Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7crw_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N GLY 578.A O no hydrogen 3.284 N/A PHE 3.A N LYS 580.A O no hydrogen 3.066 N/A GLY 12.A N SER 9.A OG no hydrogen 3.095 N/A LEU 13.A N SER 9.A O no hydrogen 3.022 N/A ARG 14.A N TRP 10.A O no hydrogen 2.945 N/A ASN 15.A N ASP 11.A O no hydrogen 2.869 N/A ILE 16.A N GLY 12.A O no hydrogen 2.933 N/A ILE 17.A N LEU 13.A O no hydrogen 2.966 N/A HIS 18.A N ARG 14.A O no hydrogen 2.916 N/A GLY 19.A N ASN 15.A O no hydrogen 2.918 N/A SER 20.A N ILE 16.A O no hydrogen 2.888 N/A SER 20.A OG THR 610.A OG1 no hydrogen 2.798 N/A ARG 21.A N ILE 17.A O no hydrogen 2.948 N/A ARG 21.A NE GLU 796.A OE1 no hydrogen 3.258 N/A ARG 21.A NH1 GLU 796.A OE2 no hydrogen 3.079 N/A LYS 22.A N HIS 18.A O no hydrogen 2.924 N/A SER 23.A N SER 20.A O no hydrogen 3.276 N/A SER 23.A OG SER 23.A O no hydrogen 2.527 N/A SER 23.A OG ASP 548.A OD1 no hydrogen 3.222 N/A SER 23.A OG ASP 548.A OD2 no hydrogen 3.030 N/A LYS 25.A NZ ASN 56.A OD1 no hydrogen 3.075 N/A HIS 28.A N LEU 47.A O no hydrogen 2.624 N/A GLN 31.A N TYR 45.A O no hydrogen 2.910 N/A VAL 33.A N ARG 43.A O no hydrogen 2.925 N/A LYS 35.A N SER 41.A O no hydrogen 3.492 N/A SER 41.A N ILE 63.A O no hydrogen 2.796 N/A HIS 42.A N ILE 63.A O no hydrogen 3.332 N/A ARG 43.A N VAL 33.A O no hydrogen 2.882 N/A ARG 43.A NH1 ASP 116.A OD2 no hydrogen 3.305 N/A ARG 43.A NH1 MET 123.A O no hydrogen 2.953 N/A ARG 43.A NH2 MET 123.A O no hydrogen 3.443 N/A LEU 44.A N SER 61.A O no hydrogen 2.893 N/A TYR 45.A N GLN 31.A O no hydrogen 2.920 N/A TYR 45.A OH ASP 116.A OD2 no hydrogen 2.249 N/A TYR 46.A N LEU 59.A O no hydrogen 2.909 N/A GLY 48.A N SER 57.A O no hydrogen 2.929 N/A ARG 54.A NE GLY 52.A O no hydrogen 2.520 N/A ARG 54.A NH2 GLY 52.A O no hydrogen 3.080 N/A ASN 56.A N PHE 89.A O no hydrogen 2.330 N/A ASN 56.A ND2 PHE 89.A O no hydrogen 3.220 N/A SER 57.A N GLY 48.A O no hydrogen 2.890 N/A LEU 59.A N TYR 46.A O no hydrogen 2.885 N/A SER 61.A N LEU 44.A O no hydrogen 2.901 N/A SER 61.A OG SER 76.A O no hydrogen 3.543 N/A LYS 65.A N PRO 39.A O no hydrogen 3.446 N/A GLU 70.A N GLU 70.A OE2 no hydrogen 2.398 N/A LYS 78.A N TYR 60.A O no hydrogen 3.292 N/A ASP 82.A N MET 127.A O no hydrogen 3.192 N/A ILE 91.A N ASN 56.A O no hydrogen 2.567 N/A SER 93.A OG TYR 94.A O no hydrogen 3.567 N/A TYR 94.A OH GLN 31.A OE1 no hydrogen 3.142 N/A ASP 95.A N LEU 104.A O no hydrogen 2.892 N/A PHE 96.A N ASP 95.A OD1 no hydrogen 2.866 N/A HIS 97.A N LEU 102.A O no hydrogen 2.884 N/A SER 98.A OG GLU 99.A OE1 no hydrogen 2.763 N/A GLU 99.A N GLU 99.A OE1 no hydrogen 2.548 N/A SER 100.A N HIS 97.A ND1 no hydrogen 3.092 N/A SER 100.A OG HIS 97.A ND1 no hydrogen 2.514 N/A LEU 102.A N HIS 97.A O no hydrogen 2.909 N/A PHE 103.A N CYS 114.A O no hydrogen 2.858 N/A LEU 104.A N ASP 95.A O no hydrogen 2.912 N/A PHE 105.A N PHE 112.A O no hydrogen 2.949 N/A ALA 107.A N SER 110.A O no hydrogen 2.846 N/A ASN 109.A N ALA 107.A O no hydrogen 2.302 N/A SER 110.A N ALA 107.A O no hydrogen 3.048 N/A SER 110.A OG ASN 109.A O no hydrogen 2.715 N/A PHE 112.A N PHE 105.A O no hydrogen 2.882 N/A HIS 113.A N LEU 130.A O no hydrogen 3.091 N/A CYS 114.A N PHE 