Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ls1_m.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A OG1 GLN 6.A OE1 no hydrogen 3.398 N/A ILE 7.A N THR 3.A O no hydrogen 2.968 N/A ARG 8.A N VAL 4.A O no hydrogen 2.838 N/A ARG 8.A NE ASP 429.A OD2 no hydrogen 3.144 N/A ARG 8.A NH1 ASP 12.A OD1 no hydrogen 2.951 N/A ARG 8.A NH2 ASP 12.A OD1 no hydrogen 2.649 N/A ARG 8.A NH2 ASP 429.A OD2 no hydrogen 2.404 N/A ALA 9.A N ASP 5.A O no hydrogen 2.907 N/A ILE 10.A N GLN 6.A O no hydrogen 2.952 N/A MET 11.A N ILE 7.A O no hydrogen 2.896 N/A ASP 12.A N ARG 8.A O no hydrogen 2.840 N/A LYS 13.A N ALA 9.A O no hydrogen 2.965 N/A LYS 14.A N ASP 12.A O no hydrogen 2.879 N/A ARG 18.A N LEU 70.A O no hydrogen 2.897 N/A ARG 18.A NE LEU 324.A O no hydrogen 3.030 N/A ARG 18.A NH1 ILE 17.A O no hydrogen 2.884 N/A ARG 18.A NH2 LEU 324.A O no hydrogen 2.648 N/A ASN 19.A ND2 ASP 94.A OD2 no hydrogen 2.851 N/A MET 20.A N ASN 72.A O no hydrogen 2.865 N/A SER 21.A N GLY 95.A O no hydrogen 2.899 N/A SER 21.A OG GLY 95.A O no hydrogen 2.888 N/A ILE 23.A N LEU 97.A O no hydrogen 2.899 N/A LYS 30.A NZ SER 76.A O no hydrogen 2.407 N/A LYS 30.A NZ SER 76.A OG no hydrogen 3.367 N/A THR 32.A OG1 GLY 29.A O no hydrogen 2.543 N/A LEU 33.A N GLY 29.A O no hydrogen 2.921 N/A THR 34.A N LYS 30.A O no hydrogen 2.902 N/A THR 34.A OG1 LYS 30.A O no hydrogen 3.027 N/A THR 34.A OG1 SER 31.A O no hydrogen 2.620 N/A ASP 35.A N SER 31.A O no hydrogen 2.881 N/A SER 36.A N THR 32.A O no hydrogen 2.921 N/A LEU 37.A N LEU 33.A O no hydrogen 2.921 N/A VAL 38.A N THR 34.A O no hydrogen 2.894 N/A CYS 39.A N ASP 35.A O no hydrogen 2.904 N/A LYS 40.A N SER 36.A O no hydrogen 2.935 N/A LYS 40.A NZ GLY 191.A O no hydrogen 3.492 N/A ALA 41.A N LEU 37.A O no hydrogen 3.073 N/A ILE 46.A N LEU 73.A O no hydrogen 2.926 N/A LEU 48.A N ILE 71.A O no hydrogen 2.872 N/A TYR 50.A N PHE 69.A O no hydrogen 2.928 N/A TYR 50.A OH ASP 314.A OD1 no hydrogen 2.177 N/A SER 53.A N ASP 56.A OD2 no hydrogen 2.779 N/A SER 53.A OG ASP 56.A OD2 no hydrogen 2.683 N/A LEU 57.A N SER 53.A O no hydrogen 2.914 N/A ASN 58.A N GLU 54.A O no hydrogen 2.933 N/A ASN 58.A ND2 GLU 54.A O no hydrogen 2.324 N/A PHE 59.A N ASN 55.A O no hydrogen 2.846 N/A ILE 60.A N LEU 57.A O no hydrogen 3.263 N/A LYS 64.A NZ ALA 15.A O no hydrogen 2.474 N/A SER 67.A OG GLU 51.A OE1 no hydrogen 2.388 N/A PHE 69.A N TYR 50.A O no hydrogen 2.875 N/A ILE 71.A N LEU 48.A O no hydrogen 2.910 N/A ASN 72.A N ARG 18.A O no hydrogen 2.928 N/A ASN 72.A ND2 ASN 19.A OD1 no hydrogen 2.366 N/A LEU 73.A N ILE 46.A O no hydrogen 2.880 N/A ILE 74.A N MET 20.A O no hydrogen 2.961 N/A ASP 75.A N THR 44.A O no hydrogen 2.895 N/A SER 76.A OG VAL 22.A O no hydrogen 2.449 N/A SER 83.A N VAL 80.A O no hydrogen 3.473 N/A SER 83.A OG VAL 80.A O no hydrogen 2.925 N/A VAL 86.A N PHE 82.A O no hydrogen 2.983 N/A THR 87.A N SER 83.A O no hydrogen 2.845 N/A THR 87.A OG1 SER 83.A O no hydrogen 2.518 N/A THR 87.A OG1 SER 84.A O no hydrogen 2.823 N/A ALA 88.A N SER 84.A O no hydrogen 2.937 N/A ALA 89.A N GLU 85.A O no hydrogen 2.931 N/A LEU 90.A N VAL 86.A O no hydrogen 2.873 N/A ARG 91.A N THR 87.A O no hydrogen 2.914 N/A VAL 92.A N ALA 88.A O no hydrogen 2.958 N/A THR 93.A N ALA 89.A O no hydrogen 2.885 N/A THR 93.A OG1 ALA 89.A O no hydrogen 2.645 N/A THR 93.A OG1 LEU 90.A O no hydrogen 3.565 N/A GLY 95.A N ASN 19.A O no hydrogen 2.900 N/A ALA 96.A N LYS 123.A O no hydrogen 2.922 N/A LEU 97.A N SER 21.A O no hydrogen 2.888 N/A VAL 98.A N VAL 125.A O no hydrogen 2.876 N/A VAL 99.A N ILE 23.A O