A O no hydrogen 3.165 N/A PHE 576.A N LEU 572.A O no hydrogen 2.925 N/A TYR 577.A N SER 573.A O no hydrogen 2.891 N/A TYR 577.A OH HIS 279.A O no hydrogen 2.984 N/A ARG 578.A N HIS 574.A O no hydrogen 2.910 N/A LEU 579.A N ARG 575.A O no hydrogen 2.918 N/A ALA 580.A N PHE 576.A O no hydrogen 2.900 N/A ASN 581.A N TYR 577.A O no hydrogen 2.879 N/A ASN 581.A ND2 ASN 458.A O no hydrogen 2.732 N/A ASN 581.A ND2 TYR 577.A O no hydrogen 2.801 N/A GLU 582.A N ARG 578.A O no hydrogen 2.916 N/A CYS 583.A N LEU 579.A O no hydrogen 2.906 N/A CYS 583.A SG LEU 579.A O no hydrogen 3.157 N/A ALA 584.A N ALA 580.A O no hydrogen 2.892 N/A GLN 585.A N ASN 581.A O no hydrogen 2.909 N/A GLN 585.A NE2 ILE 460.A O no hydrogen 2.998 N/A SER 588.A N CYS 583.A O no hydrogen 2.690 N/A VAL 591.A N TYR 598.A O no hydrogen 2.908 N/A MET 592.A N THR 464.A O no hydrogen 3.236 N/A CYS 593.A N SER 596.A O no hydrogen 2.902 N/A SER 596.A N CYS 593.A O no hydrogen 2.909 N/A LEU 597.A N ALA 323.A O no hydrogen 2.898 N/A TYR 598.A N VAL 591.A O no hydrogen 2.876 N/A TYR 598.A OH ASP 314.A OD2 no hydrogen 3.021 N/A VAL 599.A N PHE 320.A O no hydrogen 3.002 N/A LYS 600.A N GLU 589.A O no hydrogen 3.291 N/A LYS 600.A NZ TYR 380.A OH no hydrogen 3.419 N/A LYS 600.A NZ VAL 586.A O no hydrogen 3.254 N/A LYS 600.A NZ GLU 589.A OE2 no hydrogen 3.285 N/A LYS 600.A NZ SER 605.A OG no hydrogen 2.473 N/A GLY 603.A N ASN 552.A OD1 no hydrogen 3.461 N/A THR 604.A N ASP 547.A O no hydrogen 3.102 N/A SER 605.A OG VAL 586.A O no hydrogen 3.254 N/A SER 605.A OG GLU 589.A OE1 no hydrogen 3.299 N/A SER 605.A OG GLU 589.A OE2 no hydrogen 3.210 N/A THR 611.A OG1 ASP 608.A O no hydrogen 2.498 N/A ASN 615.A N THR 611.A O no hydrogen 3.191 N/A ASN 615.A ND2 THR 611.A O no hydrogen 2.449 N/A SER 616.A N ALA 612.A O no hydrogen 2.904 N/A SER 616.A OG ALA 612.A O no hydrogen 2.632 N/A VAL 617.A N TYR 613.A O no hydrogen 2.923 N/A PHE 618.A N ALA 614.A O no hydrogen 2.904 N/A ASN 619.A N ASN 615.A O no hydrogen 2.881 N/A ASN 619.A ND2 SER 683.A O no hydrogen 3.549 N/A ILE 620.A N SER 616.A O no hydrogen 2.938 N/A CYS 621.A N VAL 617.A O no hydrogen 2.903 N/A GLN 622.A N PHE 618.A O no hydrogen 2.899 N/A ALA 623.A N ASN 619.A O no hydrogen 2.908 N/A VAL 624.A N ILE 620.A O no hydrogen 2.931 N/A THR 625.A N CYS 621.A O no hydrogen 2.882 N/A THR 625.A OG1 CYS 621.A O no hydrogen 2.500 N/A ALA 626.A N GLN 622.A O no hydrogen 2.902 N/A ASN 627.A N ALA 623.A O no hydrogen 2.911 N/A ASN 627.A ND2 ALA 623.A O no hydrogen 2.889 N/A VAL 628.A N VAL 624.A O no hydrogen 2.914 N/A ASN 629.A N THR 625.A O no hydrogen 2.900 N/A ASN 629.A ND2 GLN 392.A OE1 no hydrogen 3.091 N/A ASN 629.A ND2 THR 625.A O no hydrogen 2.587 N/A ALA 630.A N ALA 626.A