103.A O no hydrogen 2.904 N/A ASP 116.A N GLY 101.A O no hydrogen 3.071 N/A MET 123.A N ASP 116.A OD1 no hydrogen 2.872 N/A SER 125.A OG PRO 126.A O no hydrogen 3.492 N/A MET 127.A N MET 80.A O no hydrogen 2.674 N/A LEU 130.A N HIS 113.A O no hydrogen 3.173 N/A ILE 132.A N LEU 111.A O no hydrogen 3.337 N/A THR 134.A OG1 GLU 171.A OE1 no hydrogen 3.369 N/A THR 134.A OG1 GLU 171.A OE2 no hydrogen 3.336 N/A GLN 135.A N GLU 171.A OE2 no hydrogen 2.657 N/A CYS 136.A N THR 134.A OG1 no hydrogen 3.125 N/A CYS 136.A SG THR 134.A OG1 no hydrogen 3.452 N/A CYS 136.A SG GLU 171.A OE1 no hydrogen 3.289 N/A ARG 140.A NH1 ILE 132.A O no hydrogen 3.508 N/A ARG 140.A NH2 ILE 132.A O no hydrogen 3.398 N/A MET 141.A N ILE 156.A O no hydrogen 3.087 N/A LYS 144.A N SER 154.A O no hydrogen 3.039 N/A LYS 144.A NZ CYS 205.A O no hydrogen 2.918 N/A CYS 146.A N PHE 152.A O no hydrogen 3.219 N/A ASP 149.A N CYS 146.A O no hydrogen 2.919 N/A ALA 151.A N ASP 149.A OD1 no hydrogen 3.076 N/A PHE 153.A N ALA 164.A O no hydrogen 2.918 N/A SER 154.A N LYS 144.A O no hydrogen 3.011 N/A PHE 155.A N TRP 162.A O no hydrogen 2.914 N/A ILE 156.A N MET 141.A O no hydrogen 2.889 N/A ASN 157.A N ASP 160.A O no hydrogen 2.920 N/A ASN 158.A ND2 SER 137.A OG no hydrogen 3.429 N/A ASP 160.A N ASN 157.A O no hydrogen 2.924 N/A TRP 162.A N PHE 155.A O no hydrogen 2.894 N/A VAL 163.A N ARG 172.A O no hydrogen 2.909 N/A ALA 164.A N PHE 153.A O no hydrogen 2.896 N/A ASN 165.A N GLU 170.A O no hydrogen 2.957 N/A ASN 165.A ND2 GLY 272.A O no hydrogen 3.270 N/A ILE 166.A N ALA 151.A O no hydrogen 2.892 N/A GLU 167.A N ASN 165.A OD1 no hydrogen 3.098 N/A ARG 173.A NE THR 175.A O no hydrogen 2.766 N/A ARG 173.A NH2 ASP 160.A OD2 no hydrogen 2.360 N/A ARG 173.A NH2 HIS 178.A O no hydrogen 3.071 N/A LEU 174.A N LEU 161.A O no hydrogen 3.192 N/A CYS 177.A N ASP 160.A OD1 no hydrogen 2.962 N/A CYS 177.A SG GLU 223.A OE2 no hydrogen 3.160 N/A HIS 178.A N ASP 160.A OD2 no hydrogen 2.813 N/A GLN 179.A NE2 ASP 183.A O no hydrogen 3.047 N/A ASN 184.A ND2 GLY 180.A O no hydrogen 2.960 N/A SER 187.A N VAL 224.A O no hydrogen 2.966 N/A ALA 188.A N ASN 159.A O no hydrogen 2.631 N/A GLY 189.A N GLU 222.A O no hydrogen 2.686 N/A GLN 196.A N THR 192.A O no hydrogen 2.987 N/A GLU 197.A N PHE 193.A O no hydrogen 2.913 N/A GLU 198.A N VAL 194.A O no hydrogen 2.836 N/A PHE 199.A N ILE 195.A O no hydrogen 3.309 N/A ARG 201.A N ILE 195.A O no hydrogen 3.374 N/A ARG 201.A NE THR 203.A O no hydrogen 2.947 N/A ARG 201.A NH2 THR 203.A O no hydrogen 3.466 N/A ARG 201.A NH2 GLU 222.A OE2 no hydrogen 2.343 N/A THR 203.A OG1 ASP 142.A OD2 no hydrogen 2.551 N/A CYS 205.A SG SER 154.A OG no hydrogen 3.766 N/A CYS 208.A N ARG 218.A O no hydrogen 3.043 N/A CYS 208.A SG THR 210.A O no hydrogen 3.816 N/A THR 210.A OG1 ASP 304.A O no hydrogen 2.597 N/A LYS 215.A N THR 268.A O no hydrogen 3.011 N/A LYS 215.A NZ ASP 149.A OD2 no hydrogen 3.077 N/A THR 216.A N SER 212.A O no hydrogen 3.374 N/A THR 216.A OG1 LEU 266.A O no hydrogen 3.514 N/A LEU 217.A N LEU 266.A O no hydrogen 2.801 N/A LEU 220.A N TRP 206.A O no hydrogen 2.863 N/A TYR 221.A N LYS 262.A O no hydrogen 3.111 N/A TYR 221.A OH GLU 279.A OE1 no hydrogen 2.923 N/A GLU 223.A N ALA 260.A O no hydrogen 2.765 N/A VAL 224.A N SER 187.A O no hydrogen 3.083 N/A ASP 225.A N LYS 258.A O no hydrogen 3.142 N/A GLU 226.A N PRO 185.A O no hydrogen 2.914 N/A VAL 229.A N GLU 226.A O no hydrogen 3.447 N/A ILE 232.A N TYR 247.A O no hydrogen 3.144 N/A VAL 234.A N ASP 245.A O no hydrogen 2.989 N/A SER 236.A N LYS 243.A O no hydrogen 3.193 N/A GLU 240.A N GLU 240.A OE1 no hydrogen 2.547 N/A ARG 242.A N LEU 239.A O no hydrogen 3.290 N/A ASP 245.A N VAL 234.A O no hydrogen 2.776 N/A SER 246.A OG HIS 233.A NE2 no hydrogen 2.977 N/A TYR 247.A N ILE 232.A O no hydrogen 3.314 N/A ARG 248.A NH1 SER 227.A O no hydrogen 3.208 N/A ARG 248.A NH1 VAL 229.A O no hydrogen 2.728 N/A ARG 248.A NH2 LEU 182.A O no hydrogen 3.486 N/A TYR 249.A N GLU 230.A O no hydrogen 3.213 N/A ARG 251.A NE GLU 230.A OE1 no hydrogen 2.853 N/A THR 252.A N TYR 706.A O no hydrogen 2.486 N/A THR 252.A OG1 TYR 725.A OH no hydrogen 3.092 N/A GLY 253.A N GLU 712.A OE2 no hydrogen 3.491 N/A SER 254.A N ARG 251.A O no hydrogen 2.805 N/A LYS 255.A N SER 254.A OG no hydrogen 2.416 N/A ASN 256.A ND2 GLU 294.A OE2 no hydrogen 3.546 N/A ASN 256.A ND2 TYR 295.A OH no hydrogen 2.969 N/A LYS 258.A N ASP 225.A O no hydrogen 3.389 N/A ALA 260.A N GLU 223.A O no hydrogen 3.135 N/A LYS 262.A N TYR 221.A O no hydrogen 3.124 N/A LEU 266.A N LEU 217.A O no hydrogen 3.174 N/A GLN 267.A N SER 276.A O no hydrogen 2.975 N/A THR 268.A N LYS 215.A O no hydrogen 2.982 N/A THR 268.A OG1 LYS 273.A O no hydrogen 2.727 N/A GLY 272.A N ASP 269.A O no hydrogen 2.930 N/A LYS 273.A N ASP 269.A OD1 no hydrogen 3.105 N/A ILE 274.A N GLU 170.A OE2 no hydrogen 3.104 N/A VAL 275.A N GLN 267.A O no hydrogen 2.719 N/A CYS 278.A SG GLU 279.A O no hydrogen 3.362 N/A LYS 280.A NZ GLU 265.A OE1 no hydrogen 2.863 N/A LYS 280.A NZ GLU 265.A OE2 no hydrogen 3.221 N/A GLU 281.A N ILE 331.A O no hydrogen 2.934 N/A SER 288.A N PRO 285.A O no hydrogen 2.822 N/A SER 288.A OG PRO 285.A O no hydrogen 2.567 N/A LEU 289.A N PRO 285.A O no hydrogen 2.849 N/A PHE 290.A N PHE 286.A O no hydrogen 3.185 N/A GLU 294.A N LEU 313.A O no hydrogen 2.663 N/A TYR 295.A N LEU 313.A O no hydrogen 2.961 N/A TYR 295.A OH THR 708.A OG1 no hydrogen 3.359 N/A ALA 297.A N MET 311.A O no hydrogen 2.852 N/A ARG 298.A NH1 PHE 199.A O no hydrogen 2.871 N/A GLY 300.A N TRP 309.A O no hydrogen 2.781 N/A TRP 301.A NE1 TRP 206.A O no hydrogen 3.083 N/A THR 302.A N TYR 307.A O no hydrogen 3.249 N/A THR 302.A OG1 ASP 304.A OD1 no hydrogen 2.830 N/A ARG 306.A N ASP 304.A OD1 no hydrogen 3.235 N/A ALA 308.A N LEU 325.A O no hydrogen 2.709 N/A TRP 309.A N GLY 300.A O no hydrogen 2.552 N/A TRP 309.A NE1 TRP 301.A O no hydrogen 3.181 N/A ALA 310.A N VAL 323.A O no hydrogen 3.260 N/A MET 311.A N ARG 298.A O no hydrogen 2.844 N/A PHE 312.A N GLN 321.A O no hydrogen 3.251 N/A LEU 313.A N TYR 295.A O no hydrogen 3.015 N/A GLN 317.A N ASP 314.A O no hydrogen 3.150 N/A GLN 317.A NE2 GLY 709.A O no hydrogen 3.236 N/A GLN 318.A N ASP 314.A OD1 no hydrogen 3.136 N/A ARG 319.A N ASP 314.A OD1 no hydrogen 3.417 N/A LEU 320.A N GLU 359.A O no hydrogen 3.030 N/A GLN 321.A N PHE 312.A O no hydrogen 3.290 N/A LEU 322.A N TYR 357.A O no hydrogen 2.833 N/A VAL 323.A N ALA 