Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ity_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N GLU 630.A OE2 no hydrogen 3.208 N/A GLU 7.A N GLU 7.A OE1 no hydrogen 2.417 N/A LYS 9.A N VAL 6.A O no hydrogen 3.039 N/A ARG 11.A N GLU 8.A O no hydrogen 2.901 N/A LEU 12.A N LYS 9.A O no hydrogen 2.930 N/A LEU 13.A N TRP 10.A O no hydrogen 2.912 N/A PHE 16.A N LEU 12.A O no hydrogen 3.002 N/A LEU 17.A N LEU 13.A O no hydrogen 2.964 N/A LYS 18.A N PRO 14.A O no hydrogen 2.941 N/A LYS 18.A N ALA 15.A O no hydrogen 2.922 N/A VAL 19.A N PHE 16.A O no hydrogen 2.930 N/A LYS 20.A N PHE 16.A O no hydrogen 2.909 N/A GLN 25.A NE2 GLY 21.A O no hydrogen 2.326 N/A ILE 27.A N VAL 23.A O no hydrogen 3.213 N/A ASP 28.A N LYS 24.A O no hydrogen 2.882 N/A SER 29.A N GLN 25.A O no hydrogen 2.942 N/A PHE 30.A N HIS 26.A O no hydrogen 2.896 N/A ASN 31.A N ILE 27.A O no hydrogen 2.910 N/A TYR 32.A N ASP 28.A O no hydrogen 2.889 N/A PHE 33.A N SER 29.A O no hydrogen 2.905 N/A ILE 34.A N PHE 30.A O no hydrogen 2.940 N/A ASN 35.A N TYR 32.A O no hydrogen 3.381 N/A VAL 36.A N TYR 32.A O no hydrogen 2.891 N/A VAL 36.A N PHE 33.A O no hydrogen 3.204 N/A GLU 37.A N PHE 33.A O no hydrogen 2.902 N/A ILE 38.A N PHE 33.A O no hydrogen 3.253 N/A LYS 39.A NZ ASN 35.A O no hydrogen 2.870 N/A LYS 40.A N VAL 36.A O no hydrogen 2.930 N/A ILE 41.A N GLU 37.A O no hydrogen 2.869 N/A MET 42.A N ILE 38.A O no hydrogen 2.917 N/A LYS 43.A N LYS 39.A O no hydrogen 2.883 N/A ALA 44.A N LYS 40.A O no hydrogen 2.914 N/A ASN 45.A N ILE 41.A O no hydrogen 3.282 N/A VAL 48.A N LEU 58.A O no hydrogen 3.005 N/A LEU 58.A N VAL 48.A O no hydrogen 2.940 N/A LYS 59.A N GLU 101.A O no hydrogen 2.935 N/A TYR 60.A N GLU 46.A O no hydrogen 2.696 N/A TYR 60.A OH ASN 364.A OD1 no hydrogen 2.461 N/A LEU 61.A N ASP 99.A O no hydrogen 2.957 N/A ASN 62.A N ASP 99.A OD1 no hydrogen 2.255 N/A ILE 63.A N ASN 62.A OD1 no hydrogen 2.445 N/A TYR 64.A N THR 97.A O no hydrogen 2.865 N/A ASP 69.A N SER 93.A O no hydrogen 2.984 N/A VAL 70.A N ARG 78.A O no hydrogen 2.978 N/A VAL 76.A N SER 73.A O no hydrogen 3.027 N/A THR 77.A OG1 VAL 70.A O no hydrogen 3.400 N/A ARG 78.A N VAL 70.A O no hydrogen 3.128 N/A ARG 78.A NH1 GLU 84.A OE2 no hydrogen 3.386 N/A ARG 78.A NH2 GLU 84.A OE2 no hydrogen 3.293 N/A GLU 84.A N SER 81.A OG no hydrogen 3.353 N/A CYS 85.A N SER 81.A O no hydrogen 3.266 N/A ARG 86.A N PRO 82.A O no hydrogen 2.912 N/A ARG 86.A NE GLU 158.A OE2 no hydrogen 2.729 N/A ARG 86.A NH1 GLU 143.A OE1 no hydrogen 2.979 N/A ARG 86.A NH2 GLU 143.A OE1 no hydrogen 3.232 N/A ARG 86.A NH2 GLU 143.A OE2 no hydrogen 2.473 N/A ARG 86.A NH2 TYR 151.A OH no hydrogen 3.040 N/A LEU 87.A N HIS 83.A O no hydrogen 2.919 N/A ARG 88.A N GLU 84.A O no hydrogen 3.025 N/A ARG 88.A NH1 GLU 84.A OE2 no hydrogen 3.108 N/A ARG 88.A NH2 SER 846.A O no hydrogen 2.690 N/A MET 90.A N CYS 85.A O no hydrogen 3.109 N/A TYR 92.A N ILE 153.A O no hydrogen 2.955 N/A SER 93.A OG ALA 94.A O no hydrogen 3.300 N/A SER 93.A OG MET 119.A O no hydrogen 2.601 N/A ALA 94.A N MET 119.A O no hydrogen 2.891 N/A ILE 96.A N GLY 117.A O no hydrogen 2.878 N/A THR 97.A N TYR 64.A O no hydrogen 2.909 N/A THR 97.A OG1 TYR 64.A O no hydrogen 3.480 N/A VAL 98.A N LEU 114.A O no hydrogen 3.023 N/A ASP 99.A N ASN 62.A O no hydrogen 2.948 N/A ILE 100.A N ARG 111.A O no hydrogen 3.196 N/A GLU 101.A N LYS 59.A O no hydrogen 3.060 N/A TYR 102.A N ILE 109.A O no hydrogen 2.910 N/A ARG 104.A NH1 ASP 384.A OD1 no hydrogen 3.057 N/A ARG 104.A NH2 TYR 102.A OH no hydrogen 3.536 N/A GLN 107.A NE2 ARG 108.A O no hydrogen 2.505 N/A ILE 109.A N TYR 102.A O no hydrogen 2.874 N/A ARG 111.A N ILE 100.A O no hydrogen 2.842 N/A ARG 111.A NH1 ALA 113.A O no hydrogen 3.498 N/A LEU 114.A N VAL 98.A O no hydrogen 2.888 N/A ILE 116.A N ILE 96.A O no hydrogen 2.918 N/A ARG 118.A N THR 395.A OG1 no hydrogen 2.364 N/A ARG 118.A NH2 SER 93.A O no hydrogen 3.426 N/A MET 119.A N ALA 94.A O no hydrogen 2.884 N/A ILE 121.A N TYR 92.A O no hydrogen 2.982 N/A LEU 123.A N TYR 151.A O no hydrogen 3.360 N/A ARG 124.A NE ASP 147.A O no hydrogen 