O no hydrogen 2.879 N/A LEU 631.A N ASN 627.A O no hydrogen 2.923 N/A LEU 632.A N VAL 628.A O no hydrogen 3.021 N/A SER 633.A N ALA 630.A O no hydrogen 3.390 N/A SER 633.A OG HIS 57.A NE2 no hydrogen 3.230 N/A SER 633.A OG ASN 629.A O no hydrogen 2.365 N/A THR 634.A OG1 ALA 630.A O no hydrogen 3.328 N/A THR 634.A OG1 LEU 631.A O no hydrogen 3.531 N/A THR 634.A OG1 GLY 698.A O no hydrogen 2.895 N/A ASN 637.A ND2 ASP 635.A OD1 no hydrogen 2.496 N/A TYR 643.A N ASP 641.A OD1 no hydrogen 2.799 N/A ASN 646.A N LYS 642.A O no hydrogen 2.914 N/A LEU 647.A N TYR 643.A O no hydrogen 2.897 N/A GLN 648.A N VAL 644.A O no hydrogen 2.862 N/A GLN 648.A NE2 LEU 631.A O no hydrogen 2.459 N/A HIS 649.A N ARG 645.A O no hydrogen 2.935 N/A HIS 649.A NE2 ASN 9.A O no hydrogen 2.410 N/A ARG 650.A N ASN 646.A O no hydrogen 2.914 N/A LEU 651.A N LEU 647.A O no hydrogen 2.847 N/A TYR 652.A N GLN 648.A O no hydrogen 2.929 N/A TYR 652.A OH ASP 6.A OD1 no hydrogen 2.405 N/A TYR 652.A OH ASP 6.A OD2 no hydrogen 3.420 N/A GLU 653.A N HIS 649.A O no hydrogen 2.928 N/A CYS 654.A N ARG 650.A O no hydrogen 2.879 N/A CYS 654.A SG ARG 650.A O no hydrogen 3.244 N/A LEU 655.A N LEU 651.A O no hydrogen 2.902 N/A LEU 655.A N TYR 652.A O no hydrogen 3.252 N/A TYR 656.A N TYR 652.A O no hydrogen 2.934 N/A TYR 656.A OH ASP 389.A OD2 no hydrogen 2.697 N/A ARG 657.A N GLU 653.A O no hydrogen 2.869 N/A ARG 659.A NH1 ASP 215.A OD1 no hydrogen 3.180 N/A ARG 659.A NH2 ASP 215.A OD1 no hydrogen 3.077 N/A ARG 659.A NH2 ASP 215.A OD2 no hydrogen 2.963 N/A VAL 666.A N ASP 662.A O no hydrogen 3.120 N/A ASN 667.A N THR 663.A O no hydrogen 2.905 N/A GLU 668.A N ASP 664.A O no hydrogen 2.946 N/A PHE 669.A N PHE 665.A O no hydrogen 2.864 N/A TYR 670.A N VAL 666.A O no hydrogen 2.898 N/A ALA 671.A N ASN 667.A O no hydrogen 2.927 N/A TYR 672.A N GLU 668.A O no hydrogen 2.900 N/A TYR 672.A OH LEU 699.A O no hydrogen 2.974 N/A LEU 673.A N PHE 669.A O no hydrogen 2.893 N/A ARG 674.A N TYR 670.A O no hydrogen 2.923 N/A LYS 675.A N ALA 671.A O no hydrogen 2.899 N/A LYS 675.A NZ ASP 532.A O no hydrogen 3.002 N/A HIS 676.A N TYR 672.A O no hydrogen 2.911 N/A SER 678.A N CYS 689.A O no hydrogen 2.919 N/A SER 678.A OG ARG 674.A O no hydrogen 3.546 N/A MET 680.A N VAL 687.A O no hydrogen 2.907 N/A ILE 681.A N THR 510.A O no hydrogen 3.200 N/A LEU 682.A N ASP 685.A O no hydrogen 2.888 N/A SER 683.A N SER 616.A OG no hydrogen 3.266 N/A ASP 685.A N LEU 682.A O no hydrogen 2.919 N/A VAL 687.A N MET 680.A O no hydrogen 2.914 N/A VAL 688.A N MET 539.A O no hydrogen 2.950 N/A CYS 689.A N SER 678.A O no hydrogen 2.885 N/A PHE 690.A N HIS 537.A O no hydrogen 2.917 N/A ASN 691.A ND2 GLU 534.A OE2 no hydrogen 2.890 N/A SER 692.A N ASN 535.A O no