310.A O no hydrogen 3.089 N/A LEU 324.A N PHE 354.A O no hydrogen 2.863 N/A LEU 325.A N ALA 308.A O no hydrogen 2.511 N/A LEU 329.A N PRO 326.A O no hydrogen 3.107 N/A PHE 330.A N PRO 327.A O no hydrogen 3.479 N/A ILE 331.A N GLU 281.A O no hydrogen 2.826 N/A GLU 335.A N GLU 335.A OE1 no hydrogen 2.446 N/A GLN 339.A N SER 336.A OG no hydrogen 3.317 N/A TRP 340.A N SER 336.A O no hydrogen 3.117 N/A GLU 342.A N ALA 338.A O no hydrogen 3.147 N/A ALA 343.A N GLN 339.A O no hydrogen 3.200 N/A ALA 344.A N TRP 340.A O no hydrogen 2.780 N/A ARG 345.A N GLU 342.A O no hydrogen 3.376 N/A ALA 346.A N ALA 343.A O no hydrogen 3.354 N/A GLN 352.A NE2 PRO 353.A O no hydrogen 3.542 N/A PHE 354.A N LEU 324.A O no hydrogen 3.208 N/A ILE 355.A N PHE 423.A O no hydrogen 2.859 N/A TYR 357.A OH GLU 430.A OE2 no hydrogen 2.893 N/A GLU 359.A N LEU 320.A O no hydrogen 2.546 N/A THR 361.A N GLN 318.A O no hydrogen 3.493 N/A VAL 363.A N THR 361.A OG1 no hydrogen 3.174 N/A ASN 366.A ND2 GLU 390.A OE1 no hydrogen 3.339 N/A HIS 368.A ND1 SER 442.A OG no hydrogen 2.365 N/A HIS 368.A NE2 GLU 390.A OE1 no hydrogen 3.163 N/A HIS 372.A N LEU 386.A O no hydrogen 2.793 N/A PHE 374.A N CYS 384.A O no hydrogen 3.171 N/A GLN 376.A N GLN 376.A OE1 no hydrogen 2.548 N/A GLN 380.A NE2 GLN 381.A OE1 no hydrogen 3.530 N/A GLN 381.A N GLN 381.A OE1 no hydrogen 2.559 N/A CYS 384.A SG VAL 401.A O no hydrogen 3.265 N/A CYS 384.A SG THR 402.A OG1 no hydrogen 2.646 N/A PHE 385.A N VAL 401.A O no hydrogen 3.005 N/A LEU 386.A N HIS 372.A O no hydrogen 2.922 N/A ARG 387.A N TYR 399.A O no hydrogen 2.976 N/A ARG 387.A NE GLU 359.A OE2 no hydrogen 2.869 N/A ARG 387.A NH2 GLU 359.A OE2 no hydrogen 3.209 N/A ARG 387.A NH2 HIS 368.A O no hydrogen 3.565 N/A ASN 389.A ND2 TYR 357.A OH no hydrogen 2.897 N/A CYS 391.A SG VAL 360.A O no hydrogen 4.050 N/A CYS 391.A SG ASN 389.A OD1 no hydrogen 3.762 N/A LYS 392.A N ASN 389.A OD1 no hydrogen 2.686 N/A GLY 394.A N GLU 390.A O no hydrogen 3.286 N/A CYS 396.A SG VAL 440.A O no hydrogen 3.345 N/A CYS 396.A SG SER 442.A OG no hydrogen 3.778 N/A HIS 397.A N ASN 389.A O no hydrogen 2.998 N/A HIS 397.A ND1 THR 434.A OG1 no hydrogen 2.640 N/A HIS 397.A NE2 GLY 436.A O no hydrogen 2.801 N/A LEU 398.A N THR 434.A OG1 no hydrogen 3.369 N/A TYR 399.A N ARG 387.A O no hydrogen 3.001 N/A ARG 400.A N VAL 431.A O no hydrogen 3.133 N/A ARG 400.A NE GLU 429.A OE2 no hydrogen 3.273 N/A ARG 400.A NH2 TYR 476.A O no hydrogen 2.578 N/A ARG 400.A NH2 GLU 477.A O no hydrogen 2.805 N/A VAL 401.A N PHE 385.A O no hydrogen 3.166 N/A THR 402.A N GLU 429.A O no hydrogen 3.303 N/A THR 402.A OG1 GLU 429.A OE2 no hydrogen 3.115 N/A VAL 403.A N PHE 383.A O no hydrogen 2.609 N/A LEU 405.A N GLN 381.A O no hydrogen 2.646 N/A ASN 408.A N GLN 352.A OE1 no hydrogen 3.496 N/A ASN 408.A ND2 TYR 410.A OH no hydrogen 2.989 N/A TYR 410.A OH GLU 422.A OE2 no hydrogen 2.456 N/A TRP 412.A NE1 VAL 351.A O no hydrogen 3.217 N/A THR 413.A N ASP 411.A OD1 no hydrogen 3.480 N/A THR 413.A OG1 ASP 411.A OD1 no hydrogen 2.439 N/A THR 413.A OG1 ASP 411.A OD2 no hydrogen 3.049 N/A GLU 414.A N ASP 411.A O no hydrogen 3.269 N/A ALA 419.A N GLU 422.A OE1 no hydrogen 2.990 N/A LYS 424.A NZ GLU 358.A OE1 no