Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6zca_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 THR 1.A O no hydrogen 2.326 N/A GLN 3.A N SER 15.A O no hydrogen 2.923 N/A VAL 5.A N ARG 13.A O no hydrogen 2.913 N/A GLN 6.A NE2 GLN 12.A OE1 no hydrogen 2.839 N/A TYR 7.A N ARG 11.A O no hydrogen 2.844 N/A TYR 7.A OH GLY 635.A O no hydrogen 3.261 N/A ARG 9.A NE GLU 714.A OE2 no hydrogen 2.836 N/A ARG 9.A NH2 GLU 714.A OE2 no hydrogen 3.412 N/A ARG 11.A N TYR 7.A O no hydrogen 2.985 N/A ARG 13.A N VAL 5.A O no hydrogen 2.946 N/A ARG 13.A NH1 GLU 726.A OE2 no hydrogen 2.289 N/A SER 15.A N GLN 3.A O no hydrogen 2.886 N/A ARG 18.A NH1 ASP 973.A OD2 no hydrogen 2.299 N/A ILE 29.A N ASN 27.A OD1 no hydrogen 3.291 N/A GLU 30.A N ASN 27.A O no hydrogen 3.010 N/A GLN 32.A N ILE 29.A O no hydrogen 3.243 N/A GLN 32.A NE2 ILE 133.A O no hydrogen 3.534 N/A THR 33.A N ILE 29.A O no hydrogen 3.397 N/A THR 33.A OG1 GLU 30.A O no hydrogen 3.040 N/A SER 34.A N GLU 30.A O no hydrogen 2.936 N/A SER 35.A N ILE 31.A O no hydrogen 2.919 N/A SER 35.A OG SER 389.A OG no hydrogen 2.468 N/A TYR 36.A N GLN 32.A O no hydrogen 2.900 N/A GLN 37.A N THR 33.A O no hydrogen 2.981 N/A TRP 38.A N SER 34.A O no hydrogen 2.962 N/A PHE 39.A N SER 35.A O no hydrogen 2.838 N/A LEU 40.A N TYR 36.A O no hydrogen 2.923 N/A ASP 41.A N GLN 37.A O no hydrogen 3.080 N/A GLU 42.A N TRP 38.A O no hydrogen 2.928 N/A GLU 42.A N ASP 41.A OD1 no hydrogen 2.350 N/A GLY 43.A N TRP 38.A O no hydrogen 3.474 N/A GLY 43.A N PHE 39.A O no hydrogen 2.828 N/A LEU 44.A N LEU 40.A O no hydrogen 3.003 N/A ARG 45.A N ASP 41.A O no hydrogen 3.041 N/A GLU 46.A N GLU 42.A O no hydrogen 2.848 N/A MET 47.A N GLY 43.A O no hydrogen 2.884 N/A PHE 48.A N LEU 44.A O no hydrogen 2.972 N/A GLN 49.A N ARG 45.A O no hydrogen 2.935 N/A ASP 50.A N GLU 46.A O no hydrogen 2.849 N/A ASP 50.A N MET 47.A O no hydrogen 3.099 N/A ILE 51.A N MET 47.A O no hydrogen 2.942 N/A SER 52.A OG PHE 48.A O no hydrogen 2.956 N/A THR 58.A N ASP 56.A OD1 no hydrogen 3.443 N/A THR 58.A OG1 ASP 56.A OD1 no hydrogen 3.110 N/A THR 58.A OG1 ASN 60.A OD1 no hydrogen 2.318 N/A ASN 60.A N ASP 56.A OD1 no hydrogen 3.182 N/A SER 62.A N ILE 98.A O no hydrogen 2.920 N/A SER 62.A OG GLU 64.A OE2 no hydrogen 3.254 N/A SER 62.A OG ILE 98.A O no hydrogen 3.354 N/A GLU 64.A N ARG 96.A O no hydrogen 2.900 N/A PHE 65.A N SER 52.A OG no hydrogen 2.484 N/A ILE 66.A N LYS 94.A O no hydrogen 2.907 N/A SER 69.A OG ARG 92.A O no hydrogen 2.772 N/A GLY 71.A N PRO 90.A O no hydrogen 2.578 N/A LYS 74.A NZ THR 86.A O no hydrogen 2.436 N/A GLU 78.A N GLU 78.A OE1 no hydrogen 2.471 N/A SER 80.A N PRO 76.A O no hydrogen 3.510 N/A SER 80.A OG VAL 77.A O no hydrogen 2.520 N/A LYS 81.A N VAL 77.A O no hydrogen 2.868 N/A GLU 82.A N GLU 78.A O no hydrogen 2.923 N/A ARG 83.A N GLU 79.A O no hydrogen 2.940 N/A VAL 85.A N SER 80.A O no hydrogen 3.131 N/A TYR 87.A N ILE 125.A O no hydrogen 2.985 N/A ALA 89.A N PHE 115.A O no hydrogen 2.649 N/A ARG 92.A N SER 69.A O no hydrogen 2.894 N/A VAL 93.A N VAL 110.A O no hydrogen 2.899 N/A LYS 94.A N ILE 66.A O no hydrogen 2.912 N/A VAL 95.A N GLN 108.A O no hydrogen 2.871 N/A ARG 96.A N GLU 64.A O no hydrogen 2.870 N/A ILE 98.A N SER 62.A O no hydrogen 2.875 N/A GLU 101.A N GLU 101.A OE1 no hydrogen 2.619 N/A THR 102.A N ASN 99.A O no hydrogen 3.304 N/A THR 102.A OG1 GLY 103.A O no hydrogen 3.542 N/A GLN 108.A N VAL 95.A O no hydrogen 2.900 N/A VAL 110.A N VAL 93.A O no hydrogen 2.895 N/A MET 112.A N LEU 91.A O no hydrogen 2.903 N/A PHE 115.A N ALA 89.A O no hydrogen 2.878 N/A MET 118.A N TYR 36.A OH no hydrogen 3.379 N/A THR 121.A N THR 119.A OG1 no hydrogen 3.193 N/A THR 