no hydrogen 2.906 N/A VAL 100.A N MET 127.A O no hydrogen 2.861 N/A CYS 102.A N ASN 129.A O no hydrogen 3.281 N/A VAL 103.A N ASP 101.A OD1 no hydrogen 3.179 N/A SER 104.A N ASP 101.A OD2 no hydrogen 3.483 N/A SER 104.A OG HIS 28.A NE2 no hydrogen 3.057 N/A SER 104.A OG GLY 105.A O no hydrogen 3.471 N/A GLY 105.A N ASP 101.A O no hydrogen 2.964 N/A CYS 107.A N THR 110.A OG1 no hydrogen 2.678 N/A CYS 107.A SG HIS 28.A NE2 no hydrogen 3.989 N/A CYS 107.A SG SER 104.A OG no hydrogen 3.686 N/A CYS 107.A SG GLY 105.A O no hydrogen 3.354 N/A THR 110.A OG1 CYS 107.A O no hydrogen 2.461 N/A GLU 111.A N CYS 107.A O no hydrogen 2.911 N/A THR 112.A N VAL 108.A O no hydrogen 2.923 N/A THR 112.A OG1 VAL 108.A O no hydrogen 3.486 N/A THR 112.A OG1 GLN 109.A O no hydrogen 2.717 N/A VAL 113.A N GLN 109.A O no hydrogen 2.916 N/A LEU 114.A N THR 110.A O no hydrogen 2.894 N/A ARG 115.A N GLU 111.A O no hydrogen 2.873 N/A GLN 116.A N THR 112.A O no hydrogen 2.927 N/A ALA 117.A N VAL 113.A O no hydrogen 2.910 N/A ILE 118.A N LEU 114.A O no hydrogen 2.891 N/A ALA 119.A N ARG 115.A O no hydrogen 2.881 N/A GLU 120.A N GLN 116.A O no hydrogen 2.933 N/A ARG 121.A N ILE 118.A O no hydrogen 2.922 N/A ILE 122.A N ALA 117.A O no hydrogen 2.841 N/A LYS 123.A NZ HIS 323.A O no hydrogen 3.318 N/A VAL 125.A N ALA 96.A O no hydrogen 2.894 N/A LEU 126.A N THR 182.A O no hydrogen 2.934 N/A MET 127.A N VAL 98.A O no hydrogen 2.915 N/A MET 128.A N GLY 184.A O no hydrogen 2.830 N/A ASN 129.A N VAL 100.A O no hydrogen 2.936 N/A ASN 129.A ND2 HIS 28.A O no hydrogen 2.811 N/A ALA 134.A N LYS 130.A O no hydrogen 2.946 N/A LEU 135.A N MET 131.A O no hydrogen 2.908 N/A LEU 136.A N ASP 132.A O no hydrogen 2.846 N/A LEU 138.A N ARG 133.A O no hydrogen 3.162 N/A GLN 139.A N LEU 135.A O no hydrogen 3.113 N/A GLU 141.A N GLU 144.A OE2 no hydrogen 2.578 N/A LEU 145.A N GLU 141.A O no hydrogen 2.942 N/A TYR 146.A N PRO 142.A O no hydrogen 2.916 N/A TYR 146.A OH ASP 229.A OD1 no hydrogen 3.424 N/A GLN 147.A N GLU 143.A O no hydrogen 2.927 N/A GLN 147.A NE2 GLU 143.A OE2 no hydrogen 2.787 N/A THR 148.A N GLU 144.A O no hydrogen 2.874 N/A THR 148.A OG1 GLU 144.A O no hydrogen 2.706 N/A PHE 149.A N LEU 145.A O no hydrogen 2.967 N/A GLN 150.A N TYR 146.A O no hydrogen 2.920 N/A ARG 151.A N GLN 147.A O no hydrogen 2.912 N/A ARG 151.A NH1 GLU 154.A OE1 no hydrogen 2.796 N/A ARG 151.A NH2 GLN 147.A OE1 no hydrogen 3.168 N/A ILE 152.A N THR 148.A O no hydrogen 2.964 N/A VAL 153.A N PHE 149.A O no hydrogen 2.952 N/A GLU 154.A N GLN 150.A O no hydrogen 2.904 N/A ASN 155.A N ARG 151.A O no hydrogen 2.937 N/A VAL 156.A N ILE 152.A O no hydrogen 2.981 N/A ASN 157.A N VAL 153.A O no hydrogen 2.906 N/A VAL 158.A N GLU 154.A O no hydrogen 2.879 N/A ILE 159.A N ASN 155.A O no hydrogen 2.982 N/A ILE 160.A N VAL 156.A O no hydrogen 2.938 N/A SER 161.A N ASN 157.A O no hydrogen 2.876 N/A SER 161.A OG ASN 157.A O no hydrogen 2.966 N/A THR 162.A N VAL 158.A O no hydrogen 2.907 N/A THR 162.A OG1 VAL 158.A O no hydrogen 2.823 N/A TYR 163.A N ILE 159.A O no hydrogen 2.974 N/A TYR 163.A OH GLU 111.A OE2 no hydrogen 3.084 N/A SER 168.A OG GLY 166.A O no hydrogen 3.518 N/A GLY 172.A N GLY 169.A O no hydrogen 3.139 N/A ASN 173.A ND2 MET 175.A O no hydrogen 3.695 N/A ASP 177.A N THR 182.A OG1 no hydrogen 3.104 N/A LEU 180.A N ASP 177.A O no hydrogen 3.332 N/A GLY 181.A N PRO 178.A O no hydrogen 3.087 N/A THR 182.A OG1 ASP 177.A O no hydrogen 2.732 N/A PHE 185.A N PHE 194.A O no hydrogen 3.291 N/A GLY 186.A N MET 128.A O no hydrogen 2.933 N/A SER 187.A