hydrogen 2.905 N/A LYS 424.A NZ GLU 358.A OE2 no hydrogen 3.274 N/A CYS 425.A SG ILE 355.A O no hydrogen 4.041 N/A CYS 425.A SG PHE 423.A O no hydrogen 3.638 N/A LYS 428.A N THR 402.A O no hydrogen 2.921 N/A GLU 429.A N THR 402.A O no hydrogen 3.332 N/A VAL 431.A N ARG 400.A O no hydrogen 3.125 N/A LEU 433.A N LEU 398.A O no hydrogen 3.163 N/A THR 434.A OG1 HIS 397.A ND1 no hydrogen 2.640 N/A VAL 440.A N CYS 396.A O no hydrogen 2.535 N/A LEU 441.A N GLN 460.A O no hydrogen 2.677 N/A SER 442.A OG HIS 368.A ND1 no hydrogen 2.365 N/A SER 446.A N ARG 443.A O no hydrogen 3.244 N/A SER 446.A OG ARG 443.A O no hydrogen 2.741 N/A TRP 449.A N TYR 458.A O no hydrogen 2.801 N/A ASN 451.A N LEU 456.A O no hydrogen 2.506 N/A GLN 453.A N ASN 451.A OD1 no hydrogen 3.215 N/A LEU 456.A N ASN 451.A O no hydrogen 2.796 N/A VAL 457.A N VAL 474.A O no hydrogen 2.973 N/A TYR 458.A N TRP 449.A O no hydrogen 2.596 N/A PHE 459.A N TYR 472.A O no hydrogen 3.187 N/A GLN 460.A NE2 CYS 494.A O no hydrogen 3.181 N/A GLY 461.A N HIS 470.A O no hydrogen 3.194 N/A THR 462.A N GLU 439.A O no hydrogen 3.347 N/A ASP 464.A N TYR 472.A OH no hydrogen 3.166 N/A GLU 468.A N THR 465.A O no hydrogen 3.194 N/A HIS 470.A N GLY 461.A O no hydrogen 3.240 N/A HIS 470.A ND1 THR 486.A OG1 no hydrogen 2.969 N/A LEU 471.A N THR 486.A OG1 no hydrogen 3.188 N/A TYR 472.A N PHE 459.A O no hydrogen 2.765 N/A VAL 474.A N VAL 457.A O no hydrogen 3.211 N/A SER 475.A OG SER 478.A O no hydrogen 2.252 N/A SER 475.A OG SER 478.A OG no hydrogen 3.213 N/A GLU 477.A N GLU 477.A OE1 no hydrogen 2.376 N/A SER 478.A OG SER 475.A OG no hydrogen 3.213 N/A VAL 483.A N VAL 473.A O no hydrogen 3.119 N/A ARG 484.A NH1 THR 486.A O no hydrogen 2.755 N/A LEU 485.A N LEU 471.A O no hydrogen 2.694 N/A THR 486.A OG1 HIS 470.A ND1 no hydrogen 2.969 N/A SER 491.A N SER 508.A O no hydrogen 3.115 N/A SER 491.A OG LEU 467.A O no hydrogen 3.117 N/A SER 491.A OG ASN 598.A O no hydrogen 3.000 N/A HIS 492.A N HIS 469.A O no hydrogen 2.869 N/A HIS 492.A ND1 HIS 469.A O no hydrogen 3.181 N/A SER 493.A N HIS 506.A O no hydrogen 3.032 N/A SER 495.A N VAL 504.A O no hydrogen 3.263 N/A SER 497.A OG ASP 501.A OD1 no hydrogen 3.495 N/A ASN 499.A N SER 497.A OG no hydrogen 3.117 N/A ASN 499.A ND2 SER 497.A OG no hydrogen 3.202 N/A PHE 500.A N SER 497.A O no hydrogen 3.127 N/A PHE 503.A N TYR 519.A O no hydrogen 3.094 N/A SER 505.A N HIS 517.A O no hydrogen 2.845 N/A SER 505.A OG HIS 517.A O no hydrogen 3.518 N/A TYR 507.A N CYS 515.A O no hydrogen 3.193 N/A SER 508.A N SER 491.A O no hydrogen 3.356 N/A SER 509.A N THR 512.A O no hydrogen 3.258 N/A VAL 510.A N ASN 598.A OD1 no hydrogen 3.081 N/A THR 512.A N SER 509.A O no hydrogen 3.254 N/A THR 512.A OG1 SER 509.A OG no hydrogen 3.231 N/A CYS 515.A N TYR 507.A O no hydrogen 2.964 N/A CYS 515.A SG TYR 507.A O no hydrogen 3.438 N/A CYS 515.A SG PRO 513.A O no hydrogen 4.006 N/A HIS 517.A N SER 505.A O no hydrogen 3.014 N/A VAL 518.A N ALA 537.A O no hydrogen 2.889 N/A TYR 519.A N PHE 503.A O no hydrogen 2.981 N/A LYS 520.A N ARG 534.A O no hydrogen 2.887 N/A LEU 521.A N ASP 501.A O no hydrogen 2.896 N/A SER 522.A N GLN 532.A O no hydrogen 3.099 N/A LYS 531.A N PRO 528.A O no hydrogen 3.222 N/A