hydrogen 2.593 N/A THR 693.A N ASN 691.A OD1 no hydrogen 3.081 N/A THR 693.A OG1 ASN 535.A OD1 no hydrogen 2.685 N/A ALA 695.A N ASN 691.A O no hydrogen 3.108 N/A SER 696.A N SER 692.A O no hydrogen 2.895 N/A GLN 697.A N THR 693.A O no hydrogen 2.921 N/A GLY 698.A N ALA 695.A O no hydrogen 3.293 N/A LEU 699.A N TYR 694.A O no hydrogen 2.564 N/A ALA 701.A N ASN 627.A OD1 no hydrogen 3.233 N/A PHE 706.A N SER 702.A O no hydrogen 3.094 N/A LYS 707.A N ILE 703.A O no hydrogen 2.897 N/A SER 708.A N LYS 704.A O no hydrogen 2.895 N/A SER 708.A OG PHE 58.A O no hydrogen 3.220 N/A SER 708.A OG LYS 704.A O no hydrogen 2.656 N/A VAL 709.A N ASN 705.A O no hydrogen 2.918 N/A LEU 710.A N PHE 706.A O no hydrogen 2.899 N/A TYR 711.A N LYS 707.A O no hydrogen 2.877 N/A TYR 711.A OH TYR 87.A O no hydrogen 2.820 N/A TYR 711.A OH TYR 99.A OH no hydrogen 2.839 N/A TYR 712.A N SER 708.A O no hydrogen 2.952 N/A TYR 712.A OH GLN 392.A OE1 no hydrogen 2.953 N/A TYR 712.A OH ASN 629.A OD1 no hydrogen 3.122 N/A GLN 713.A N VAL 709.A O no hydrogen 2.783 N/A VAL 716.A N LEU 710.A O no hydrogen 3.166 N/A LYS 722.A N SER 719.A O no hydrogen 3.378 N/A CYS 723.A SG SER 719.A O no hydrogen 3.564 N/A TRP 724.A N GLY 540.A O no hydrogen 2.898 N/A GLU 726.A N LEU 538.A O no hydrogen 2.875 N/A THR 730.A OG1 ASP 728.A OD2 no hydrogen 3.120 N/A PHE 736.A N GLN 739.A O no hydrogen 2.829 N/A CYS 737.A N ASP 685.A OD2 no hydrogen 2.661 N/A CYS 737.A SG ASP 685.A OD2 no hydrogen 3.918 N/A GLN 739.A N PHE 736.A O no hydrogen 3.083 N/A HIS 740.A N TYR 755.A O no hydrogen 2.917 N/A MET 742.A N LEU 753.A O no hydrogen 2.949 N/A VAL 744.A N VAL 751.A O no hydrogen 2.900 N/A LYS 745.A NZ ASP 748.A OD1 no hydrogen 3.500 N/A GLN 746.A N ASP 749.A O no hydrogen 2.778 N/A ASP 749.A N GLN 746.A O no hydrogen 3.330 N/A VAL 751.A N VAL 744.A O no hydrogen 2.914 N/A TYR 752.A OH LEU 729.A O no hydrogen 2.849 N/A LEU 753.A N MET 742.A O no hydrogen 2.863 N/A TYR 755.A N HIS 740.A O no hydrogen 2.863 N/A SER 759.A OG ASP 757.A OD2 no hydrogen 3.253 N/A ARG 760.A N ASP 757.A O no hydrogen 3.158 N/A ARG 760.A NH2 ARG 760.A O no hydrogen 3.419 N/A ILE 761.A N ASP 757.A O no hydrogen 3.457 N/A LEU 762.A N PRO 758.A O no hydrogen 2.910 N/A GLY 763.A N SER 759.A O no hydrogen 2.882 N/A ALA 764.A N ARG 760.A O no hydrogen 2.922 N/A GLY 765.A N ILE 761.A O no hydrogen 2.921 N/A CYS 766.A N LEU 762.A O no hydrogen 2.896 N/A CYS 766.A SG LEU 762.A O no hydrogen 3.099 N/A PHE 767.A N GLY 763.A O no hydrogen 2.877 N/A VAL 772.A N ASP 770.A OD1 no hydrogen 3.414 N/A LYS 773.A NZ ASP 769.A OD1 no hydrogen 2.506 N/A THR 774.A N ILE 771.A O no hydrogen 3.154 N/A THR 774.A OG1 ASP 770.A O no hydrogen 3.535 N/A THR 774.A OG1 ILE 771.A O no