121.A OG1 THR 119.A OG1 no hydrogen 3.079 N/A GLY 122.A N THR 119.A O no hydrogen 3.462 N/A THR 123.A OG1 THR 121.A OG1 no hydrogen 2.572 N/A PHE 124.A N ARG 131.A O no hydrogen 2.910 N/A ILE 126.A N ALA 129.A O no hydrogen 2.898 N/A ASN 127.A N THR 86.A OG1 no hydrogen 3.284 N/A ALA 129.A N ILE 126.A O no hydrogen 2.917 N/A VAL 132.A N GLN 447.A O no hydrogen 2.897 N/A GLN 136.A N ARG 388.A O no hydrogen 2.931 N/A LEU 137.A N SER 465.A O no hydrogen 3.048 N/A VAL 138.A N ARG 386.A O no hydrogen 2.913 N/A SER 140.A N ASN 384.A O no hydrogen 2.811 N/A SER 142.A OG SER 140.A O no hydrogen 2.956 N/A SER 142.A OG TYR 144.A OH no hydrogen 2.853 N/A TYR 144.A N THR 160.A O no hydrogen 2.884 N/A TYR 144.A OH SER 142.A OG no hydrogen 2.853 N/A SER 146.A N THR 158.A O no hydrogen 2.929 N/A LYS 148.A N GLY 156.A O no hydrogen 2.864 N/A LYS 148.A NZ THR 173.A OG1 no hydrogen 3.277 N/A ASP 150.A N LYS 154.A O no hydrogen 3.175 N/A LYS 151.A NZ ASP 150.A OD1 no hydrogen 3.317 N/A LYS 151.A NZ ASP 150.A OD2 no hydrogen 3.421 N/A ASN 152.A N ASP 150.A OD1 no hydrogen 2.849 N/A GLY 153.A N ASP 150.A O no hydrogen 3.120 N/A LYS 154.A N ASN 152.A OD1 no hydrogen 2.948 N/A GLY 156.A N LYS 148.A O no hydrogen 2.926 N/A THR 158.A N SER 146.A O no hydrogen 2.890 N/A THR 158.A OG1 TYR 171.A O no hydrogen 3.370 N/A THR 160.A N TYR 144.A O no hydrogen 2.913 N/A ILE 162.A N SER 142.A O no hydrogen 3.227 N/A ARG 165.A N ASP 265.A O no hydrogen 3.526 N/A ARG 165.A NE ASN 396.A OD1 no hydrogen 2.989 N/A GLU 170.A N ARG 182.A O no hydrogen 2.929 N/A TYR 171.A OH SER 362.A OG no hydrogen 3.315 N/A GLU 172.A N TYR 180.A O no hydrogen 2.904 N/A THR 173.A OG1 PHE 157.A O no hydrogen 3.223 N/A ASP 174.A N VAL 178.A O no hydrogen 2.925 N/A TYR 180.A N GLU 172.A O no hydrogen 2.879 N/A VAL 181.A N LEU 189.A O no hydrogen 2.605 N/A ARG 182.A N GLU 170.A O no hydrogen 2.864 N/A THR 186.A OG1 ARG 238.A O no hydrogen 3.523 N/A ARG 187.A N THR 186.A OG1 no hydrogen 2.694 N/A VAL 191.A N VAL 179.A O no hydrogen 3.265 N/A THR 192.A OG1 ASP 223.A OD1 no hydrogen 2.299 N/A THR 192.A OG1 ASP 223.A OD2 no hydrogen 3.017 N/A VAL 193.A N PRO 190.A O no hydrogen 3.267 N/A LEU 195.A N VAL 191.A O no hydrogen 2.936 N/A ARG 196.A N THR 192.A O no hydrogen 2.884 N/A ARG 196.A NH2 ASP 223.A OD2 no hydrogen 3.269 N/A ALA 197.A N VAL 193.A O no hydrogen 2.884 N/A LEU 198.A N LEU 194.A O no hydrogen 2.948 N/A GLY 199.A N ARG 196.A O no hydrogen 2.849 N/A SER 202.A N PHE 200.A O no hydrogen 3.184 N/A SER 202.A OG GLU 205.A OE1 no hydrogen 2.450 N/A GLU 205.A N SER 202.A OG no hydrogen 3.380 N/A ILE 206.A N ASP 203.A O no hydrogen 3.369 N/A LEU 207.A N ASP 203.A O no hydrogen 3.120 N/A ASP 208.A N GLN 204.A O no hydrogen 3.318 N/A LEU 209.A N ILE 206.A O no hydrogen 3.293 N/A ILE 210.A N ILE 206.A O no hydrogen 3.271 N/A GLY 211.A N ILE 206.A O no hydrogen 3.352 N/A GLU 212.A N GLU 212.A OE1 no hydrogen 2.718 N/A ASN 213.A N ILE 210.A O no hydrogen 3.197 N/A GLU 214.A N ASN 213.A OD1 no hydrogen 2.637 N/A ASN 218.A N GLU 214.A O no hydrogen 2.866 N/A ASN 218.A ND2 ASP 177.A O no hydrogen 3.347 N/A THR 219.A N TYR 215.A O no hydrogen 2.939 N/A THR 219.A OG1 LEU 216.A O no hydrogen 2.525 N/A LEU 220.A N LEU 216.A O no hydrogen 2.847 N/A ASP 221.A N ARG 217.A O no hydrogen 2.919 N/A LYS 222.A N ASN 218.A O no hydrogen 2.913 N/A LYS 222.A NZ TYR 180.A OH no hydrogen 3.540 N/A ASP 223.A N LEU 220.A O no hydrogen 3.047 N/A THR 225.A OG1 ASN 227.A O no hydrogen 3.039 N/A ASN 227.A N THR 225.A OG1 no hydrogen 3.399 N/A SER 228.A N ASN 227.A OD1 no hydrogen 2.749 N/A SER 228.A OG ASP 229.A OD1 no hydrogen 3.459 N/A ALA 231.A N ASN 227.A O no hydrogen 