LYS 531.A NZ GLY 523.A O no hydrogen 2.969 N/A LYS 531.A NZ PRO 524.A O no hydrogen 3.302 N/A LYS 531.A NZ ASP 525.A OD1 no hydrogen 3.149 N/A ARG 534.A N LYS 520.A O no hydrogen 2.877 N/A ARG 534.A NH2 GLN 532.A OE1 no hydrogen 3.227 N/A TRP 536.A N VAL 518.A O no hydrogen 3.144 N/A TRP 536.A NE1 PRO 64.A O no hydrogen 2.844 N/A ALA 537.A N VAL 518.A O no hydrogen 3.194 N/A SER 538.A N LEU 73.A O no hydrogen 3.013 N/A SER 538.A OG VAL 516.A O no hydrogen 3.547 N/A SER 538.A OG GLU 541.A OE2 no hydrogen 3.060 N/A MET 540.A N VAL 516.A O no hydrogen 3.002 N/A SER 544.A OG ALA 543.A O no hydrogen 2.884 N/A GLU 553.A N ILE 569.A O no hydrogen 3.082 N/A PHE 555.A N GLY 567.A O no hydrogen 2.910 N/A PHE 557.A N LEU 565.A O no hydrogen 3.042 N/A ARG 560.A NH1 GLU 651.A OE1 no hydrogen 3.002 N/A ALA 561.A N THR 559.A OG1 no hydrogen 3.272 N/A ASP 562.A N THR 559.A O no hydrogen 3.027 N/A LEU 565.A N PHE 557.A O no hydrogen 3.171 N/A TYR 566.A OH GLN 564.A OE1 no hydrogen 3.112 N/A GLY 567.A N PHE 555.A O no hydrogen 2.929 N/A MET 568.A N VAL 620.A O no hydrogen 2.710 N/A ILE 569.A N GLU 553.A O no hydrogen 3.193 N/A TYR 570.A N VAL 618.A O no hydrogen 3.144 N/A HIS 573.A N ALA 612.A O no hydrogen 3.289 N/A LYS 580.A N ALA 1.A O no hydrogen 3.278 N/A LYS 580.A NZ GLY 661.A O no hydrogen 3.064 N/A LYS 580.A NZ ILE 663.A O no hydrogen 3.112 N/A HIS 581.A N PHE 662.A O no hydrogen 3.248 N/A HIS 581.A ND1 GLY 615.A O no hydrogen 2.997 N/A THR 583.A N ARG 667.A O no hydrogen 3.231 N/A VAL 584.A N ALA 617.A O no hydrogen 2.834 N/A LEU 585.A N ALA 669.A O no hydrogen 3.125 N/A VAL 587.A N HIS 671.A O no hydrogen 2.970 N/A GLN 592.A NE2 TYR 714.A OH no hydrogen 2.835 N/A GLN 594.A NE2 PRO 466.A O no hydrogen 3.611 N/A LEU 595.A N ASP 622.A OD2 no hydrogen 2.781 N/A VAL 596.A N ASP 622.A OD2 no hydrogen 2.460 N/A ASN 598.A N LEU 467.A O no hydrogen 2.965 N/A SER 599.A N ASN 597.A O no hydrogen 2.698 N/A PHE 600.A N SER 508.A OG no hydrogen 2.884 N/A LYS 601.A NZ LEU 595.A O no hydrogen 2.402 N/A LYS 601.A NZ ASN 597.A OD1 no hydrogen 2.324 N/A LYS 604.A N LYS 601.A O no hydrogen 3.188 N/A TYR 605.A N LYS 601.A O no hydrogen 2.901 N/A THR 610.A N LEU 606.A O no hydrogen 2.702 N/A THR 610.A OG1 SER 20.A OG no hydrogen 2.798 N/A THR 610.A OG1 LEU 606.A O no hydrogen 2.986 N/A LEU 611.A N ARG 607.A O no hydrogen 2.762 N/A ALA 612.A N ASN 609.A O no hydrogen 2.815 N/A SER 613.A N ASN 609.A O no hydrogen 2.840 N/A SER 613.A OG THR 610.A O no hydrogen 2.821 N/A TYR 616.A N LEU 611.A O no hydrogen 3.153 N/A ALA 617.A N PRO 582.A O no hydrogen 3.111 N/A VAL 619.A N VAL 584.A O no hydrogen 3.007 N/A VAL 620.A N MET 568.A O no hydrogen 2.935 N/A ASP 622.A N TYR 566.A O no hydrogen 3.299 N/A ARG 624.A N ASP 648.A OD2 no hydrogen 3.223 N/A ARG 624.A NE ASP 648.A OD2 no hydrogen 3.367 N/A SER 626.A OG VAL 593.A O no hydrogen 3.375 N/A SER 626.A OG CYS 627.A O no hydrogen 3.229 N/A ARG 629.A NH1 GLN 564.A O no hydrogen 3.219 N/A ARG 629.A NH2 GLN 564.A O no hydrogen 3.044 N/A GLY 635.A N LEU 631.A O no hydrogen 2.523 N/A ALA 636.A N PHE 633.A O no hydrogen 3.409 N/A LYS 638.A NZ VAL 363.A O no hydrogen 3.181 N/A ASN 639.A N TYR 714.A O no hydrogen 3.077 N/A GLN 640.A N