N TRP 192.A O no hydrogen 2.736 N/A SER 187.A OG ASP 132.A OD2 no hydrogen 2.476 N/A GLY 188.A N ASN 129.A OD1 no hydrogen 3.061 N/A GLY 191.A N GLY 188.A O no hydrogen 3.203 N/A TRP 192.A N SER 187.A O no hydrogen 3.198 N/A ALA 193.A N LEU 310.A O no hydrogen 3.313 N/A PHE 194.A N PHE 185.A O no hydrogen 2.838 N/A THR 195.A OG1 VAL 183.A O no hydrogen 3.316 N/A LYS 197.A NZ GLU 201.A OE1 no hydrogen 3.231 N/A LYS 197.A NZ GLN 318.A OE1 no hydrogen 3.331 N/A PHE 199.A N THR 195.A O no hydrogen 3.016 N/A ALA 200.A N LEU 196.A O no hydrogen 2.824 N/A GLU 201.A N LYS 197.A O no hydrogen 2.916 N/A MET 202.A N GLN 198.A O no hydrogen 2.907 N/A TYR 203.A N PHE 199.A O no hydrogen 2.951 N/A VAL 204.A N ALA 200.A O no hydrogen 2.853 N/A ALA 205.A N GLU 201.A O no hydrogen 2.932 N/A LYS 206.A N MET 202.A O no hydrogen 2.877 N/A PHE 207.A N TYR 203.A O no hydrogen 2.923 N/A SER 211.A N GLU 214.A OE1 no hydrogen 3.035 N/A ARG 215.A N SER 211.A O no hydrogen 2.893 N/A ALA 216.A N ALA 212.A O no hydrogen 2.930 N/A LYS 217.A N ALA 213.A O no hydrogen 2.915 N/A LYS 218.A N GLU 214.A O no hydrogen 2.893 N/A VAL 219.A N ARG 215.A O no hydrogen 2.922 N/A GLU 220.A N ALA 216.A O no hydrogen 2.931 N/A ASP 221.A N LYS 217.A O no hydrogen 2.920 N/A MET 222.A N LYS 218.A O no hydrogen 2.878 N/A MET 223.A N VAL 219.A O no hydrogen 2.914 N/A LYS 224.A N GLU 220.A O no hydrogen 2.948 N/A LYS 225.A N ASP 221.A O no hydrogen 2.898 N/A LEU 226.A N MET 222.A O no hydrogen 2.846 N/A TRP 227.A N MET 223.A O no hydrogen 2.998 N/A GLY 228.A N LYS 224.A O no hydrogen 2.892 N/A ARG 230.A NE GLY 228.A O no hydrogen 2.567 N/A TYR 231.A N SER 240.A O no hydrogen 2.932 N/A PHE 232.A N PRO 252.A O no hydrogen 3.117 N/A ASP 233.A N LYS 238.A O no hydrogen 2.976 N/A ASN 236.A N ASP 233.A OD2 no hydrogen 2.519 N/A GLY 237.A N ASP 233.A O no hydrogen 2.554 N/A SER 240.A N TYR 231.A O no hydrogen 2.842 N/A SER 240.A OG SER 242.A OG no hydrogen 2.969 N/A SER 242.A N SER 240.A OG no hydrogen 3.244 N/A SER 242.A OG SER 240.A OG no hydrogen 2.969 N/A SER 245.A N LYS 249.A O no hydrogen 2.595 N/A ASP 247.A N SER 245.A OG no hydrogen 3.341 N/A GLY 248.A N SER 245.A O no hydrogen 2.843 N/A LEU 251.A N ALA 243.A O no hydrogen 2.951 N/A ARG 253.A NH1 GLU 143.A OE2 no hydrogen 3.117 N/A THR 254.A N ARG 230.A O no hydrogen 2.854 N/A CYS 256.A SG ARG 253.A O no hydrogen 3.204 N/A GLN 257.A N ARG 253.A O no hydrogen 2.941 N/A LEU 258.A N THR 254.A O no hydrogen 2.868 N/A LEU 258.A N PHE 255.A O no hydrogen 3.301 N/A ILE 259.A N PHE 255.A O no hydrogen 2.885 N/A LEU 260.A N PHE 255.A O no hydrogen 3.489 N/A PHE 264.A N LEU 260.A O no hydrogen 2.473 N/A LYS 265.A N ASP 261.A O no hydrogen 2.902 N/A LYS 265.A NZ ASP 261.A OD1 no hydrogen 2.491 N/A LYS 265.A NZ ASP 261.A OD2 no hydrogen 3.170 N/A VAL 266.A N PRO 262.A O no hydrogen 2.907 N/A PHE 267.A N ILE 263.A O no hydrogen 2.912 N/A ASP 268.A N PHE 264.A O no hydrogen 2.891 N/A ALA 269.A N LYS 265.A O no hydrogen 2.900 N/A ILE 270.A N VAL 266.A O no hydrogen 2.940 N/A MET 271.A N PHE 267.A O no hydrogen 2.904 N/A ASN 272.A N ASP 268.A O no hydrogen 2.899 N/A ASN 272.A ND2 ASP 268.A O no hydrogen 2.375 N/A PHE 273.A N ILE 270.A O no hydrogen 3.354 N/A ARG 274.A N ALA 269.A O no hydrogen 3.044 N/A ARG 274.A NH1 ASP 268.A OD2 no hydrogen 2.458 N/A LYS 275.A NZ PHE 273.A O no hydrogen 3.130 N/A THR 278.A N ARG 274.A O no hydrogen 2.892 N/A ALA 279.A N LYS 275.A O no hydrogen 2.916 N/A LYS 280.A N GLU 276.A O no hydrogen 2.944 N/A LEU 281.A N GLU 277.A O no hydrogen 2.878 N/A