3.199 N/A LEU 232.A N SER 228.A O no hydrogen 2.908 N/A LEU 233.A N ASP 229.A O no hydrogen 2.924 N/A GLU 234.A N LYS 230.A O no hydrogen 2.873 N/A ILE 235.A N ALA 231.A O no hydrogen 2.906 N/A TYR 236.A N LEU 232.A O no hydrogen 2.924 N/A TYR 236.A OH ASN 249.A OD1 no hydrogen 3.037 N/A GLU 237.A N LEU 233.A O no hydrogen 2.892 N/A ARG 238.A N GLU 234.A O no hydrogen 2.903 N/A LEU 239.A N ILE 235.A O no hydrogen 2.902 N/A ARG 240.A N TYR 236.A O no hydrogen 2.540 N/A ALA 250.A N THR 246.A O no hydrogen 2.590 N/A LYS 251.A N VAL 247.A O no hydrogen 2.941 N/A LYS 251.A NZ THR 321.A OG1 no hydrogen 3.054 N/A SER 252.A N GLU 248.A O no hydrogen 2.886 N/A SER 252.A OG GLU 248.A O no hydrogen 2.462 N/A LEU 253.A N ASN 249.A O no hydrogen 2.896 N/A LEU 254.A N ALA 250.A O no hydrogen 2.918 N/A ASP 255.A N LYS 251.A O no hydrogen 2.921 N/A SER 256.A N SER 252.A O no hydrogen 2.898 N/A SER 256.A OG SER 252.A O no hydrogen 3.019 N/A SER 256.A OG LEU 253.A O no hydrogen 2.822 N/A ARG 257.A N LEU 253.A O no hydrogen 2.900 N/A ARG 257.A N LEU 254.A O no hydrogen 3.283 N/A PHE 258.A N LEU 254.A O no hydrogen 2.905 N/A PHE 259.A N ASP 255.A O no hydrogen 2.954 N/A TYR 264.A N ASP 260.A O no hydrogen 2.893 N/A ARG 271.A N ALA 267.A O no hydrogen 3.247 N/A ARG 271.A NH1 ASP 358.A OD2 no hydrogen 2.378 N/A ARG 271.A NH2 ASP 358.A OD1 no hydrogen 3.295 N/A TYR 272.A N ASN 268.A O no hydrogen 2.918 N/A LYS 273.A N VAL 269.A O no hydrogen 2.908 N/A LYS 273.A NZ GLY 383.A O no hydrogen 3.306 N/A LYS 273.A NZ ASP 541.A OD1 no hydrogen 3.161 N/A ILE 274.A N GLY 270.A O no hydrogen 2.897 N/A ASN 275.A N ARG 271.A O no hydrogen 2.911 N/A ASN 275.A ND2 TYR 346.A O no hydrogen 3.489 N/A ASN 275.A ND2 GLU 348.A OE1 no hydrogen 3.009 N/A LYS 276.A N TYR 272.A O no hydrogen 2.942 N/A LYS 277.A N LYS 273.A O no hydrogen 2.898 N/A LYS 277.A N ILE 274.A O no hydrogen 2.898 N/A LYS 277.A NZ LYS 277.A O no hydrogen 3.553 N/A LYS 277.A NZ TYR 365.A OH no hydrogen 2.761 N/A LEU 278.A N ILE 274.A O no hydrogen 2.825 N/A LYS 281.A N HIS 279.A ND1 no hydrogen 3.208 N/A ASN 282.A ND2 LYS 276.A O no hydrogen 3.599 N/A ARG 283.A N ILE 280.A O no hydrogen 3.318 N/A GLN 287.A NE2 GLN 333.A OE1 no hydrogen 3.511 N/A GLY 305.A N GLU 301.A O no hydrogen 2.910 N/A PHE 306.A N ASN 302.A O no hydrogen 2.892 N/A ARG 307.A N GLY 303.A O no hydrogen 2.901 N/A LYS 308.A N ILE 304.A O no hydrogen 2.896 N/A LEU 309.A N GLY 305.A O no hydrogen 2.899 N/A TYR 310.A N PHE 306.A O no hydrogen 2.754 N/A GLU 317.A N SER 324.A OG no hydrogen 2.637 N/A THR 321.A OG1 VAL 320.A O no hydrogen 2.506 N/A ILE 327.A N VAL 315.A O no hydrogen 2.953 N/A PHE 328.A N ASN 344.A O no hydrogen 3.195 N/A THR 331.A OG1 ASN 340.A O no hydrogen 2.900 N/A ASP 332.A N ASN 340.A O no hydrogen 2.904 N/A GLN 333.A NE2 GLY 335.A O no hydrogen 3.356 N/A ASN 340.A N ASP 332.A O no hydrogen 3.201 N/A ASN 344.A N PHE 328.A O no hydrogen 2.995 N/A ASP 358.A N THR 355.A O no hydrogen 2.614 N/A ILE 359.A N THR 355.A O no hydrogen 3.399 N/A ILE 360.A N PRO 356.A O no hydrogen 2.920 N/A SER 361.A N ALA 357.A O no hydrogen 2.884 N/A SER 361.A OG ALA 357.A O no hydrogen 2.749 N/A SER 361.A OG ASP 358.A O no hydrogen 2.611 N/A SER 362.A N ASP 358.A O no hydrogen 2.886 N/A SER 362.A OG TYR 171.A OH no hydrogen 3.315 N/A SER 362.A OG ASP 358.A O no hydrogen 2.883 N/A SER 362.A OG ILE 359.A O no hydrogen 2.598 N/A ILE 363.A N ILE 359.A O no hydrogen 2.927 N/A SER 364.A N ILE 360.A O no hydrogen 2.923 N/A SER 364.A OG GLY 343.A O no hydrogen 2.361 N/A SER 364.A OG ILE 360.A O no hydrogen 2.816 N/A SER 364.A OG SER 361.A O no hydrogen 2.695 N/A TYR 365.A N SER 361.A O no hydrogen 2.873 N/A TYR 