2.714 N/A ARG 124.A NH2 ASP 147.A O no hydrogen 3.329 N/A SER 125.A N MET 122.A O no hydrogen 3.307 N/A SER 125.A OG MET 122.A O no hydrogen 2.888 N/A SER 126.A N ASN 31.A OD1 no hydrogen 2.630 N/A SER 126.A OG ASN 127.A OD1 no hydrogen 2.554 N/A ASN 127.A ND2 GLY 66.A O no hydrogen 2.327 N/A CYS 128.A SG TYR 92.A OH no hydrogen 3.730 N/A VAL 129.A N TYR 92.A OH no hydrogen 3.224 N/A THR 131.A N CYS 128.A O no hydrogen 3.189 N/A LYS 133.A NZ VAL 129.A O no hydrogen 3.175 N/A THR 134.A N GLU 137.A OE1 no hydrogen 2.621 N/A THR 134.A OG1 GLU 137.A OE1 no hydrogen 3.231 N/A GLU 137.A N THR 134.A OG1 no hydrogen 3.131 N/A PHE 138.A N THR 134.A O no hydrogen 2.901 N/A ALA 139.A N PRO 135.A O no hydrogen 2.887 N/A LYS 140.A N ALA 136.A O no hydrogen 2.921 N/A LEU 141.A N GLU 137.A O no hydrogen 2.903 N/A ASN 142.A N ALA 139.A O no hydrogen 3.035 N/A GLU 143.A N PHE 138.A O no hydrogen 2.950 N/A ASP 147.A N CYS 144.A O no hydrogen 3.076 N/A GLY 149.A N ASP 147.A OD1 no hydrogen 3.198 N/A GLY 150.A N LEU 123.A O no hydrogen 3.340 N/A TYR 151.A OH ASP 147.A OD2 no hydrogen 2.759 N/A PHE 152.A N LYS 159.A O no hydrogen 2.906 N/A VAL 154.A N VAL 157.A O no hydrogen 2.933 N/A GLY 156.A N MET 90.A O no hydrogen 3.266 N/A VAL 157.A N VAL 154.A O no hydrogen 2.901 N/A LYS 159.A N PHE 152.A O no hydrogen 2.892 N/A LYS 159.A NZ SER 403.A O no hydrogen 2.634 N/A VAL 160.A N GLN 421.A O no hydrogen 2.899 N/A LEU 162.A N VAL 419.A O no hydrogen 3.143 N/A GLN 164.A N GLU 346.A O no hydrogen 2.959 N/A GLN 164.A NE2 LEU 162.A O no hydrogen 3.644 N/A GLU 165.A N SER 439.A O no hydrogen 3.250 N/A GLN 166.A N ARG 344.A O no hydrogen 2.953 N/A SER 168.A N ASN 342.A O no hydrogen 2.647 N/A SER 168.A OG LYS 169.A O no hydrogen 3.281 N/A ASN 170.A N THR 187.A O no hydrogen 3.366 N/A ASN 170.A ND2 SER 189.A O no hydrogen 3.365 N/A ILE 173.A N SER 185.A O no hydrogen 2.947 N/A GLU 175.A N GLY 183.A O no hydrogen 2.913 N/A ASP 177.A N ALA 181.A O no hydrogen 2.855 N/A GLY 180.A N ASP 177.A O no hydrogen 3.119 N/A GLY 183.A N GLU 175.A O no hydrogen 2.880 N/A ALA 184.A N MET 199.A O no hydrogen 2.936 N/A SER 185.A N ILE 173.A O no hydrogen 2.881 N/A SER 185.A OG ALA 184.A O no hydrogen 2.667 N/A SER 185.A OG ASN 198.A OD1 no hydrogen 2.933 N/A VAL 186.A N THR 197.A O no hydrogen 2.971 N/A SER 188.A OG THR 302.A OG1 no hydrogen 2.328 N/A SER 188.A OG HIS 303.A ND1 no hydrogen 3.075 N/A SER 189.A N ASN 170.A OD1 no hydrogen 3.197 N/A THR 190.A N LYS 193.A O no hydrogen 2.488 N/A THR 190.A OG1 LYS 193.A O no hydrogen 2.999 N/A LYS 193.A N THR 190.A OG1 no hydrogen 3.069 N/A LYS 194.A NZ PHE 412.A O no hydrogen 3.469 N/A SER 195.A N SER 188.A O no hydrogen 2.925 N/A SER 195.A OG THR 299.A O no hydrogen 3.189 N/A THR 197.A N VAL 186.A O no hydrogen 2.905 N/A THR 197.A OG1 ARG 209.A O no hydrogen 3.142 N/A ASN 198.A N ARG 209.A O no hydrogen 2.945 N/A MET 199.A N ALA 184.A O no hydrogen 2.848 N/A ALA 200.A N TYR 207.A O no hydrogen 2.907 N/A LYS 202.A NZ ASP 216.A OD2 no hydrogen 2.623 N/A GLY 204.A N VAL 201.A O no hydrogen 2.875 N/A ARG 205.A NE PRO 250.A O no hydrogen 3.662 N/A ARG 205.A NH1 GLN 203.A OE1 no hydrogen 3.429 N/A TYR 207.A N ALA 200.A O no hydrogen 2.902 N/A LEU 208.A N ILE 217.A O no hydrogen 2.849 N/A ARG 209.A N ASN 198.A O no hydrogen 2.872 N/A THR 212.A N HIS 210.A ND1 no hydrogen 3.162 N/A LEU 213.A N HIS 210.A O no hydrogen 3.181 N/A SER 214.A N LYS 273.A O no hydrogen 2.975 N/A SER 214.A OG LYS 273.A O no hydrogen 2.947 N/A ILE 217.A N LEU 208.A O no hydrogen 3.160 N/A ILE 219.A N PHE 206.A O no hydrogen 3.182 N/A ILE 222.A N PRO 218.A O no hydrogen 3.420 N/A PHE 223.A N ILE 219.A O no hydrogen 2.896 N/A LYS 224.A N VAL 220.A O no hydrogen 2.900 N/A LYS 224.A NZ ASP 231.A OD1 no hydrogen 2.887 N/A ALA 225.A N ILE 221.A O no hydrogen 2.913 N/A MET 226.A N PHE 223.A O no hydrogen 2.850 N/A SER 230.A N GLU 233.A OE1 no hydrogen 3.266 N/A GLN 232.A NE2 GLN 236.A OE1 no hydrogen 2.994 N/A VAL 235.A N ASP 231.A O no hydrogen 2.937 N/A GLN 236.A N GLN 232.A O no hydrogen 2.897 N/A MET 237.A N ILE 234.A O no