ILE 282.A N THR 278.A O no hydrogen 2.902 N/A GLU 283.A N ALA 279.A O no hydrogen 2.934 N/A LYS 284.A N LYS 280.A O no hydrogen 2.886 N/A LEU 285.A N LEU 281.A O no hydrogen 2.883 N/A ASP 286.A N ILE 282.A O no hydrogen 2.917 N/A GLU 292.A N GLU 292.A OE1 no hydrogen 2.728 N/A ASP 293.A N ASP 290.A O no hydrogen 3.192 N/A LYS 294.A N SER 291.A O no hydrogen 3.366 N/A LYS 296.A N ASP 293.A O no hydrogen 3.290 N/A LYS 296.A NZ ASP 293.A OD2 no hydrogen 3.426 N/A LEU 302.A N GLY 298.A O no hydrogen 2.893 N/A LYS 303.A N LYS 299.A O no hydrogen 2.931 N/A ALA 304.A N PRO 300.A O no hydrogen 2.905 N/A VAL 305.A N LEU 301.A O no hydrogen 2.876 N/A MET 306.A N LEU 302.A O no hydrogen 2.938 N/A ARG 307.A N LYS 303.A O no hydrogen 2.908 N/A ARG 308.A N ALA 304.A O no hydrogen 2.899 N/A TRP 309.A N VAL 305.A O no hydrogen 2.899 N/A LEU 310.A N MET 306.A O no hydrogen 2.926 N/A ALA 315.A N PRO 311.A O no hydrogen 2.962 N/A LEU 316.A N ALA 312.A O no hydrogen 2.922 N/A LEU 317.A N GLY 313.A O no hydrogen 2.880 N/A GLN 318.A N ASP 314.A O no hydrogen 2.941 N/A GLN 318.A NE2 TYR 50.A OH no hydrogen 3.512 N/A MET 319.A N ALA 315.A O no hydrogen 2.970 N/A ILE 320.A N LEU 316.A O no hydrogen 2.912 N/A THR 321.A N LEU 317.A O no hydrogen 2.907 N/A THR 321.A OG1 LEU 317.A O no hydrogen 2.635 N/A THR 321.A OG1 GLN 318.A O no hydrogen 2.726 N/A ILE 322.A N GLN 318.A O no hydrogen 2.947 N/A HIS 323.A N MET 319.A O no hydrogen 2.936 N/A HIS 323.A ND1 MET 319.A O no hydrogen 2.549 N/A HIS 323.A NE2 LEU 180.A O no hydrogen 2.440 N/A LEU 324.A N ILE 320.A O no hydrogen 2.853 N/A SER 326.A OG THR 329.A OG1 no hydrogen 2.978 N/A THR 329.A OG1 SER 326.A O no hydrogen 2.712 N/A THR 329.A OG1 SER 326.A OG no hydrogen 2.978 N/A ALA 330.A N SER 326.A O no hydrogen 2.912 N/A GLN 331.A N PRO 327.A O no hydrogen 2.865 N/A LYS 332.A N VAL 328.A O no hydrogen 2.951 N/A TYR 333.A N THR 329.A O no hydrogen 2.891 N/A ARG 334.A N ALA 330.A O no hydrogen 2.897 N/A ARG 334.A NH1 THR 93.A O no hydrogen 3.401 N/A ARG 334.A NH2 ARG 91.A O no hydrogen 3.212 N/A LEU 338.A N ARG 334.A O no hydrogen 2.906 N/A GLU 346.A N ASP 345.A OD1 no hydrogen 2.787 N/A ALA 347.A N PRO 343.A O no hydrogen 2.939 N/A ALA 348.A N ASP 344.A O no hydrogen 2.878 N/A MET 349.A N ASP 345.A O no hydrogen 2.919 N/A GLY 350.A N GLU 346.A O no hydrogen 2.883 N/A ILE 351.A N ALA 347.A O no hydrogen 2.940 N/A SER 353.A OG MET 349.A O no hydrogen 3.139 N/A CYS 354.A SG SER 353.A O no hydrogen 3.045 N/A GLY 358.A N ASP 355.A O no hydrogen 3.188 N/A LEU 360.A N THR 453.A OG1 no hydrogen 2.695 N/A MET 361.A N SER 384.A O no hydrogen 2.869 N/A MET 362.A N ILE 451.A O no hydrogen 2.900 N/A TYR 363.A N ARG 381.A O no hydrogen 3.364 N/A ILE 364.A N GLY 449.A O no hydrogen 2.873 N/A SER 365.A N PHE 379.A O no hydrogen 3.243 N/A LYS 366.A N PHE 379.A O no hydrogen 3.007 N/A VAL 368.A N TYR 377.A O no hydrogen 2.927 N/A THR 370.A N ARG 375.A O no hydrogen 2.981 N/A THR 370.A OG1 ASP 372.A OD2 no hydrogen 2.310 N/A SER 371.A OG SER 371.A O no hydrogen 2.558 N/A PHE 376.A N ASP 442.A OD2 no hydrogen 3.201 N/A TYR 377.A N VAL 368.A O no hydrogen 2.875 N/A ALA 378.A N LEU 438.A O no hydrogen 2.868 N/A PHE 379.A N LYS 366.A O no hydrogen 2.799 N/A GLY 380.A N VAL 436.A O no hydrogen 2.967 N/A ARG 381.A N TYR 363.A O no hydrogen 3.099 N/A ARG 381.A NE VAL 92.A O no hydrogen 2.535 N/A ARG 381.A NH1 GLN 331.A OE1 no hydrogen 3.172 N/A ARG 381.A NH2 VAL 92.A O no hydrogen 3.415 N/A ARG 381.A NH2 GLN 331.A OE1 no hydrogen 3.445 N/A VAL 382.A N ASN 434.A O no hydrogen 