365.A OH ASP 375.A O no hydrogen 2.246 N/A PHE 366.A N SER 362.A O no hydrogen 2.891 N/A PHE 367.A N ILE 363.A O no hydrogen 2.952 N/A ASN 368.A N SER 364.A O no hydrogen 2.886 N/A LEU 369.A N TYR 365.A O no hydrogen 2.896 N/A LEU 370.A N PHE 366.A O no hydrogen 2.912 N/A HIS 371.A N PHE 367.A O no hydrogen 2.928 N/A THR 376.A OG1 PHE 145.A O no hydrogen 3.035 N/A HIS 381.A NE2 ASP 544.A OD1 no hydrogen 2.708 N/A ASN 384.A N HIS 381.A O no hydrogen 2.924 N/A ASN 384.A ND2 ASP 377.A OD1 no hydrogen 2.533 N/A ASN 384.A ND2 ASP 378.A O no hydrogen 2.901 N/A ARG 385.A NH2 ASP 380.A O no hydrogen 3.415 N/A ARG 386.A N VAL 138.A O no hydrogen 2.915 N/A ARG 386.A NH1 GLU 392.A OE2 no hydrogen 3.044 N/A ARG 386.A NH2 GLU 392.A OE1 no hydrogen 3.037 N/A ARG 386.A NH2 GLU 392.A OE2 no hydrogen 3.558 N/A ARG 388.A N GLN 136.A O no hydrogen 2.875 N/A SER 389.A OG SER 35.A OG no hydrogen 2.468 N/A GLY 391.A N SER 35.A OG no hydrogen 2.722 N/A LEU 393.A N SER 389.A O no hydrogen 3.468 N/A LEU 394.A N VAL 390.A O no hydrogen 2.904 N/A GLN 395.A N GLY 391.A O no hydrogen 2.934 N/A ASN 396.A N GLU 392.A O no hydrogen 2.856 N/A GLN 397.A N LEU 393.A O no hydrogen 2.953 N/A PHE 398.A N LEU 394.A O no hydrogen 2.908 N/A ARG 399.A N GLN 395.A O no hydrogen 2.911 N/A ILE 400.A N ASN 396.A O no hydrogen 2.897 N/A GLY 401.A N GLN 397.A O no hydrogen 2.963 N/A LEU 402.A N PHE 398.A O no hydrogen 2.834 N/A SER 403.A N ARG 399.A O no hydrogen 2.921 N/A SER 403.A OG ILE 400.A O no hydrogen 2.281 N/A MET 405.A N GLY 401.A O no hydrogen 2.969 N/A GLU 406.A N LEU 402.A O no hydrogen 2.841 N/A ARG 407.A N SER 403.A O no hydrogen 2.937 N/A VAL 408.A N ARG 404.A O no hydrogen 2.915 N/A VAL 409.A N MET 405.A O no hydrogen 2.887 N/A ARG 410.A N GLU 406.A O no hydrogen 2.875 N/A GLU 411.A N ARG 407.A O no hydrogen 2.946 N/A ARG 412.A N VAL 408.A O no hydrogen 2.895 N/A ARG 412.A NH2 GLN 425.A O no hydrogen 3.127 N/A MET 413.A N VAL 409.A O no hydrogen 2.858 N/A SER 414.A N ARG 410.A O no hydrogen 2.905 N/A ILE 415.A N GLU 411.A O no hydrogen 2.905 N/A GLN 416.A N ARG 412.A O no hydrogen 3.231 N/A ASN 419.A ND2 MET 413.A O no hydrogen 3.304 N/A GLN 425.A N GLN 425.A OE1 no hydrogen 2.534 N/A LEU 426.A N PRO 423.A O no hydrogen 3.076 N/A ILE 427.A N GLN 425.A O no hydrogen 2.613 N/A ILE 433.A N ILE 429.A O no hydrogen 3.413 N/A ALA 434.A N ARG 430.A O no hydrogen 2.795 N/A SER 435.A N PRO 431.A O no hydrogen 2.908 N/A SER 435.A OG VAL 432.A O no hydrogen 2.168 N/A ILE 436.A N VAL 432.A O no hydrogen 3.273 N/A LYS 437.A N ILE 433.A O no hydrogen 3.144 N/A GLU 438.A N ALA 434.A O no hydrogen 2.470 N/A PHE 439.A N ILE 436.A O no hydrogen 2.919 N/A PHE 440.A N ILE 436.A O no hydrogen 2.958 N/A SER 443.A OG GLU 438.A O no hydrogen 3.208 N/A SER 443.A OG PHE 439.A O no hydrogen 2.460 N/A SER 443.A OG GLY 441.A O no hydrogen 3.183 N/A GLN 444.A NE2 GLN 444.A O no hydrogen 2.869 N/A SER 446.A OG PHE 440.A O no hydrogen 3.063 N/A GLN 447.A N VAL 132.A O no hydrogen 2.930 N/A MET 449.A N GLU 130.A O no hydrogen 3.485 N/A ALA 456.A N ASN 453.A OD1 no hydrogen 2.415 N/A GLU 457.A N ASN 453.A O no hydrogen 3.277 N/A LEU 458.A N PRO 454.A O no hydrogen 2.904 N/A THR 459.A N LEU 455.A O no hydrogen 2.937 N/A THR 459.A OG1 LEU 455.A O no hydrogen 3.136 N/A HIS 460.A N ALA 456.A O no hydrogen 2.921 N/A HIS 460.A ND1 HIS 460.A O no hydrogen 2.527 N/A LYS 461.A N GLU 457.A O no hydrogen 2.865 N/A LYS 461.A NZ THR 121.A O no hydrogen 2.384 N/A ARG 462.A NE LEU 28.A O no hydrogen 3.409 N/A ARG 462.A NH2 LEU 28.A O no hydrogen 2.771 N/A LEU 464.A N ASN 503.A O no hydrogen 2.924 N/A GLU 475.A N GLY 471.A O no hydrogen 3.388 N/A HIS 481.A NE2 ASP 