hydrogen 3.055 N/A ILE 238.A N ILE 234.A O no hydrogen 2.890 N/A GLY 239.A N VAL 235.A O no hydrogen 3.356 N/A THR 240.A N SER 515.A OG no hydrogen 2.814 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 2.649 N/A VAL 244.A N GLU 241.A O no hydrogen 2.832 N/A MET 245.A N GLU 241.A O no hydrogen 3.207 N/A ALA 246.A N GLU 242.A O no hydrogen 2.929 N/A ALA 247.A N HIS 243.A O no hydrogen 2.883 N/A PHE 248.A N VAL 244.A O no hydrogen 2.904 N/A GLY 249.A N MET 245.A O no hydrogen 2.909 N/A SER 251.A OG PHE 248.A O no hydrogen 2.377 N/A LEU 252.A N PHE 248.A O no hydrogen 3.372 N/A GLU 253.A N GLY 249.A O no hydrogen 2.926 N/A GLU 254.A N PRO 250.A O no hydrogen 2.883 N/A CYS 255.A N SER 251.A O no hydrogen 2.920 N/A CYS 255.A SG LEU 252.A O no hydrogen 2.950 N/A GLN 256.A N LEU 252.A O no hydrogen 2.921 N/A LYS 257.A N GLU 253.A O no hydrogen 2.897 N/A ALA 258.A N GLU 254.A O no hydrogen 3.476 N/A PHE 261.A N GLN 265.A OE1 no hydrogen 2.510 N/A THR 262.A N GLN 265.A OE1 no hydrogen 3.027 N/A GLN 263.A N GLU 229.A OE2 no hydrogen 2.910 N/A GLN 263.A NE2 ALA 225.A O no hydrogen 2.348 N/A ALA 266.A N THR 262.A O no hydrogen 3.132 N/A LEU 267.A N GLN 263.A O no hydrogen 2.904 N/A LYS 268.A N MET 264.A O no hydrogen 2.890 N/A TYR 269.A N GLN 265.A O no hydrogen 2.912 N/A ILE 270.A N ALA 266.A O no hydrogen 2.898 N/A GLY 271.A N LEU 267.A O no hydrogen 2.881 N/A ASN 272.A N LYS 268.A O no hydrogen 2.918 N/A LYS 273.A N TYR 269.A O no hydrogen 2.948 N/A VAL 274.A N GLY 271.A O no hydrogen 3.259 N/A GLN 277.A N ARG 275.A O no hydrogen 2.924 N/A LYS 286.A NZ THR 287.A OG1 no hydrogen 2.569 N/A GLU 290.A N THR 287.A O no hydrogen 2.850 N/A GLU 291.A N THR 287.A O no hydrogen 2.802 N/A GLU 294.A N GLU 290.A O no hydrogen 2.911 N/A LEU 295.A N GLU 291.A O no hydrogen 2.858 N/A LEU 296.A N ALA 292.A O no hydrogen 2.934 N/A ALA 297.A N ARG 293.A O no hydrogen 2.884 N/A SER 298.A N GLU 294.A O no hydrogen 2.944 N/A SER 298.A OG GLU 294.A O no hydrogen 3.321 N/A THR 299.A OG1 LEU 295.A O no hydrogen 2.579 N/A ILE 300.A N LEU 295.A O no hydrogen 3.067 N/A THR 302.A OG1 SER 188.A O no hydrogen 3.385 N/A THR 302.A OG1 SER 188.A OG no hydrogen 2.328 N/A HIS 303.A N SER 188.A OG no hydrogen 2.484 N/A HIS 303.A ND1 SER 188.A OG no hydrogen 3.075 N/A VAL 304.A N LEU 301.A O no hydrogen 3.174 N/A ARG 312.A NH2 LEU 509.A O no hydrogen 2.880 N/A LYS 314.A NZ ALA 297.A O no hydrogen 3.279 N/A LYS 314.A NZ ILE 300.A O no hydrogen 2.520 N/A LYS 314.A NZ LEU 301.A O no hydrogen 2.581 N/A LYS 314.A NZ VAL 304.A O no hydrogen 3.350 N/A CYS 315.A N PHE 311.A O no hydrogen 2.779 N/A CYS 315.A SG PHE 311.A O no hydrogen 3.103 N/A ILE 316.A N ARG 312.A O no hydrogen 2.919 N/A TYR 317.A N ALA 313.A O no hydrogen 2.926 N/A THR 318.A N LYS 314.A O no hydrogen 2.934 N/A ALA 319.A N CYS 315.A O no hydrogen 2.893 N/A VAL 320.A N ILE 316.A O no hydrogen 2.909 N/A MET 321.A N TYR 317.A O no hydrogen 2.941 N/A VAL 322.A N THR 318.A O no hydrogen 2.905 N/A ARG 323.A N ALA 319.A O no hydrogen 2.911 N/A ARG 323.A NH1 ILE 238.A O no hydrogen 3.449 N/A ARG 323.A NH1 GLU 241.A OE1 no hydrogen 2.744 N/A ARG 323.A NH1 GLU 241.A OE2 no hydrogen 3.556 N/A ARG 323.A NH2 GLU 241.A OE2 no hydrogen 2.823 N/A ARG 324.A N VAL 320.A O no hydrogen 2.898 N/A VAL 325.A N MET 321.A O no hydrogen 2.948 N/A ILE 326.A N VAL 322.A O no hydrogen 2.910 N/A LEU 327.A N ARG 323.A O no hydrogen 2.906 N/A ALA 328.A N ARG 324.A O no hydrogen 2.904 N/A GLN 329.A N VAL 325.A O no hydrogen 3.054 N/A GLN 329.A N ILE 326.A O no hydrogen 3.117 N/A GLY 330.A N LEU 327.A O no hydrogen 3.185 N/A LYS 333.A N ASP 331.A O no hydrogen 2.559 N/A ARG 337.A NE GLU 175.A OE1 no hydrogen 2.837 N/A ARG 337.A NH2 GLU 175.A OE1 no hydrogen 2.698 N/A ARG 337.A NH2 GLU 175.A OE2 no hydrogen 2.843 N/A TYR 339.A N ASP 336.A O no hydrogen 3.308 N/A TYR 339.A OH ASN 619.A OD1 no hydrogen 3.172 N/A TYR 340.A N SER 457.A OG no hydrogen 2.895 N/A TYR 340.A OH GLU 165.A OE2 no hydrogen 3.355 N/A ASN 342.A N TYR 339.A O no hydrogen 3.027 N/A LYS 343.A N TYR 340.A O no hydrogen 3.062 N/A LYS 343.A NZ GLU 165.A OE2 no hydrogen 3.005 N/A ARG 344.A N GLN 166.A O no hydrogen 2.881 N/A ARG 344.A NE ASP 571.A OD1 no hydrogen 3.495 N/A ARG 344.A NE ASP 571.A OD2 no hydrogen 3.009 N/A ARG 344.A NH1 GLY 341.A O no hydrogen 3.320 N/A ARG 344.A NH1 LYS 343.A O no hydrogen 2.445 N/A LEU 345.A N GLY 573.A O no hydrogen 2.819 N/A GLU 346.A N GLN 164.A O no hydrogen 2.840 N/A LEU 347.A N GLN 350.A OE1 no hydrogen 2.625 N/A GLY 349.A N SER 29.A OG no hydrogen 2.749 N/A LEU 352.A N ALA 348.A O no hydrogen 2.892 N/A SER 353.A N GLY 349.A O no hydrogen 2.867 N/A SER 353.A OG GLU 37.A OE1 no hydrogen 2.962 N/A LEU 354.A N GLN 350.A O no hydrogen 2.954 N/A LEU 355.A N LEU 351.A O no hydrogen 2.943 N/A PHE 356.A N LEU 352.A O no hydrogen 2.848 N/A GLU 357.A N SER 353.A O no hydrogen 2.897 N/A ASP 358.A N LEU 354.A O no hydrogen 2.978 N/A LEU 359.A N LEU 355.A O no hydrogen 2.916 N/A PHE 360.A N PHE 356.A O no hydrogen 2.850 N/A LYS 361.A N GLU 357.A O no hydrogen 2.917 N/A LYS 362.A N ASP 358.A O no hydrogen 2.923 N/A PHE 363.A N LEU 359.A O no hydrogen 2.876 N/A ASN 364.A N PHE 360.A O no hydrogen 2.912 N/A SER 365.A N LYS 361.A O no hydrogen 2.903 N/A SER 365.A OG LYS 361.A O no hydrogen 3.304 N/A SER 365.A OG LYS 362.A O no hydrogen 2.556 N/A GLU 366.A N LYS 362.A O no hydrogen 2.881 N/A MET 367.A N PHE 363.A O no hydrogen 2.918 N/A LYS 368.A N ASN 364.A O no hydrogen 2.901 N/A LYS 369.A N SER 365.A O no hydrogen 2.894 N/A LYS 369.A NZ GLU 366.A OE1 no hydrogen 3.392 N/A LYS 369.A NZ GLU 366.A OE2 no hydrogen 2.700 N/A ILE 370.A N GLU 366.A O no hydrogen 2.917 N/A ALA 371.A N MET 367.A O no hydrogen 2.911 N/A ASP 372.A N LYS 368.A O no hydrogen 2.884 N/A GLN 373.A N LYS 369.A O no hydrogen 2.917 N/A VAL 374.A N ILE 370.A O no hydrogen 2.959 N/A VAL 374.A N ALA 371.A O no hydrogen 2.943 N/A ILE 375.A N ALA 371.A O no hydrogen 2.586 N/A LYS 377.A NZ GLN 378.A OE1 no hydrogen 3.030 N/A GLN 382.A NE2 ALA 380.A O no hydrogen 2.834 N/A LYS 387.A N ASP 384.A OD2 no hydrogen 3.315 N/A HIS 388.A N VAL 385.A O no hydrogen 3.044 N/A MET 389.A N VAL 386.A O no hydrogen 3.488 N/A ARG 390.A NH1 ASP 392.A OD1 no hydrogen 2.478 N/A ARG 390.A NH2 GLN 393.A OE1 no hydrogen 2.984 N/A GLN 391.A NE2 PRO 115.A O no hydrogen 2.300 N/A THR 395.A OG1 ARG 118.A O no hydrogen 3.556 N/A ASN 396.A N ASP 392.A O no hydrogen 2.870 N/A GLY 397.A N GLN 393.A O no hydrogen 2.929 N/A MET 398.A N ILE 394.A O no hydrogen 2.946 N/A VAL 399.A N THR 395.A O no hydrogen 2.914 N/A ASN 400.A N ASN 396.A O no hydrogen 2.899 N/A ALA 401.A N GLY 397.A O no hydrogen 2.913 N/A ILE 402.A N MET 398.A O no hydrogen 2.925 N/A SER 403.A N VAL 399.A O no hydrogen 2.900 N/A SER 403.A OG VAL 399.A O no hydrogen 2.989 N/A SER 403.A OG ASN 400.A O no hydrogen 3.206 N/A THR 404.A N ASN 400.A O no hydrogen 2.912 N/A THR 404.A OG1 ASN 400.A O no hydrogen 2.800 N/A THR 404.A OG1 ASN 406.A OD1 no hydrogen 2.265 N/A GLY 405.A N ALA 401.A O no hydrogen 3.204 N/A TRP 407.A N ARG 416.A O no hydrogen 2.900 N/A TRP 407.A NE1 ALA 401.A O no hydrogen 3.032 N/A LEU 409.A N MET 414.A O no hydrogen 2.958 N/A LYS 413.A N LYS 410.A O no hydrogen 2.991 N/A LYS 413.A NZ LYS 410.A O no hydrogen 3.229 N/A MET 414.A N LEU 409.A O no hydrogen 2.958 N/A ARG 416.A N TRP 407.A O no hydrogen 2.926 N/A ARG 416.A NH2 GLN 166.A OE1 no hydrogen 3.138 N/A VAL 419.A N GLY 405.A O no hydrogen 2.636 N/A THR 420.A OG1 ILE 402.A O no hydrogen 2.600 N/A GLN 421.A N VAL 160.A O no hydrogen 2.924 N/A LEU 423.A N GLU 158.A O no hydrogen 2.852 N/A ARG 425.A NE GLU 158.A OE1 no hydrogen 3.123 N/A ARG 425.A NH2 ASP 147.A OD1 no hydrogen 3.064 N/A SER 427.A N SER 430.A OG no hydrogen 2.698 N/A TYR 428.A OH ILE 711.A O no hydrogen 2.919 N/A SER 430.A N SER 427.A OG no hydrogen 3.147 N/A SER 430.A OG SER 424.A O no hydrogen 3.480 N/A SER 430.A OG SER 427.A O no hydrogen 2.272 N/A SER 430.A OG SER 427.A OG no hydrogen 3.282 N/A ALA 431.A N SER 427.A O no hydrogen 2.887 N/A LEU 432.A N TYR 428.A O no hydrogen 2.951 N/A GLY 433.A N ILE 429.A O no hydrogen 2.890 N/A MET 434.A N SER 430.A O no hydrogen 2.929 N/A