hydrogen 3.436 N/A THR 777.A OG1 GLY 776.A O no hydrogen 2.275 N/A PHE 783.A N MET 779.A O no hydrogen 2.889 N/A VAL 784.A N ILE 780.A O no hydrogen 2.893 N/A SER 785.A N GLU 781.A O no hydrogen 2.906 N/A SER 785.A OG GLU 781.A O no hydrogen 3.014 N/A LEU 786.A N ARG 782.A O no hydrogen 2.922 N/A ALA 787.A N PHE 783.A O no hydrogen 2.874 N/A ILE 788.A N VAL 784.A O no hydrogen 2.889 N/A ASP 789.A N SER 785.A O no hydrogen 2.919 N/A ALA 790.A N LEU 786.A O no hydrogen 2.909 N/A LEU 793.A N ALA 790.A O no hydrogen 3.073 N/A THR 794.A N TYR 791.A O no hydrogen 3.002 N/A LYS 795.A NZ TYR 791.A OH no hydrogen 3.413 N/A HIS 796.A N LEU 793.A O no hydrogen 3.158 N/A HIS 796.A NE2 TYR 755.A OH no hydrogen 3.133 N/A TYR 801.A N ASN 798.A O no hydrogen 3.095 N/A ALA 802.A N ASN 798.A O no hydrogen 3.334 N/A ASP 803.A N GLN 799.A O no hydrogen 2.913 N/A LEU 807.A N ASP 803.A O no hydrogen 2.898 N/A TYR 808.A N VAL 804.A O no hydrogen 2.907 N/A LEU 809.A N PHE 805.A O no hydrogen 2.932 N/A GLN 810.A N HIS 806.A O no hydrogen 2.922 N/A GLN 810.A NE2 HIS 806.A O no hydrogen 2.919 N/A TYR 811.A N LEU 807.A O no hydrogen 2.893 N/A ILE 812.A N TYR 808.A O no hydrogen 2.911 N/A ARG 813.A N LEU 809.A O no hydrogen 2.960 N/A LYS 814.A N GLN 810.A O no hydrogen 2.899 N/A LYS 814.A NZ ASP 342.A OD1 no hydrogen 2.846 N/A LYS 814.A NZ GLU 818.A OE2 no hydrogen 2.918 N/A LEU 815.A N TYR 811.A O no hydrogen 2.869 N/A HIS 816.A N ILE 812.A O no hydrogen 2.925 N/A HIS 816.A NE2 ASN 833.A OD1 no hydrogen 2.756 N/A ASP 817.A N ARG 813.A O no hydrogen 2.923 N/A GLU 818.A N LYS 814.A O no hydrogen 2.917 N/A LEU 819.A N LEU 815.A O no hydrogen 2.891 N/A THR 820.A N HIS 816.A O no hydrogen 2.904 N/A THR 820.A OG1 HIS 816.A O no hydrogen 2.938 N/A THR 820.A OG1 ASP 817.A O no hydrogen 2.521 N/A GLY 821.A N ASP 817.A O no hydrogen 2.919 N/A HIS 822.A N GLU 818.A O no hydrogen 2.902 N/A MET 823.A N LEU 819.A O no hydrogen 2.927 N/A LEU 824.A N THR 820.A O no hydrogen 2.903 N/A ASP 825.A N GLY 821.A O no hydrogen 2.896 N/A MET 826.A N HIS 822.A O no hydrogen 2.917 N/A TYR 827.A N MET 823.A O no hydrogen 2.878 N/A THR 836.A N ASN 833.A O no hydrogen 2.904 N/A THR 836.A OG1 ASN 833.A O no hydrogen 2.937 N/A SER 837.A N ASP 834.A O no hydrogen 2.907 N/A SER 837.A OG GLU 841.A OE1 no hydrogen 3.535 N/A TYR 839.A N THR 836.A O no hydrogen 2.918 N/A TRP 840.A N SER 837.A O no hydrogen 2.916 N/A TYR 845.A OH TYR 839.A O no hydrogen 2.640 N/A GLU 846.A N PRO 842.A O no hydrogen 2.964 N/A ALA 847.A N GLU 843.A O no hydrogen 2.921 N/A TYR 849.A N GLU 846.A O no hydrogen 3.330 N/A TYR 849.A OH ILE 788.A O no hydrogen 3.054 N/A THR 850.A N ALA 847.A O no hydrogen 3.433 N/A THR 850.A OG1 ALA 847.A O no hydrogen 2.735 N/A