378.A OD1 no hydrogen 3.183 N/A ARG 487.A NE THR 519.A OG1 no hydrogen 3.406 N/A CYS 489.A N SER 504.A O no hydrogen 3.322 N/A CYS 489.A SG VAL 592.A O no hydrogen 3.643 N/A ILE 499.A N PRO 497.A O no hydrogen 2.941 N/A LEU 501.A N ASN 498.A O no hydrogen 2.857 N/A ASN 503.A N LEU 464.A O no hydrogen 2.902 N/A SER 504.A OG GLU 492.A OE1 no hydrogen 2.238 N/A SER 506.A N ARG 487.A O no hydrogen 2.782 N/A SER 506.A OG GLY 486.A O no hydrogen 2.609 N/A SER 506.A OG ARG 487.A O no hydrogen 2.553 N/A SER 507.A OG LYS 590.A O no hydrogen 3.512 N/A SER 507.A OG VAL 593.A O no hydrogen 2.881 N/A LYS 510.A N GLU 518.A O no hydrogen 3.287 N/A LYS 510.A NZ TYR 537.A OH no hydrogen 3.122 N/A ASN 512.A N PHE 516.A O no hydrogen 2.975 N/A ARG 513.A N ASN 512.A OD1 no hydrogen 2.609 N/A GLU 518.A N LYS 510.A O no hydrogen 3.295 N/A THR 519.A N LEU 538.A O no hydrogen 2.914 N/A THR 519.A OG1 GLY 486.A O no hydrogen 3.203 N/A TYR 521.A N ASP 536.A O no hydrogen 2.899 N/A TYR 521.A OH GLU 543.A OE2 no hydrogen 2.285 N/A ARG 522.A N MET 585.A O no hydrogen 2.894 N/A ARG 522.A NE ASP 586.A O no hydrogen 3.468 N/A ARG 522.A NH2 ASP 586.A O no hydrogen 3.381 N/A ASP 525.A N LYS 530.A O no hydrogen 3.004 N/A GLU 527.A N GLU 527.A OE1 no hydrogen 2.570 N/A GLY 529.A N ASP 525.A O no hydrogen 2.546 N/A ASP 536.A N TYR 521.A O no hydrogen 2.904 N/A LEU 538.A N THR 519.A O no hydrogen 2.899 N/A GLU 543.A N THR 539.A O no hydrogen 3.176 N/A ASP 544.A N ALA 540.A O no hydrogen 2.948 N/A ASP 544.A N ASP 541.A O no hydrogen 2.913 N/A ASN 545.A N GLU 542.A O no hydrogen 3.351 N/A VAL 548.A N ARG 569.A O no hydrogen 3.372 N/A ALA 549.A N TYR 584.A O no hydrogen 2.457 N/A GLU 558.A N ASP 556.A OD2 no hydrogen 3.285 N/A SER 565.A N ASP 563.A OD1 no hydrogen 2.969 N/A SER 565.A N ASP 564.A OD1 no hydrogen 2.626 N/A SER 565.A OG ASP 564.A OD1 no hydrogen 3.197 N/A ILE 566.A N VAL 577.A O no hydrogen 2.913 N/A ALA 568.A N THR 575.A O no hydrogen 2.896 N/A ARG 569.A NH1 GLU 543.A OE2 no hydrogen 2.980 N/A PHE 570.A N GLU 573.A O no hydrogen 2.856 N/A ARG 571.A NE ASP 544.A O no hydrogen 2.375 N/A GLU 573.A N PHE 570.A O no hydrogen 2.920 N/A THR 575.A N ALA 568.A O no hydrogen 2.934 N/A THR 575.A OG1 VAL 576.A O no hydrogen 3.359 N/A VAL 577.A N ILE 566.A O no hydrogen 2.885 N/A SER 578.A OG ASN 580.A OD1 no hydrogen 2.539 N/A MET 585.A N ARG 522.A O no hydrogen 3.265 N/A SER 588.A N ASP 586.A OD1 no hydrogen 3.147 N/A SER 588.A OG PRO 589.A O no hydrogen 3.268 N/A GLN 591.A NE2 GLY 486.A O no hydrogen 2.762 N/A VAL 593.A N LYS 590.A O no hydrogen 3.444 N/A SER 594.A OG THR 597.A OG1 no hydrogen 3.332 N/A THR 597.A N SER 594.A OG no hydrogen 3.120 N/A THR 597.A OG1 SER 594.A OG no hydrogen 3.332 N/A ALA 598.A N SER 594.A O no hydrogen 3.114 N/A CYS 599.A N ALA 596.A O no hydrogen 3.106 N/A CYS 599.A SG GLN 618.A OE1 no hydrogen 3.501 N/A ILE 600.A N THR 597.A O no hydrogen 3.039 N/A ASP 606.A N LEU 603.A O no hydrogen 3.212 N/A ASP 607.A N ASP 606.A OD1 no hydrogen 2.520 N/A SER 608.A N ASP 607.A OD1 no hydrogen 2.452 N/A ALA 611.A N ASP 607.A O no hydrogen 2.989 N/A LEU 612.A N SER 608.A O no hydrogen 2.944 N/A MET 613.A N ASN 609.A O no hydrogen 2.916 N/A GLY 614.A N ARG 610.A O no hydrogen 2.862 N/A ALA 615.A N ALA 611.A O no hydrogen 2.905 N/A ASN 616.A N LEU 612.A O no hydrogen 2.954 N/A MET 617.A N MET 613.A O no hydrogen 2.890 N/A GLN 618.A N GLY 614.A O no hydrogen 2.884 N/A GLN 618.A NE2 ALA 596.A O no hydrogen 3.662 N/A ARG 619.A N ALA 615.A O no hydrogen 2.952 N/A ARG 619.A NH1 ASN 616.A OD1 no hydrogen 2.349 N/A GLN 620.A N MET 617.A O no hydrogen 3.459 N/A ALA 621.A N GLN 618.A O no hydrogen 3.303 N/A MET 625.A