MET 435.A N ALA 431.A O no hydrogen 2.879 N/A THR 436.A N LEU 432.A O no hydrogen 2.985 N/A THR 436.A OG1 GLY 433.A O no hydrogen 3.300 N/A ARG 437.A N MET 434.A O no hydrogen 3.318 N/A ILE 438.A N LYS 477.A O no hydrogen 2.678 N/A SER 439.A N ILE 163.A O no hydrogen 2.946 N/A SER 439.A OG SER 440.A O no hydrogen 3.260 N/A SER 440.A OG LEU 475.A O no hydrogen 3.346 N/A LYS 444.A NZ GLU 471.A O no hydrogen 2.392 N/A VAL 448.A N ARG 446.A O no hydrogen 2.945 N/A ARG 452.A NH2 GLU 471.A O no hydrogen 2.325 N/A SER 453.A N GLY 450.A O no hydrogen 3.055 N/A SER 453.A OG GLY 450.A O no hydrogen 2.231 N/A GLN 455.A N GLN 455.A OE1 no hydrogen 2.339 N/A GLN 455.A NE2 ASP 338.A O no hydrogen 2.765 N/A GLN 458.A N GLN 455.A O no hydrogen 3.341 N/A TRP 459.A N PRO 456.A O no hydrogen 3.030 N/A MET 461.A N GLN 458.A O no hydrogen 3.294 N/A LEU 462.A N GLN 458.A O no hydrogen 3.249 N/A CYS 463.A N ASN 478.A O no hydrogen 3.027 N/A THR 467.A OG1 VAL 476.A O no hydrogen 3.542 N/A CYS 473.A N GLY 470.A O no hydrogen 3.187 N/A GLY 474.A N THR 467.A OG1 no hydrogen 2.769 N/A LEU 475.A N ALA 472.A O no hydrogen 2.805 N/A LYS 477.A N ILE 438.A O no hydrogen 3.036 N/A LYS 477.A NZ GLU 165.A OE1 no hydrogen 2.733 N/A ASN 478.A ND2 ASP 466.A OD2 no hydrogen 2.478 N/A LEU 479.A N THR 436.A O no hydrogen 3.204 N/A ALA 480.A N MET 461.A O no hydrogen 2.638 N/A THR 483.A OG1 CYS 576.A O no hydrogen 3.202 N/A HIS 484.A N CYS 576.A O no hydrogen 2.772 N/A THR 486.A N ARG 574.A O no hydrogen 2.894 N/A THR 486.A OG1 ASP 571.A O no hydrogen 3.367 N/A THR 486.A OG1 ARG 574.A O no hydrogen 3.070 N/A GLU 490.A N GLU 490.A OE2 no hydrogen 2.427 N/A LYS 496.A N GLY 492.A O no hydrogen 2.958 N/A LEU 497.A N PRO 493.A O no hydrogen 2.857 N/A ALA 498.A N ILE 494.A O no hydrogen 2.902 N/A SER 499.A N VAL 495.A O no hydrogen 2.917 N/A SER 499.A OG VAL 495.A O no hydrogen 3.090 N/A SER 499.A OG LYS 496.A O no hydrogen 2.624 N/A ASN 500.A N LYS 496.A O no hydrogen 2.940 N/A LEU 501.A N ALA 498.A O no hydrogen 2.991 N/A GLU 504.A N VAL 531.A O no hydrogen 2.920 N/A LEU 508.A N ASP 505.A O no hydrogen 3.164 N/A LEU 509.A N VAL 506.A O no hydrogen 3.236 N/A LEU 514.A N GLY 511.A O no hydrogen 3.210 N/A SER 515.A N GLU 512.A O no hydrogen 2.930 N/A SER 515.A OG GLU 512.A O no hydrogen 3.561 N/A TYR 516.A N GLU 513.A O no hydrogen 3.334 N/A VAL 519.A N TYR 516.A O no hydrogen 3.413 N/A PHE 520.A N ILE 532.A O no hydrogen 2.906 N/A LEU 521.A N ARG 564.A O no hydrogen 3.193 N/A VAL 522.A N GLY 530.A O no hydrogen 2.945 N/A PHE 523.A N VAL 566.A O no hydrogen 2.736 N/A LEU 524.A N ASN 527.A O no hydrogen 2.614 N/A ASN 525.A N ILE 568.A O no hydrogen 3.180 N/A ASN 525.A ND2 SER 570.A OG no hydrogen 2.613 N/A ASN 527.A N LEU 524.A O no hydrogen 3.034 N/A LEU 529.A N VAL 522.A O no hydrogen 2.858 N/A VAL 531.A N GLU 504.A O no hydrogen 3.423 N/A ILE 532.A N PHE 520.A O no hydrogen 2.891 N/A LYS 537.A N ASP 534.A OD1 no hydrogen 3.288 N/A LEU 538.A N ASP 534.A O no hydrogen 3.440 N/A VAL 539.A N HIS 535.A O no hydrogen 2.899 N/A ASN 540.A N LYS 536.A O no hydrogen 2.904 N/A THR 541.A N LYS 537.A O no hydrogen 2.921 N/A THR 541.A OG1 LYS 537.A O no hydrogen 2.780 N/A PHE 542.A N LEU 538.A O no hydrogen 2.908 N/A ARG 543.A N VAL 539.A O no hydrogen 2.912 N/A ARG 543.A NE GLU 620.A OE2 no hydrogen 2.874 N/A LEU 544.A N ASN 540.A O no hydrogen 2.901 N/A MET 545.A N THR 541.A O no hydrogen 2.906 N/A ARG 546.A N PHE 542.A O no hydrogen 2.908 N/A ARG 546.A NH1 VAL 555.A O no hydrogen 3.293 N/A ARG 546.A NH1 GLU 620.A OE1 no hydrogen 2.430 N/A ARG 546.A NH1 GLU 620.A OE2 no hydrogen 3.027 N/A ARG 546.A NH2 GLU 620.A OE2 no hydrogen 2.834 N/A ARG 547.A N ARG 543.A O no hydrogen 2.908 N/A ARG 547.A NE GLU 614.A OE1 no hydrogen 2.670 N/A ARG 547.A NH2 GLU 614.A OE2 no hydrogen 2.990 N/A ALA 548.A N LEU 544.A O no hydrogen 3.026 N/A GLY 549.A N ARG 546.A O no hydrogen 3.273 N/A GLU 553.A N GLU 553.A OE1 no hydrogen 2.484 N/A VAL 555.A N ASN 552.A O no hydrogen 2.938 N/A SER 556.A N SER 569.A O no hydrogen 2.930 N/A SER 556.A OG SER 569.A O no hydrogen 3.524 