2.908 N/A PHE 383.A N MET 361.A O no hydrogen 2.956 N/A SER 384.A N MET 361.A O no hydrogen 3.057 N/A SER 384.A OG GLY 350.A O no hydrogen 3.194 N/A SER 384.A OG PRO 359.A O no hydrogen 3.249 N/A VAL 387.A N VAL 430.A O no hydrogen 2.865 N/A THR 389.A N GLU 428.A O no hydrogen 3.225 N/A THR 389.A OG1 THR 416.A OG1 no hydrogen 3.094 N/A THR 389.A OG1 ILE 427.A O no hydrogen 3.224 N/A LEU 391.A N SER 388.A O no hydrogen 3.248 N/A ARG 394.A N THR 452.A O no hydrogen 2.904 N/A ARG 394.A NH1 PHE 454.A O no hydrogen 2.474 N/A ARG 394.A NH1 GLU 455.A O no hydrogen 2.830 N/A ILE 395.A N TYR 409.A O no hydrogen 3.249 N/A MET 396.A N THR 450.A O no hydrogen 2.848 N/A GLY 397.A N ASP 407.A O no hydrogen 3.421 N/A TYR 400.A N GLY 397.A O no hydrogen 3.246 N/A THR 401.A OG1 LYS 404.A O no hydrogen 2.530 N/A TYR 409.A N ILE 395.A O no hydrogen 3.150 N/A ILE 413.A N LEU 391.A O no hydrogen 3.380 N/A THR 416.A N THR 389.A OG1 no hydrogen 3.409 N/A THR 416.A OG1 THR 389.A OG1 no hydrogen 3.094 N/A THR 416.A OG1 ILE 427.A O no hydrogen 2.326 N/A ILE 417.A N GLY 437.A O no hydrogen 3.028 N/A LEU 418.A N GLU 425.A O no hydrogen 2.932 N/A MET 420.A N TYR 423.A O no hydrogen 3.195 N/A GLU 425.A N LEU 418.A O no hydrogen 2.877 N/A ILE 427.A N THR 416.A O no hydrogen 2.909 N/A VAL 430.A N VAL 387.A O no hydrogen 2.936 N/A CYS 432.A SG CYS 354.A O no hydrogen 3.180 N/A GLY 433.A N VAL 382.A O no hydrogen 2.771 N/A ASN 434.A ND2 PRO 431.A O no hydrogen 3.360 N/A VAL 436.A N GLY 380.A O no hydrogen 2.863 N/A GLY 437.A N ILE 417.A O no hydrogen 3.146 N/A LEU 438.A N ALA 378.A O no hydrogen 2.885 N/A GLN 443.A N GLY 440.A O no hydrogen 3.319 N/A PHE 444.A N VAL 441.A O no hydrogen 3.061 N/A LEU 445.A N VAL 441.A O no hydrogen 2.916 N/A LYS 447.A NZ VAL 500.A O no hydrogen 2.895 N/A THR 448.A OG1 LYS 447.A O no hydrogen 2.565 N/A GLY 449.A N ILE 364.A O no hydrogen 2.948 N/A THR 450.A N MET 396.A O no hydrogen 2.949 N/A THR 450.A OG1 ASN 459.A OD1 no hydrogen 2.982 N/A ILE 451.A N MET 362.A O no hydrogen 2.910 N/A THR 452.A N ARG 394.A O no hydrogen 2.896 N/A THR 453.A N LEU 360.A O no hydrogen 2.939 N/A THR 453.A OG1 LEU 360.A O no hydrogen 3.339 N/A ARG 461.A N LEU 338.A O no hydrogen 3.157 N/A ARG 461.A NH1 GLU 340.A OE2 no hydrogen 3.214 N/A VAL 471.A N GLY 514.A O no hydrogen 2.930 N/A VAL 473.A N ILE 512.A O no hydrogen 2.923 N/A ALA 474.A N SER 539.A O no hydrogen 2.910 N/A VAL 475.A N HIS 510.A O no hydrogen 2.952 N/A GLU 476.A N LYS 537.A O no hydrogen 2.946 N/A LYS 478.A N PRO 535.A O no hydrogen 3.356 N/A ALA 481.A N ASN 479.A OD1 no hydrogen 3.175 N/A ASP 482.A N ASN 479.A O no hydrogen 3.001 N/A LEU 483.A N PRO 480.A O no hydrogen 3.353 N/A LEU 486.A N ASP 482.A O no hydrogen 2.867 N/A VAL 487.A N LEU 483.A O no hydrogen 2.921 N/A GLU 488.A N PRO 484.A O no hydrogen 2.910 N/A GLY 489.A N LYS 485.A O no hydrogen 2.866 N/A LEU 490.A N LEU 486.A O no hydrogen 2.867 N/A LYS 491.A N VAL 487.A O no hydrogen 2.952 N/A ARG 492.A N GLU 488.A O no hydrogen 2.912 N/A LEU 493.A N GLY 489.A O no hydrogen 2.841 N/A ALA 494.A N LEU 490.A O no hydrogen 2.900 N/A LYS 495.A N LYS 491.A O no hydrogen 2.945 N/A SER 496.A N ARG 492.A O no hydrogen 2.887 N/A SER 496.A OG ARG 492.A O no hydrogen 3.125 N/A SER 496.A OG LEU 493.A O no hydrogen 2.851 N/A SER 496.A OG ASP 497.A OD1 no hydrogen 2.936 N/A ASP 497.A N LEU 493.A O no hydrogen 2.915 N/A GLN 501.A N ALA 513.A O no hydrogen 2.944 N/A ILE 503.A N ILE 511.A O no hydrogen 2.930 N/A GLU 505.A N GLU 509.A O no hydrogen 2.899 N/A SER 507.A N GLU 505.A OE1 