N THR 762.A O no hydrogen 3.039 N/A THR 634.A OG1 CYS 599.A O no hydrogen 2.999 N/A GLU 637.A N THR 634.A O no hydrogen 2.850 N/A SER 640.A OG MET 636.A O no hydrogen 2.214 N/A GLY 641.A N TYR 638.A O no hydrogen 2.804 N/A LYS 642.A N TYR 638.A O no hydrogen 3.061 N/A LYS 642.A NZ ASP 643.A OD1 no hydrogen 3.365 N/A SER 644.A OG SER 640.A O no hydrogen 2.457 N/A VAL 648.A N ALA 717.A O no hydrogen 3.360 N/A CYS 650.A SG VAL 711.A O no hydrogen 3.325 N/A LYS 651.A N TYR 684.A OH no hydrogen 2.993 N/A GLY 654.A N HIS 652.A O no hydrogen 2.626 N/A ILE 655.A N ARG 667.A O no hydrogen 2.831 N/A GLU 657.A N TRP 665.A O no hydrogen 2.920 N/A ARG 658.A N TRP 665.A O no hydrogen 2.966 N/A VAL 664.A N TYR 684.A O no hydrogen 2.927 N/A TRP 665.A N ARG 658.A O no hydrogen 2.884 N/A VAL 666.A N ASP 682.A O no hydrogen 2.950 N/A ARG 667.A N ILE 655.A O no hydrogen 3.006 N/A ARG 667.A N GLU 657.A OE1 no hydrogen 2.611 N/A ARG 667.A NH2 LYS 678.A O no hydrogen 2.796 N/A GLN 675.A N VAL 672.A O no hydrogen 3.181 N/A LYS 676.A NZ GLU 671.A OE1 no hydrogen 3.128 N/A LYS 676.A NZ ASP 673.A O no hydrogen 2.465 N/A LYS 678.A NZ GLU 671.A OE1 no hydrogen 3.039 N/A LEU 681.A N GLY 679.A O no hydrogen 2.752 N/A ASP 682.A N VAL 666.A O no hydrogen 2.863 N/A LYS 683.A NZ SER 685.A OG no hydrogen 3.184 N/A TYR 684.A N VAL 664.A O no hydrogen 2.888 N/A LEU 686.A N LYS 662.A O no hydrogen 3.402 N/A LYS 688.A NZ ALA 661.A O no hydrogen 3.380 N/A LYS 688.A NZ GLN 700.A O no hydrogen 2.745 N/A SER 692.A OG THR 696.A O no hydrogen 2.356 N/A SER 692.A OG THR 696.A OG1 no hydrogen 3.024 N/A GLY 695.A N SER 692.A O no hydrogen 3.445 N/A THR 696.A N SER 692.A OG no hydrogen 2.595 N/A THR 696.A OG1 SER 692.A OG no hydrogen 3.024 N/A ILE 703.A N LEU 716.A O no hydrogen 2.852 N/A SER 705.A N ASP 708.A OD2 no hydrogen 3.375 N/A SER 705.A OG ASP 708.A OD2 no hydrogen 2.560 N/A GLU 714.A N VAL 711.A O no hydrogen 3.012 N/A LEU 716.A N VAL 648.A O no hydrogen 3.371 N/A GLU 723.A N GLU 726.A O no hydrogen 2.644 N/A GLU 726.A N GLU 723.A O no hydrogen 2.806 N/A LEU 727.A N GLU 637.A O no hydrogen 3.033 N/A GLY 730.A N TYR 1010.A OH no hydrogen 2.531 N/A ARG 731.A N MET 1011.A O no hydrogen 2.947 N/A VAL 733.A N MET 1009.A O no hydrogen 2.925 N/A VAL 735.A N GLY 1007.A O no hydrogen 2.840 N/A GLY 736.A N ILE 929.A O no hydrogen 3.359 N/A THR 739.A OG1 ASN 744.A O no hydrogen 3.405 N/A TYR 743.A N TRP 740.A O no hydrogen 2.912 N/A ASN 744.A ND2 MET 738.A O no hydrogen 2.912 N/A ASN 744.A ND2 LEU 931.A O no hydrogen 2.256 N/A TYR 745.A N TYR 743.A O no hydrogen 2.742 N/A ALA 748.A N TYR 745.A O no hydrogen 3.288 N/A ILE 749.A N VAL 908.A O no hydrogen 2.829 N/A MET 751.A N LYS 911.A O no hydrogen 3.393 N/A SER 752.A N ASP 928.A O no hydrogen 2.408 N/A SER 752.A OG ILE 927.A O no hydrogen 2.603 N/A SER 752.A OG ASP 928.A O no hydrogen 2.553 N/A ARG 754.A N GLU 915.A OE1 no hydrogen 3.038 N/A ARG 754.A NE ASP 928.A OD1 no hydrogen 2.929 N/A ARG 754.A NH2 ASP 928.A OD1 no hydrogen 3.136 N/A LEU 755.A N SER 752.A O no hydrogen 3.471 N/A VAL 756.A N GLU 753.A O no hydrogen 2.912 N/A LYS 757.A N GLU 753.A O no hydrogen 3.286 N/A LYS 757.A NZ GLU 753.A OE1 no hydrogen 3.009 N/A ASP 759.A N VAL 756.A O no hydrogen 3.241 N/A THR 762.A OG1 ASP 759.A O no hydrogen 3.189 N/A SER 763.A N ARG 891.A O no hydrogen 2.898 N/A HIS 765.A N GLN 889.A O no hydrogen 2.922 N/A GLU 767.A N ILE 887.A O no hydrogen 2.925 N/A TYR 769.A N VAL 885.A O no hydrogen 2.941 N/A SER 771.A N VAL 883.A O no hydrogen 2.885 N/A ASP 775.A N GLY 878.A O no hydrogen 2.941 N/A GLY 779.A N THR 776.A O no hydrogen 3.260 N/A THR 784.A OG1 GLU 782.A O no hydrogen 3.322 N/A ARG 