N/A SER 556.A OG SER 569.A OG no hydrogen 2.174 N/A SER 556.A OG ASP 617.A OD2 no hydrogen 3.341 N/A SER 558.A N TYR 567.A O no hydrogen 2.897 N/A SER 558.A OG TYR 567.A O no hydrogen 3.514 N/A THR 559.A N ASP 623.A OD2 no hydrogen 2.464 N/A ASN 560.A N CYS 565.A O no hydrogen 2.884 N/A ASP 563.A N ASN 560.A OD1 no hydrogen 2.385 N/A ARG 564.A N LEU 561.A O no hydrogen 3.148 N/A ARG 564.A NH1 PRO 517.A O no hydrogen 2.887 N/A ARG 564.A NH2 LEU 514.A O no hydrogen 2.662 N/A CYS 565.A N ASN 560.A O no hydrogen 2.926 N/A CYS 565.A SG ASP 563.A O no hydrogen 3.136 N/A VAL 566.A N LEU 521.A O no hydrogen 2.650 N/A TYR 567.A N SER 558.A O no hydrogen 2.891 N/A ILE 568.A N PHE 523.A O no hydrogen 2.720 N/A SER 569.A N SER 556.A O no hydrogen 2.878 N/A SER 569.A OG SER 556.A O no hydrogen 3.369 N/A SER 569.A OG SER 556.A OG no hydrogen 2.174 N/A SER 570.A N ASN 525.A OD1 no hydrogen 2.579 N/A SER 570.A OG ASP 491.A OD1 no hydrogen 2.228 N/A ASP 571.A N ASN 525.A OD1 no hydrogen 3.391 N/A GLY 573.A N THR 486.A O no hydrogen 2.718 N/A ARG 574.A N THR 486.A OG1 no hydrogen 2.549 N/A ARG 574.A NE ASP 571.A O no hydrogen 2.654 N/A ARG 574.A NE ASP 571.A OD1 no hydrogen 3.098 N/A ARG 574.A NH1 PHE 554.A O no hydrogen 3.117 N/A ARG 574.A NH1 ASP 617.A OD2 no hydrogen 3.116 N/A ARG 574.A NH2 PHE 554.A O no hydrogen 3.139 N/A ARG 574.A NH2 ASP 571.A O no hydrogen 2.931 N/A CYS 576.A N HIS 484.A O no hydrogen 2.701 N/A CYS 576.A SG LEU 616.A O no hydrogen 3.943 N/A ARG 577.A N LEU 616.A O no hydrogen 2.923 N/A ARG 577.A NE GLU 641.A OE2 no hydrogen 2.821 N/A ARG 577.A NH2 GLU 641.A OE2 no hydrogen 2.494 N/A ARG 577.A NH2 THR 646.A OG1 no hydrogen 2.379 N/A TYR 579.A N GLU 614.A O no hydrogen 2.888 N/A TYR 579.A OH GLU 641.A OE1 no hydrogen 3.304 N/A ILE 580.A N LEU 640.A O no hydrogen 3.014 N/A ILE 581.A N LEU 612.A O no hydrogen 3.052 N/A VAL 582.A N THR 638.A O no hydrogen 2.679 N/A LYS 583.A N LYS 586.A O no hydrogen 3.062 N/A LYS 586.A N LYS 583.A O no hydrogen 3.211 N/A ALA 588.A N ILE 581.A O no hydrogen 2.810 N/A THR 590.A N HIS 593.A ND1 no hydrogen 3.337 N/A LYS 592.A NZ GLU 596.A OE2 no hydrogen 2.876 N/A MET 594.A N THR 590.A O no hydrogen 3.212 N/A GLU 595.A N ASN 591.A O no hydrogen 2.895 N/A GLU 596.A N LYS 592.A O no hydrogen 2.896 N/A LEU 597.A N HIS 593.A O no hydrogen 2.903 N/A ALA 598.A N MET 594.A O no hydrogen 2.887 N/A GLN 599.A N GLU 595.A O no hydrogen 2.911 N/A GLY 600.A N LEU 597.A O no hydrogen 3.221 N/A TYR 601.A N GLU 596.A O no hydrogen 2.887 N/A ARG 602.A NE GLU 596.A OE1 no hydrogen 2.458 N/A ARG 602.A NH1 GLU 610.A OE2 no hydrogen 2.666 N/A ARG 602.A NH2 GLU 596.A OE2 no hydrogen 3.449 N/A ASN 603.A N ASP 606.A OD2 no hydrogen 2.413 N/A ASP 606.A N ASN 603.A OD1 no hydrogen 2.968 N/A PHE 607.A N ASN 603.A O no hydrogen 3.295 N/A LEU 608.A N PHE 604.A O no hydrogen 2.938 N/A HIS 609.A N GLU 605.A O no hydrogen 2.914 N/A GLU 610.A N ASP 606.A O no hydrogen 3.057 N/A LEU 612.A N PHE 607.A O no hydrogen 3.193 N/A VAL 613.A N PHE 607.A O no hydrogen 3.400 N/A GLU 614.A N TYR 579.A O no hydrogen 2.922 N/A LEU 616.A N ARG 577.A O no hydrogen 2.881 N/A VAL 618.A N ASP 617.A OD1 no hydrogen 2.297 N/A ASN 619.A ND2 GLY 341.A O no hydrogen 3.672 N/A GLU 621.A N ASP 617.A O no hydrogen 2.798 N/A ASN 622.A N VAL 618.A O no hydrogen 2.923 N/A ASN 622.A N ASN 619.A O no hydrogen 3.219 N/A ASP 623.A N GLU 620.A O no hydrogen 3.049 N/A CYS 624.A N GLU 620.A O no hydrogen 3.223 N/A CYS 624.A SG GLU 620.A O no hydrogen 3.859 N/A CYS 624.A SG HIS 639.A ND1 no hydrogen 3.527 N/A ASN 625.A ND2 ASP 636.A O no hydrogen 2.988 N/A ALA 627.A N HIS 639.A O no hydrogen 3.068 N/A GLU 630.A N GLU 630.A OE1 no hydrogen 2.771 N/A THR 632.A N TYR 629.A O no hydrogen 3.067 N/A THR 632.A OG1 HIS 631.A ND1 no hydrogen 3.069 N/A ILE 633.A N GLU 630.A O no hydrogen 3.008 N/A LYS 635.A NZ ASP 636.A OD2 no hydrogen 3.074 N/A ASP 636.A N ASN 634.A OD1 no hydrogen 2.476 N/A THR 637.A OG1 ASN 634.A O no hydrogen 2.755 N/A THR 638.A OG1 ASN 625.A O no hydrogen 2.956 N/A THR 638.A OG1 HIS 639.A ND1 no hydrogen 2.321 N/A