no hydrogen 2.439 N/A GLY 508.A N GLU 505.A O no hydrogen 3.240 N/A ILE 511.A N ILE 503.A O no hydrogen 2.904 N/A ILE 512.A N VAL 473.A O no hydrogen 2.903 N/A ALA 513.A N GLN 501.A O no hydrogen 2.845 N/A GLY 514.A N VAL 471.A O no hydrogen 2.869 N/A HIS 519.A N ASP 81.A OD2 no hydrogen 2.935 N/A LEU 520.A N GLY 516.A O no hydrogen 2.912 N/A GLU 521.A N GLU 517.A O no hydrogen 2.859 N/A ILE 522.A N LEU 518.A O no hydrogen 2.944 N/A CYS 523.A N HIS 519.A O no hydrogen 2.895 N/A CYS 523.A SG ASP 497.A OD2 no hydrogen 3.643 N/A CYS 523.A SG HIS 519.A O no hydrogen 3.200 N/A LEU 524.A N LEU 520.A O no hydrogen 2.852 N/A LYS 525.A N GLU 521.A O no hydrogen 2.921 N/A ASP 526.A N ILE 522.A O no hydrogen 2.960 N/A LEU 527.A N CYS 523.A O no hydrogen 2.866 N/A GLU 528.A N LEU 524.A O no hydrogen 2.880 N/A GLU 529.A N LYS 525.A O no hydrogen 2.952 N/A ASP 530.A N ASP 526.A O no hydrogen 2.873 N/A HIS 531.A N ASP 526.A O no hydrogen 2.897 N/A ALA 532.A N LEU 527.A O no hydrogen 2.852 N/A CYS 533.A N LEU 527.A O no hydrogen 3.213 N/A CYS 533.A SG GLU 529.A O no hydrogen 3.552 N/A LYS 537.A N GLU 476.A O no hydrogen 2.860 N/A SER 539.A N ALA 474.A O no hydrogen 2.926 N/A SER 539.A OG ALA 474.A O no hydrogen 3.280 N/A SER 544.A OG TYR 545.A O no hydrogen 3.382 N/A TYR 545.A N GLU 661.A OE2 no hydrogen 2.877 N/A ARG 546.A N MET 706.A O no hydrogen 2.963 N/A GLU 547.A N ASN 662.A O no hydrogen 3.247 N/A THR 548.A N ARG 704.A O no hydrogen 2.915 N/A THR 548.A OG1 ARG 704.A O no hydrogen 3.398 N/A SER 550.A N GLN 702.A O no hydrogen 3.101 N/A SER 550.A OG GLN 702.A O no hydrogen 3.172 N/A SER 553.A N ALA 572.A O no hydrogen 2.778 N/A SER 553.A OG ALA 572.A O no hydrogen 3.123 N/A SER 553.A OG SER 697.A OG no hydrogen 3.384 N/A CYS 557.A N MET 570.A O no hydrogen 2.935 N/A CYS 557.A SG THR 700.A OG1 no hydrogen 3.705 N/A SER 559.A N LEU 568.A O no hydrogen 2.951 N/A SER 559.A OG THR 689.A O no hydrogen 3.279 N/A SER 561.A N ASN 566.A O no hydrogen 2.938 N/A SER 561.A OG ASN 566.A O no hydrogen 3.494 N/A LYS 564.A N SER 561.A O no hydrogen 2.814 N/A HIS 565.A ND1 ASN 563.A O no hydrogen 2.658 N/A ASN 566.A ND2 SER 561.A OG no hydrogen 3.037 N/A ARG 567.A N THR 674.A O no hydrogen 2.930 N/A LEU 568.A N SER 559.A O no hydrogen 2.850 N/A TYR 569.A N ASP 672.A O no hydrogen 2.851 N/A MET 570.A N CYS 557.A O no hydrogen 2.928 N/A LYS 571.A N ASP 669.A O no hydrogen 2.943 N/A ALA 572.A N SER 553.A OG no hydrogen 2.613 N/A ARG 573.A N ARG 667.A O no hydrogen 2.884 N/A ARG 573.A NH1 GLU 552.A OE2 no hydrogen 2.589 N/A ARG 573.A NH2 ASP 669.A OD2 no hydrogen 2.443 N/A ILE 583.A N LEU 579.A O no hydrogen 2.957 N/A ASP 584.A N ALA 580.A O no hydrogen 2.918 N/A LYS 585.A N GLU 581.A O no hydrogen 2.894 N/A GLY 586.A N ASP 582.A O no hydrogen 2.943 N/A GLU 587.A N ASP 582.A O no hydrogen 3.053 N/A GLN 592.A N SER 589.A O no hydrogen 3.470 N/A GLN 592.A NE2 GLU 587.A O no hydrogen 3.199 N/A ARG 597.A N GLU 593.A O no hydrogen 2.918 N/A ALA 598.A N LEU 594.A O no hydrogen 2.909 N/A ARG 599.A N LYS 595.A O no hydrogen 2.887 N/A TYR 600.A N ALA 596.A O no hydrogen 2.927 N/A TYR 600.A OH GLU 587.A OE2 no hydrogen 2.445 N/A LEU 601.A N ARG 597.A O no hydrogen 2.943 N/A ALA 602.A N ALA 598.A O no hydrogen 2.906 N/A GLU 603.A N ARG 599.A O no hydrogen 2.898 N/A LYS 604.A N TYR 600.A O no hydrogen 2.959 N/A LYS 604.A NZ TYR 605.A OH no hydrogen 2.829 N/A TYR 605.A N LEU 601.A O no hydrogen 2.911 N/A ALA 610.A N ASP 608.A OD1 no hydrogen 2.977 N/A ALA 612.A N ASP 608.A O no hydrogen 2.901 N/A ARG 613.A N