785.A NE ASP 799.A O no hydrogen 2.735 N/A ALA 794.A N ASP 793.A OD1 no hydrogen 2.910 N/A LEU 795.A N GLY 791.A O no hydrogen 3.431 N/A ARG 796.A N GLU 792.A O no hydrogen 2.893 N/A ASN 797.A N ASP 793.A O no hydrogen 2.926 N/A ASN 797.A ND2 ASP 814.A OD2 no hydrogen 3.562 N/A LEU 798.A N ALA 794.A O no hydrogen 3.117 N/A ASP 799.A N ILE 803.A O no hydrogen 2.645 N/A ARG 801.A N ASP 800.A OD1 no hydrogen 2.689 N/A ALA 808.A N ARG 805.A O no hydrogen 3.050 N/A GLY 813.A N ASP 812.A OD1 no hydrogen 2.624 N/A LEU 815.A N ASP 814.A OD1 no hydrogen 2.637 N/A LYS 819.A N THR 849.A O no hydrogen 2.912 N/A LYS 819.A NZ THR 849.A O no hydrogen 2.713 N/A LYS 819.A NZ THR 849.A OG1 no hydrogen 2.841 N/A THR 821.A N ARG 847.A O no hydrogen 2.884 N/A THR 821.A OG1 ARG 847.A O no hydrogen 3.284 N/A THR 826.A N LYS 823.A O no hydrogen 3.375 N/A THR 826.A OG1 LYS 823.A O no hydrogen 3.175 N/A GLU 832.A N THR 829.A OG1 no hydrogen 3.269 N/A ARG 833.A N THR 829.A O no hydrogen 3.348 N/A LEU 834.A N ALA 830.A O no hydrogen 2.908 N/A LEU 835.A N GLU 831.A O no hydrogen 2.905 N/A HIS 836.A N GLU 832.A O no hydrogen 2.892 N/A ALA 837.A N ARG 833.A O no hydrogen 2.917 N/A ILE 838.A N LEU 834.A O no hydrogen 2.909 N/A PHE 839.A N LEU 835.A O no hydrogen 2.898 N/A ARG 844.A NH2 LEU 778.A O no hydrogen 3.049 N/A ARG 847.A N THR 821.A O no hydrogen 2.912 N/A THR 849.A N LYS 819.A O no hydrogen 2.927 N/A VAL 853.A N ASP 814.A O no hydrogen 2.832 N/A GLY 856.A N ASP 812.A OD2 no hydrogen 3.155 N/A GLY 857.A N PRO 854.A O no hydrogen 3.297 N/A ILE 861.A N ALA 808.A O no hydrogen 3.052 N/A HIS 862.A N TYR 886.A O no hydrogen 2.722 N/A ASP 863.A N TYR 886.A O no hydrogen 2.998 N/A LYS 865.A N ARG 884.A O no hydrogen 2.898 N/A LYS 865.A NZ GLU 82.A OE1 no hydrogen 2.624 N/A PHE 867.A N LEU 882.A O no hydrogen 2.909 N/A ASN 868.A N ASP 873.A OD2 no hydrogen 3.240 N/A ARG 869.A N ASN 880.A O no hydrogen 2.415 N/A ARG 869.A NH1 PRO 876.A O no hydrogen 3.412 N/A ARG 869.A NH2 PRO 876.A O no hydrogen 2.817 N/A ARG 869.A NH2 VAL 879.A O no hydrogen 2.304 N/A VAL 879.A N PRO 876.A O no hydrogen 3.378 N/A ASN 880.A N ALA 773.A O no hydrogen 2.580 N/A GLN 881.A N ALA 773.A O no hydrogen 2.934 N/A LEU 882.A N PHE 867.A O no hydrogen 2.882 N/A VAL 883.A N SER 771.A O no hydrogen 2.911 N/A ARG 884.A N LYS 865.A O no hydrogen 2.901 N/A ARG 884.A NE GLU 768.A OE2 no hydrogen 2.679 N/A ARG 884.A NH2 GLU 82.A O no hydrogen 3.366 N/A VAL 885.A N TYR 769.A O no hydrogen 2.886 N/A TYR 886.A N ASP 863.A O no hydrogen 2.871 N/A ILE 887.A N GLU 767.A O no hydrogen 2.899 N/A VAL 888.A N ILE 860.A O no hydrogen 3.166 N/A GLN 889.A N HIS 765.A O no hydrogen 2.909 N/A ARG 891.A N SER 763.A O no hydrogen 2.899 N/A ILE 893.A N TYR 761.A O no hydrogen 3.402 N/A SER 894.A OG GLU 895.A OE1 no hydrogen 2.915 N/A GLU 895.A N GLU 895.A OE1 no hydrogen 2.557 N/A ASP 897.A N SER 894.A O no hydrogen 3.297 N/A MET 899.A N GLY 907.A O no hydrogen 2.970 N/A ALA 900.A N ILE 1012.A O no hydrogen 3.526 N/A ARG 902.A NH1 VAL 632.A O no hydrogen 3.243 N/A ARG 902.A NH2 VAL 632.A O no hydrogen 3.039 N/A ARG 902.A NH2 GLU 947.A OE2 no hydrogen 2.335 N/A HIS 903.A NE2 GLU 947.A OE1 no hydrogen 2.890 N/A ASN 905.A ND2 GLN 944.A OE1 no hydrogen 2.455 N/A GLY 907.A N MET 899.A O no hydrogen 2.836 N/A SER 910.A N ILE 749.A O no hydrogen 3.428 N/A LYS 911.A NZ TYR 743.A OH no hydrogen 3.083 N/A GLU 916.A N GLU 916.A OE1 no hydrogen 2.466 N/A MET 918.A N GLU 916.A O no hydrogen 2.711 N/A TYR 920.A N TYR 992.A O no hydrogen 3.293 N/A LEU 921.A N THR 925.A O no hydrogen 3.260 N/A GLY 924.A N LEU 921.A O no hydrogen 3.172 N/A THR 925.A N ASP 923.A OD1 no hydrogen 3.285 N/A