HIS 639.A N ASN 625.A O no hydrogen 3.221 N/A HIS 639.A ND1 THR 638.A OG1 no hydrogen 2.321 N/A HIS 639.A NE2 GLU 614.A OE2 no hydrogen 2.288 N/A LEU 640.A N ILE 580.A O no hydrogen 2.633 N/A GLU 641.A N ALA 627.A O no hydrogen 2.718 N/A THR 646.A N GLU 643.A O no hydrogen 3.264 N/A THR 646.A OG1 GLU 643.A O no hydrogen 3.042 N/A LEU 647.A N PRO 644.A O no hydrogen 2.905 N/A GLY 653.A N VAL 650.A O no hydrogen 3.020 N/A LEU 654.A N CYS 651.A O no hydrogen 3.291 N/A ILE 655.A N ALA 652.A O no hydrogen 3.108 N/A TYR 657.A N GLY 934.A O no hydrogen 2.909 N/A TYR 657.A OH SER 940.A O no hydrogen 2.700 N/A HIS 660.A N TYR 657.A O no hydrogen 3.107 N/A ASN 661.A N PRO 658.A O no hydrogen 3.261 N/A ASN 661.A ND2 HIS 874.A ND1 no hydrogen 2.858 N/A ARG 665.A N GLN 662.A O no hydrogen 2.891 N/A ASN 666.A N GLN 662.A O no hydrogen 3.414 N/A ASN 666.A ND2 PRO 658.A O no hydrogen 3.279 N/A THR 667.A N SER 663.A O no hydrogen 2.938 N/A THR 667.A OG1 SER 465.A O no hydrogen 2.648 N/A TYR 668.A N PRO 664.A O no hydrogen 2.908 N/A GLN 669.A N ARG 665.A O no hydrogen 2.878 N/A CYS 670.A N ASN 666.A O no hydrogen 2.886 N/A CYS 670.A SG ASN 666.A O no hydrogen 3.702 N/A ALA 671.A N THR 667.A O no hydrogen 2.989 N/A MET 672.A N TYR 668.A O no hydrogen 2.863 N/A GLY 673.A N GLN 669.A O no hydrogen 2.829 N/A LYS 674.A N CYS 670.A O no hydrogen 3.005 N/A LYS 674.A NZ ASP 466.A OD1 no hydrogen 2.812 N/A GLN 675.A N MET 672.A O no hydrogen 2.722 N/A ALA 676.A N GLY 673.A O no hydrogen 3.208 N/A ILE 680.A N GLN 684.A OE1 no hydrogen 2.878 N/A GLY 681.A N GLN 684.A OE1 no hydrogen 3.130 N/A ASN 683.A ND2 ASN 142.A O no hydrogen 3.399 N/A GLN 684.A N GLY 681.A O no hydrogen 3.148 N/A ARG 685.A NH2 GLU 840.A OE2 no hydrogen 2.267 N/A ARG 687.A N ASN 683.A O no hydrogen 2.927 N/A ARG 687.A NH2 ASN 683.A OD1 no hydrogen 3.039 N/A MET 692.A N TYR 755.A O no hydrogen 2.915 N/A LEU 694.A N LEU 753.A O no hydrogen 2.918 N/A ALA 696.A N ARG 751.A O no hydrogen 2.881 N/A GLN 699.A N GLY 719.A O no hydrogen 2.898 N/A MET 702.A N ASN 721.A OD1 no hydrogen 3.406 N/A LYS 704.A N HIS 932.A O no hydrogen 3.320 N/A LYS 704.A NZ GLU 709.A OE2 no hydrogen 3.500 N/A LYS 704.A NZ GLU 714.A OE1 no hydrogen 2.642 N/A THR 705.A OG1 GLY 653.A O no hydrogen 2.869 N/A LYS 706.A N THR 935.A OG1 no hydrogen 3.232 N/A ILE 708.A N THR 705.A O no hydrogen 2.987 N/A LEU 710.A N LYS 706.A O no hydrogen 2.922 N/A ILE 711.A N THR 707.A O no hydrogen 2.923 N/A GLU 712.A N GLU 709.A O no hydrogen 3.174 N/A PHE 713.A N ILE 708.A O no hydrogen 2.773 N/A LYS 715.A N GLU 712.A O no hydrogen 3.044 N/A LEU 716.A N PHE 713.A O no hydrogen 2.946 N/A ALA 718.A N TYR 981.A OH no hydrogen 3.190 N/A GLN 720.A N TYR 982.A O no hydrogen 2.898 N/A GLN 720.A NE2 TYR 697.A O no hydrogen 3.198 N/A ASN 721.A N GLN 699.A OE1 no hydrogen 2.833 N/A ASN 721.A ND2 LYS 700.A O no hydrogen 2.802 N/A ALA 722.A N VAL 980.A O no hydrogen 2.886 N/A THR 723.A N ASP 899.A OD2 no hydrogen 2.977 N/A VAL 724.A N GLY 978.A O no hydrogen 2.842 N/A ALA 725.A N ILE 900.A O no hydrogen 2.794 N/A VAL 726.A N TYR 976.A O no hydrogen 2.915 N/A MET 727.A N MET 902.A O no hydrogen 3.066 N/A SER 728.A OG ASN 903.A OD1 no hydrogen 2.974 N/A TYR 729.A N ASP 733.A OD2 no hydrogen 3.370 N/A SER 730.A OG TYR 729.A O no hydrogen 2.548 N/A TYR 732.A N SER 730.A OG no hydrogen 3.337 N/A LEU 738.A N VAL 879.A O no hydrogen 3.021 N/A LEU 740.A N LEU 882.A O no hydrogen 2.943 N/A ASN 741.A ND2 PRO 898.A O no hydrogen 3.468 N/A LYS 742.A N VAL 884.A O no hydrogen 2.827 N/A ALA 743.A N ASN 741.A OD1 no hydrogen 3.092 N/A SER 744.A OG ASP 899.A OD1 no hydrogen 2.404 N/A LEU 745.A N ASN 741.A O no hydrogen 2.991 N/A ASP 746.A N LYS 742.A O no hydrogen 2.902 N/A ARG 747.A N ALA 743.A O no hydrogen 2.865 N/A ARG 747.A NH2 GLN 886.A OE1 no hydrogen 3.555 N/A GLY 748.A N LEU 745.A O no hydrogen 3.293 N/A PHE 749.A N SER 744.A O no hydrogen 3.048 N/A GLY 750.A N GLN 720.A OE1 no hydrogen 2.771 N/A ARG 751.A N GLY 748.A O no hydrogen 3.131 N/A ARG 751.A NH2 LEU 745.A O no hydrogen 3.266 N/A CYS 752.A N ARG 862.A O no