VAL 609.A O no hydrogen 2.910 N/A LYS 614.A N ALA 610.A O no hydrogen 2.898 N/A ILE 615.A N ALA 612.A O no hydrogen 3.336 N/A ASP 621.A N GLN 650.A OE1 no hydrogen 2.416 N/A GLY 622.A N GLY 619.A O no hydrogen 3.458 N/A THR 623.A N PRO 620.A O no hydrogen 3.315 N/A GLY 624.A N PRO 620.A O no hydrogen 3.268 N/A ASN 626.A ND2 MET 663.A O no hydrogen 3.546 N/A ILE 627.A N VAL 666.A O no hydrogen 2.928 N/A THR 629.A OG1 GLU 611.A O no hydrogen 2.965 N/A ILE 631.A N VAL 670.A O no hydrogen 2.966 N/A THR 632.A N VAL 670.A O no hydrogen 3.341 N/A THR 632.A OG1 LYS 633.A O no hydrogen 3.517 N/A GLU 640.A N GLU 640.A OE1 no hydrogen 2.636 N/A ILE 641.A N TYR 637.A O no hydrogen 2.938 N/A ILE 641.A N LEU 638.A O no hydrogen 3.245 N/A VAL 645.A N ILE 641.A O no hydrogen 2.942 N/A VAL 646.A N LYS 642.A O no hydrogen 2.882 N/A ALA 647.A N ASP 643.A O no hydrogen 2.931 N/A GLY 648.A N SER 644.A O no hydrogen 2.919 N/A PHE 649.A N VAL 645.A O no hydrogen 2.889 N/A GLN 650.A N VAL 646.A O no hydrogen 2.895 N/A TRP 651.A N ALA 647.A O no hydrogen 2.950 N/A ALA 652.A N GLY 648.A O no hydrogen 2.904 N/A THR 653.A N PHE 649.A O no hydrogen 2.910 N/A THR 653.A OG1 PHE 649.A O no hydrogen 2.778 N/A THR 653.A OG1 GLN 650.A O no hydrogen 3.111 N/A LYS 654.A N GLN 650.A O no hydrogen 2.908 N/A GLU 655.A N TRP 651.A O no hydrogen 2.920 N/A CYS 659.A N GLU 547.A OE2 no hydrogen 2.918 N/A MET 663.A N THR 653.A O no hydrogen 3.052 N/A ARG 664.A N GLU 547.A O no hydrogen 2.705 N/A ARG 664.A NH2 GLU 581.A OE2 no hydrogen 2.635 N/A GLY 665.A N PRO 625.A O no hydrogen 2.985 N/A ARG 667.A N ARG 573.A O no hydrogen 2.923 N/A PHE 668.A N ILE 627.A O no hydrogen 2.817 N/A ASP 669.A N LYS 571.A O no hydrogen 2.878 N/A VAL 670.A N THR 629.A O no hydrogen 2.889 N/A ASP 672.A N TYR 569.A O no hydrogen 2.943 N/A THR 674.A N ARG 567.A O no hydrogen 2.880 N/A HIS 676.A N ASN 566.A OD1 no hydrogen 2.432 N/A GLN 685.A N GLY 682.A O no hydrogen 3.375 N/A ILE 686.A N GLY 683.A O no hydrogen 3.204 N/A ILE 687.A N GLY 683.A O no hydrogen 2.894 N/A THR 689.A OG1 GLN 685.A O no hydrogen 2.728 N/A ALA 690.A N ILE 686.A O no hydrogen 2.545 N/A ARG 691.A N ILE 687.A O no hydrogen 2.903 N/A ARG 692.A N PRO 688.A O no hydrogen 2.905 N/A ARG 692.A NH1 ASN 818.A O no hydrogen 2.976 N/A ARG 692.A NH2 LYS 560.A O no hydrogen 3.161 N/A ARG 692.A NH2 ASP 821.A OD2 no hydrogen 2.732 N/A CYS 693.A N THR 689.A O no hydrogen 2.886 N/A CYS 693.A SG CYS 557.A O no hydrogen 4.037 N/A LEU 694.A N ALA 690.A O no hydrogen 2.909 N/A TYR 695.A N ARG 691.A O no hydrogen 2.922 N/A TYR 695.A OH GLU 655.A O no hydrogen 2.264 N/A ALA 696.A N ARG 692.A O no hydrogen 2.901 N/A SER 697.A N CYS 693.A O no hydrogen 2.891 N/A SER 697.A OG SER 553.A OG no hydrogen 3.384 N/A VAL 698.A N LEU 694.A O no hydrogen 2.929 N/A LEU 699.A N TYR 695.A O no hydrogen 2.916 N/A THR 700.A N ALA 696.A O no hydrogen 2.901 N/A THR 700.A OG1 ALA 696.A O no hydrogen 2.856 N/A ALA 701.A N SER 697.A O no hydrogen 2.915 N/A GLN 702.A N THR 700.A O no hydrogen 2.916 N/A ARG 704.A N THR 548.A O no hydrogen 2.894 N/A ARG 704.A NH1 PRO 703.A O no hydrogen 2.901 N/A MET 706.A N ARG 546.A O no hydrogen 2.849 N/A GLU 707.A N GLN 783.A O no hydrogen 2.727 N/A ILE 709.A N HIS 781.A O no hydrogen 2.751 N/A TYR 710.A N LEU 753.A O no hydrogen 2.880 N/A LEU 711.A N VAL 778.A O no hydrogen 2.841 N/A VAL 712.A N ALA 751.A O no hydrogen 2.888 N/A GLU 713.A N GLN 776.A O no hydrogen 2.948 N/A ILE 714.A N VAL 749.A O no hydrogen 2.879 N/A GLN 715.A N PHE 774.A O no hydrogen 2.947 N/A CYS 716.A