ASP 928.A N MET 734.A O no hydrogen 2.982 N/A MET 930.A N ILE 750.A O no hydrogen 3.254 N/A ASN 932.A ND2 ASN 744.A OD1 no hydrogen 3.538 N/A LEU 934.A N ASN 932.A OD1 no hydrogen 2.804 N/A SER 938.A N GLY 935.A O no hydrogen 3.361 N/A ARG 939.A N GLY 935.A O no hydrogen 2.902 N/A MET 940.A N VAL 936.A O no hydrogen 3.124 N/A ILE 942.A N MET 940.A O no hydrogen 2.998 N/A VAL 945.A N ILE 942.A O no hydrogen 3.124 N/A GLU 947.A N GLY 943.A O no hydrogen 2.911 N/A LEU 948.A N GLN 944.A O no hydrogen 2.919 N/A HIS 949.A N VAL 945.A O no hydrogen 2.936 N/A MET 950.A N LEU 946.A O no hydrogen 2.946 N/A GLY 951.A N GLU 947.A O no hydrogen 2.893 N/A MET 952.A N LEU 948.A O no hydrogen 2.949 N/A ALA 953.A N HIS 949.A O no hydrogen 2.956 N/A ALA 954.A N MET 950.A O no hydrogen 2.914 N/A ARG 955.A N GLY 951.A O no hydrogen 2.935 N/A GLY 958.A N ALA 954.A O no hydrogen 2.559 N/A ALA 962.A N ARG 14.A O no hydrogen 2.657 N/A SER 963.A N GLY 633.A O no hydrogen 3.329 N/A SER 963.A OG PRO 964.A O no hydrogen 3.116 N/A GLY 968.A N GLU 604.A OE2 no hydrogen 3.141 N/A VAL 974.A N ARG 970.A O no hydrogen 2.956 N/A TRP 975.A N GLU 971.A O no hydrogen 2.938 N/A GLU 976.A N GLU 972.A O no hydrogen 2.873 N/A THR 977.A N ASP 973.A O no hydrogen 2.922 N/A LEU 978.A N VAL 974.A O no hydrogen 2.953 N/A GLU 979.A N TRP 975.A O no hydrogen 2.864 N/A GLU 980.A N GLU 976.A O no hydrogen 2.921 N/A ALA 981.A N THR 977.A O no hydrogen 2.934 N/A SER 984.A OG GLU 979.A O no hydrogen 2.344 N/A THR 989.A OG1 VAL 990.A O no hydrogen 3.557 N/A GLY 994.A N ASP 993.A OD1 no hydrogen 2.360 N/A ARG 995.A NH1 ASP 993.A OD1 no hydrogen 3.083 N/A PHE 1000.A N LEU 991.A O no hydrogen 3.315 N/A VAL 1004.A N THR 989.A O no hydrogen 2.891 N/A GLY 1007.A N VAL 735.A O no hydrogen 2.961 N/A MET 1009.A N VAL 733.A O no hydrogen 2.901 N/A MET 1011.A N ARG 731.A O no hydrogen 2.884 N/A ILE 1012.A N ALA 900.A O no hydrogen 3.398 N/A LEU 1014.A N LYS 898.A O no hydrogen 3.084 N/A GLU 1020.A N GLU 1020.A OE1 no hydrogen 2.813 N/A TRP 1022.A N GLU 1018.A O no hydrogen 3.282 N/A ALA 1023.A N MET 1019.A O no hydrogen 2.902 N/A LEU 1024.A N GLU 1020.A O no hydrogen 2.915 N/A GLU 1025.A N VAL 1021.A O no hydrogen 2.896 N/A ALA 1026.A N TRP 1022.A O no hydrogen 2.906 N/A TYR 1027.A N ALA 1023.A O no hydrogen 2.907 N/A THR 1032.A OG1 GLU 1035.A OE1 no hydrogen 3.345 N/A GLN 1034.A NE2 SER 1057.A OG no hydrogen 3.362 N/A GLU 1035.A N TYR 1031.A O no hydrogen 2.928 N/A ILE 1036.A N THR 1032.A O no hydrogen 2.940 N/A LEU 1037.A N LEU 1033.A O no hydrogen 2.934 N/A THR 1038.A N GLN 1034.A O no hydrogen 2.943 N/A THR 1038.A OG1 GLN 1034.A O no hydrogen 3.336 N/A THR 1038.A OG1 GLU 1035.A O no hydrogen 3.025 N/A VAL 1039.A N GLU 1035.A O no hydrogen 2.915 N/A LYS 1040.A N ILE 1036.A O no hydrogen 2.926 N/A SER 1041.A OG THR 1038.A O no hydrogen 3.496 N/A LYS 1049.A N VAL 1045.A O no hydrogen 3.440 N/A THR 1050.A N GLY 1046.A O no hydrogen 2.923 N/A THR 1050.A OG1 GLY 1046.A O no hydrogen 2.653 N/A THR 1050.A OG1 ARG 1047.A O no hydrogen 2.793 N/A TYR 1051.A N ARG 1047.A O no hydrogen 2.905 N/A GLU 1052.A N VAL 1048.A O no hydrogen 2.904 N/A ALA 1053.A N LYS 1049.A O no hydrogen 2.905 N/A LYS 1059.A N PRO 1055.A O no hydrogen 3.263 N/A VAL 1060.A N GLU 1056.A O no hydrogen 2.918 N/A LEU 1061.A N SER 1057.A O no hydrogen 2.918 N/A ILE 1062.A N PHE 1058.A O no hydrogen 2.910 N/A LYS 1063.A N LYS 1059.A O no hydrogen 2.924 N/A GLU 1064.A N VAL 1060.A O no hydrogen 2.866 N/A LEU 1065.A N LEU 1061.A O no hydrogen 2.903 N/A GLN 1066.A N ILE 1062.A O no hydrogen 2.910 N/A SER 1067.A N GLU 1064.A O no hydrogen 3.069 N/A SER 1067.A OG GLU 1064.A O no hydrogen 2.486 N/A