LEU 637.A O no hydrogen 2.697 N/A GLY 642.A N GLU 645.A OE2 no hydrogen 3.186 N/A GLN 643.A N GLN 640.A O no hydrogen 3.091 N/A GLU 645.A N GLU 645.A OE1 no hydrogen 2.744 N/A GLU 647.A N VAL 644.A O no hydrogen 3.123 N/A GLN 649.A N ILE 646.A O no hydrogen 3.181 N/A VAL 650.A N ILE 646.A O no hydrogen 3.401 N/A GLU 651.A N GLU 647.A O no hydrogen 3.235 N/A GLY 652.A N ASP 648.A O no hydrogen 2.925 N/A GLY 652.A N GLN 649.A O no hydrogen 3.220 N/A LEU 653.A N GLN 649.A O no hydrogen 2.683 N/A GLN 654.A N VAL 650.A O no hydrogen 3.030 N/A VAL 656.A N GLY 652.A O no hydrogen 3.213 N/A ALA 657.A N GLN 654.A O no hydrogen 2.948 N/A GLU 658.A N TYR 655.A O no hydrogen 3.042 N/A LYS 659.A N TYR 655.A O no hydrogen 3.031 N/A TYR 660.A N VAL 656.A O no hydrogen 3.038 N/A ASP 664.A N HIS 581.A O no hydrogen 3.103 N/A SER 666.A N ASP 664.A OD1 no hydrogen 3.346 N/A SER 666.A OG ASP 664.A OD1 no hydrogen 2.773 N/A SER 666.A OG ASP 664.A OD2 no hydrogen 2.896 N/A ARG 667.A N ASP 664.A O no hydrogen 3.038 N/A ARG 667.A NE ASP 664.A OD2 no hydrogen 2.407 N/A ARG 667.A NH1 PHE 3.A O no hydrogen 2.437 N/A ARG 667.A NH2 PHE 3.A O no hydrogen 2.679 N/A ARG 667.A NH2 ASP 664.A OD2 no hydrogen 2.983 N/A ALA 669.A N THR 583.A O no hydrogen 3.373 N/A HIS 671.A N LEU 585.A O no hydrogen 3.154 N/A HIS 671.A ND1 ILE 695.A O no hydrogen 2.983 N/A HIS 671.A NE2 TYR 795.A OH no hydrogen 2.396 N/A TRP 673.A NE1 TYR 795.A OH no hydrogen 3.243 N/A SER 674.A N GLY 697.A O no hydrogen 2.702 N/A SER 674.A OG TRP 673.A O no hydrogen 2.373 N/A SER 674.A OG HIS 784.A NE2 no hydrogen 3.230 N/A TYR 675.A OH GLU 645.A OE2 no hydrogen 3.222 N/A LEU 679.A N TYR 675.A O no hydrogen 2.957 N/A SER 680.A N GLY 676.A O no hydrogen 2.347 N/A SER 680.A OG GLY 676.A O no hydrogen 2.276 N/A LEU 681.A N GLY 677.A O no hydrogen 3.136 N/A MET 682.A N PHE 678.A O no hydrogen 3.044 N/A GLY 683.A N LEU 679.A O no hydrogen 2.685 N/A GLY 683.A N SER 680.A O no hydrogen 3.060 N/A LEU 684.A N SER 680.A O no hydrogen 2.960 N/A ILE 685.A N LEU 681.A O no hydrogen 3.253 N/A HIS 686.A N MET 682.A O no hydrogen 3.127 N/A LYS 687.A N GLY 683.A O no hydrogen 2.606 N/A VAL 690.A N LYS 687.A O no hydrogen 3.228 N/A PHE 691.A N LYS 687.A O no hydrogen 3.113 N/A LYS 692.A N VAL 668.A O no hydrogen 2.896 N/A ALA 694.A N ARG 743.A O no hydrogen 3.250 N/A ILE 695.A N ILE 670.A O no hydrogen 2.924 N/A ALA 696.A N LEU 745.A O no hydrogen 3.140 N/A GLY 697.A N GLY 672.A O no hydrogen 2.989 N/A ALA 698.A N LEU 747.A O no hydrogen 2.769 N/A THR 701.A OG1 HIS 759.A O no hydrogen 2.636 N/A TRP 703.A N SER 729.A OG no hydrogen 2.867 N/A TRP 703.A NE1 GLY 728.A O no hydrogen 3.176 N/A THR 708.A N PRO 250.A O no hydrogen 3.222 N/A THR 708.A OG1 ASN 256.A OD1 no hydrogen 2.781 N/A THR 708.A OG1 TYR 295.A OH no hydrogen 3.359 N/A THR 711.A N ASP 707.A O no hydrogen 3.332 N/A THR 711.A OG1 ASP 707.A O no hydrogen 2.824 N/A GLU 712.A N THR 708.A O no hydrogen 3.003 N/A ARG 713.A NH2 GLU 198.A O no hydrogen 3.018 N/A TYR 714.A N THR 711.A O no hydrogen 3.073 N/A MET 715.A N THR 711.A O no hydrogen 2.615 N/A ASP 716.A N GLU 712.A O no hydrogen 3.393 N/A ASN 720.A N VAL 717.A O no hydrogen 3.023 N/A ASN 721.A N PRO 718.A O no