N PHE 747.A O no hydrogen 2.906 N/A CYS 716.A SG PRO 717.A O no hydrogen 3.220 N/A CYS 716.A SG VAL 720.A O no hydrogen 3.127 N/A CYS 716.A SG GLN 772.A O no hydrogen 3.850 N/A ILE 724.A N VAL 721.A O no hydrogen 3.155 N/A GLY 726.A N GLY 722.A O no hydrogen 2.922 N/A VAL 727.A N GLY 723.A O no hydrogen 2.917 N/A LEU 728.A N ILE 724.A O no hydrogen 2.887 N/A ASN 729.A N TYR 725.A O no hydrogen 2.896 N/A ARG 730.A N GLY 726.A O no hydrogen 2.948 N/A LYS 731.A N VAL 727.A O no hydrogen 2.881 N/A LYS 731.A NZ ASP 764.A OD2 no hydrogen 2.889 N/A ARG 732.A N ASN 729.A O no hydrogen 3.290 N/A GLY 733.A N LEU 728.A O no hydrogen 2.716 N/A HIS 734.A N TYR 752.A O no hydrogen 3.245 N/A PHE 736.A N LYS 750.A O no hydrogen 3.504 N/A GLN 740.A NE2 GLU 718.A OE1 no hydrogen 3.284 N/A THR 744.A N VAL 741.A O no hydrogen 3.266 N/A THR 744.A OG1 VAL 741.A O no hydrogen 2.710 N/A THR 744.A OG1 MET 746.A O no hydrogen 2.739 N/A PHE 747.A N CYS 716.A O no hydrogen 2.891 N/A VAL 749.A N ILE 714.A O no hydrogen 2.928 N/A LYS 750.A N GLU 737.A O no hydrogen 3.039 N/A ALA 751.A N VAL 712.A O no hydrogen 2.901 N/A TYR 752.A N HIS 734.A O no hydrogen 2.721 N/A LEU 753.A N TYR 710.A O no hydrogen 2.889 N/A SER 758.A N VAL 755.A O no hydrogen 3.117 N/A SER 758.A OG PRO 754.A O no hydrogen 2.314 N/A PHE 761.A N SER 758.A O no hydrogen 3.244 N/A ASP 764.A N GLY 760.A O no hydrogen 2.944 N/A LEU 765.A N PHE 761.A O no hydrogen 2.866 N/A ARG 766.A N THR 762.A O no hydrogen 2.889 N/A SER 767.A N ALA 763.A O no hydrogen 2.908 N/A SER 767.A OG ALA 763.A O no hydrogen 3.070 N/A SER 767.A OG ASP 764.A O no hydrogen 2.647 N/A ASN 768.A N ASP 764.A O no hydrogen 2.927 N/A ASN 768.A ND2 ASP 764.A O no hydrogen 2.395 N/A THR 769.A N LEU 765.A O no hydrogen 2.891 N/A THR 769.A OG1 GLN 772.A O no hydrogen 3.306 N/A GLY 771.A N ARG 766.A O no hydrogen 2.863 N/A GLN 772.A NE2 GLN 719.A OE1 no hydrogen 3.480 N/A PHE 774.A N GLN 715.A O no hydrogen 2.949 N/A GLN 776.A N GLU 713.A O no hydrogen 2.868 N/A CYS 777.A SG VAL 470.A O no hydrogen 3.954 N/A VAL 778.A N LEU 711.A O no hydrogen 2.935 N/A ASP 780.A N ILE 709.A O no hydrogen 2.958 N/A HIS 781.A N ILE 709.A O no hydrogen 3.448 N/A GLN 783.A N GLU 707.A O no hydrogen 2.995 N/A GLN 783.A NE2 GLU 707.A OE1 no hydrogen 3.124 N/A LEU 785.A N LEU 705.A O no hydrogen 2.933 N/A ASP 788.A N SER 794.A OG no hydrogen 3.261 N/A ASP 791.A N ASP 788.A O no hydrogen 3.160 N/A SER 794.A N ASP 791.A O no hydrogen 2.975 N/A SER 797.A OG ASP 791.A O no hydrogen 2.646 N/A SER 797.A OG SER 794.A O no hydrogen 2.352 N/A GLN 798.A N SER 794.A O no hydrogen 2.962 N/A VAL 799.A N ARG 795.A O no hydrogen 2.886 N/A VAL 800.A N PRO 796.A O no hydrogen 2.897 N/A ALA 801.A N SER 797.A O no hydrogen 2.963 N/A GLU 802.A N GLN 798.A O no hydrogen 2.899 N/A THR 803.A N VAL 799.A O no hydrogen 2.896 N/A THR 803.A OG1 VAL 799.A O no hydrogen 3.170 N/A THR 803.A OG1 VAL 800.A O no hydrogen 2.708 N/A ARG 804.A N VAL 800.A O no hydrogen 2.912 N/A ARG 804.A NH1 LYS 810.A O no hydrogen 3.380 N/A LYS 805.A N ALA 801.A O no hydrogen 2.935 N/A ARG 806.A N GLU 802.A O no hydrogen 2.886 N/A ARG 806.A NE GLU 802.A OE2 no hydrogen 2.754 N/A LYS 807.A N THR 803.A O no hydrogen 2.873 N/A LYS 807.A NZ GLU 660.A OE1 no hydrogen 3.455 N/A GLY 808.A N ARG 804.A O no hydrogen 2.929 N/A LEU 809.A N ARG 804.A O no hydrogen 3.277 N/A PHE 819.A N LEU 816.A O no hydrogen 3.280 N/A LEU 820.A N LEU 816.A O no hydrogen 2.886 N/A ASP 821.A N LEU 558.A O no hydrogen 3.064 N/A LYS 822.A N LEU 820.A O no hydrogen 3.155 N/A