hydrogen 3.130 N/A ASN 721.A ND2 MET 715.A O no hydrogen 2.977 N/A GLY 724.A N ASN 721.A OD1 no hydrogen 3.024 N/A TYR 725.A N ASN 721.A O no hydrogen 3.192 N/A TYR 725.A OH THR 252.A OG1 no hydrogen 3.092 N/A ALA 727.A N GLN 723.A O no hydrogen 3.257 N/A GLY 728.A N TYR 725.A O no hydrogen 3.203 N/A SER 729.A N TYR 725.A O no hydrogen 2.987 N/A SER 729.A OG TYR 725.A O no hydrogen 3.214 N/A ALA 731.A N THR 701.A O no hydrogen 3.099 N/A LEU 732.A N SER 729.A O no hydrogen 3.354 N/A HIS 733.A N VAL 730.A O no hydrogen 3.045 N/A HIS 733.A NE2 GLU 726.A O no hydrogen 2.797 N/A GLU 735.A N GLU 735.A OE1 no hydrogen 2.900 N/A LYS 736.A N HIS 733.A O no hydrogen 3.280 N/A LEU 737.A N VAL 734.A O no hydrogen 3.066 N/A GLU 740.A N GLU 740.A OE1 no hydrogen 2.558 N/A ARG 743.A NE LYS 692.A O no hydrogen 2.730 N/A ARG 743.A NH2 PRO 688.A O no hydrogen 3.068 N/A ARG 743.A NH2 PHE 691.A O no hydrogen 3.098 N/A ARG 743.A NH2 LYS 692.A O no hydrogen 3.497 N/A LEU 745.A N ALA 694.A O no hydrogen 2.983 N/A LEU 747.A N ALA 696.A O no hydrogen 3.006 N/A HIS 748.A N GLN 777.A O no hydrogen 3.228 N/A HIS 748.A ND1 GLY 749.A O no hydrogen 3.066 N/A PHE 750.A N TYR 779.A O no hydrogen 2.983 N/A ASP 752.A N GLY 749.A O no hydrogen 3.439 N/A GLU 753.A N GLU 753.A OE1 no hydrogen 2.471 N/A ASN 754.A N ASP 752.A OD1 no hydrogen 3.165 N/A VAL 755.A N ASP 752.A OD1 no hydrogen 3.326 N/A HIS 759.A N HIS 756.A O no hydrogen 3.139 N/A HIS 759.A ND1 HIS 756.A O no hydrogen 3.310 N/A ASN 761.A N PHE 757.A O no hydrogen 2.924 N/A PHE 762.A N PHE 758.A O no hydrogen 2.628 N/A LEU 763.A N HIS 759.A O no hydrogen 3.119 N/A VAL 764.A N THR 760.A O no hydrogen 2.908 N/A SER 765.A N ASN 761.A O no hydrogen 3.000 N/A GLN 766.A N LEU 763.A O no hydrogen 2.758 N/A LEU 767.A N LEU 763.A O no hydrogen 2.806 N/A LEU 767.A N VAL 764.A O no hydrogen 2.971 N/A ILE 768.A N VAL 764.A O no hydrogen 3.151 N/A GLY 771.A N ILE 768.A O no hydrogen 3.209 N/A LYS 772.A NZ GLU 735.A O no hydrogen 3.345 N/A LYS 772.A NZ LEU 737.A O no hydrogen 3.566 N/A LYS 772.A NZ ASN 739.A OD1 no hydrogen 2.685 N/A GLN 775.A N LEU 744.A O no hydrogen 3.320 N/A GLN 775.A NE2 ASN 742.A OD1 no hydrogen 3.441 N/A GLN 777.A N ILE 746.A O no hydrogen 2.856 N/A TYR 779.A N HIS 748.A O no hydrogen 3.018 N/A GLU 782.A N TYR 779.A O no hydrogen 3.282 N/A ARG 787.A N GLU 782.A OE1 no hydrogen 2.776 N/A CYS 788.A SG GLU 790.A OE1 no hydrogen 3.159 N/A GLU 790.A N GLU 790.A OE1 no hydrogen 3.125 N/A SER 791.A OG GLU 782.A OE2 no hydrogen 2.968 N/A GLU 793.A N ARG 789.A O no hydrogen 2.784 N/A HIS 794.A N GLU 790.A O no hydrogen 2.904 N/A TYR 795.A N GLY 792.A O no hydrogen 3.157 N/A TYR 795.A OH HIS 671.A NE2 no hydrogen 2.396 N/A GLU 796.A N GLY 792.A O no hydrogen 3.107 N/A VAL 797.A N GLU 793.A O no hydrogen 2.843 N/A LEU 799.A N TYR 795.A O no hydrogen 3.143 N/A LEU 800.A N GLU 796.A O no hydrogen 3.023 N/A HIS 801.A N VAL 797.A O no hydrogen 3.012 N/A PHE 802.A N THR 798.A O no hydrogen 3.160 N/A LEU 803.A N LEU 799.A O no hydrogen 3.315 N/A GLN 804.A N LEU 800.A O no hydrogen 2.702 N/A GLN 804.A NE2 HIS 8.A O no hydrogen 2.752 N/A GLU 805.A N HIS 801.A O no hydrogen 3.064 N/A HIS 806.A N PHE 802.A O no hydrogen 3.321 N/A