hydrogen 3.255 N/A CYS 752.A SG ARG 862.A O no hydrogen 3.396 N/A LEU 753.A N LEU 694.A O no hydrogen 2.883 N/A VAL 754.A N GLN 860.A O no hydrogen 2.876 N/A TYR 755.A N MET 692.A O no hydrogen 2.877 N/A TYR 755.A OH GLU 840.A OE1 no hydrogen 2.730 N/A LYS 756.A N LEU 858.A O no hydrogen 2.924 N/A ALA 758.A N MET 856.A O no hydrogen 2.944 N/A LYS 759.A NZ ASP 89.A OD2 no hydrogen 3.499 N/A CYS 760.A N ILE 854.A O no hydrogen 2.900 N/A CYS 760.A SG ILE 854.A O no hydrogen 4.048 N/A LEU 762.A N PHE 852.A O no hydrogen 2.905 N/A LYS 763.A N ASP 771.A OD2 no hydrogen 2.757 N/A ARG 764.A NH2 ASP 850.A OD2 no hydrogen 3.042 N/A TYR 765.A N THR 769.A O no hydrogen 2.906 N/A TYR 765.A OH ASP 771.A OD1 no hydrogen 2.990 N/A GLN 768.A NE2 THR 766.A O no hydrogen 3.238 N/A THR 769.A N ASN 767.A O no hydrogen 2.591 N/A ASP 771.A N LYS 763.A O no hydrogen 2.989 N/A LYS 772.A N SER 814.A O no hydrogen 3.132 N/A MET 774.A N ASN 812.A O no hydrogen 3.225 N/A ASP 779.A N LYS 784.A O no hydrogen 2.465 N/A ALA 781.A N ASP 779.A OD1 no hydrogen 3.134 N/A THR 782.A N ASP 779.A OD2 no hydrogen 3.145 N/A THR 782.A OG1 ASP 779.A OD2 no hydrogen 3.063 N/A LYS 784.A NZ THR 782.A O no hydrogen 2.442 N/A ILE 786.A N MET 777.A O no hydrogen 3.121 N/A HIS 789.A N ILE 786.A O no hydrogen 2.917 N/A GLU 790.A N TRP 787.A O no hydrogen 3.189 N/A LEU 792.A N HIS 789.A O no hydrogen 3.410 N/A ASP 793.A N ILE 797.A O no hydrogen 3.048 N/A ALA 794.A N ASP 793.A OD1 no hydrogen 2.835 N/A GLY 796.A N ASP 793.A O no hydrogen 3.237 N/A ILE 797.A N ASP 795.A OD1 no hydrogen 2.902 N/A CYS 798.A N LEU 810.A O no hydrogen 3.004 N/A CYS 798.A SG LEU 810.A O no hydrogen 3.305 N/A SER 799.A OG GLU 802.A OE2 no hydrogen 2.742 N/A GLY 801.A N ILE 839.A O no hydrogen 2.465 N/A LYS 803.A NZ ASP 836.A OD2 no hydrogen 2.568 N/A VAL 804.A N SER 837.A O no hydrogen 2.844 N/A GLU 805.A N GLN 808.A OE1 no hydrogen 2.492 N/A LYS 807.A N TYR 831.A O no hydrogen 3.164 N/A GLN 808.A NE2 TRP 787.A O no hydrogen 3.594 N/A VAL 809.A N ARG 788.A O no hydrogen 3.376 N/A LEU 810.A N ILE 829.A O no hydrogen 2.451 N/A VAL 811.A N ILE 829.A O no hydrogen 3.424 N/A ASN 812.A N GLY 796.A O no hydrogen 3.256 N/A ASN 812.A ND2 MET 774.A O no hydrogen 3.327 N/A ASN 812.A ND2 GLY 775.A O no hydrogen 2.911 N/A LYS 813.A NZ THR 761.A O no hydrogen 3.132 N/A SER 814.A N LYS 772.A O no hydrogen 2.828 N/A SER 814.A OG ASP 826.A OD1 no hydrogen 3.068 N/A MET 815.A N LYS 825.A O no hydrogen 2.893 N/A THR 817.A N GLN 823.A O no hydrogen 2.717 N/A THR 817.A OG1 GLN 823.A O no hydrogen 3.421 N/A TYR 824.A OH PHE 770.A O no hydrogen 3.350 N/A LYS 825.A N MET 815.A O no hydrogen 2.917 N/A VAL 827.A N LYS 813.A O no hydrogen 2.979 N/A ILE 829.A N VAL 811.A O no hydrogen 2.773 N/A TYR 831.A N GLN 808.A O no hydrogen 2.859 N/A TYR 831.A OH THR 835.A O no hydrogen 2.927 N/A GLY 833.A N ASN 806.A OD1 no hydrogen 3.279 N/A SER 837.A N VAL 804.A O no hydrogen 2.937 N/A SER 837.A OG TYR 838.A O no hydrogen 3.475 N/A SER 837.A OG ARG 859.A O no hydrogen 3.347 N/A TYR 838.A N ARG 859.A O no hydrogen 2.806 N/A ILE 839.A N GLU 802.A O no hydrogen 3.276 N/A GLU 840.A N LEU 857.A O no hydrogen 2.925 N/A LYS 841.A NZ ARG 685.A O no hydrogen 3.356 N/A MET 843.A N LYS 855.A O no hydrogen 2.864 N/A SER 845.A N LEU 853.A O no hydrogen 2.934 N/A SER 845.A OG ILE 844.A O no hydrogen 2.836 N/A SER 846.A OG ASN 847.A O no hydrogen 2.803 N/A ASN 847.A N ALA 851.A O no hydrogen 3.263 N/A ASP 850.A N ASN 847.A O no hydrogen 3.135 N/A PHE 852.A N LEU 762.A O no hydrogen 2.887 N/A LEU 853.A N SER 845.A O no hydrogen 2.856 N/A ILE 854.A N CYS 760.A O no hydrogen 2.924 N/A LYS 855.A N MET 843.A O no hydrogen 2.925 N/A LYS 855.A NZ ASP 89.A OD1 no hydrogen 3.167 N/A LYS 855.A NZ ASP 89.A OD2 no hydrogen 3.198 N/A MET 856.A N ALA 758.A O no hydrogen 2.887 N/A LEU 857.A N LYS 841.A O no hydrogen 2.934 N/A LEU 858.A N LYS 756.A O no hydrogen 2.849 N/A ARG 859.A N TYR 838.A O no hydrogen 2.471 N/A GLN 860.A N VAL 754.A O no hydrogen 2.929 N/A ARG 862.A N CYS 752.A O no hydrogen 2.928 N/A ARG 862.A NH1 ASP 991.A OD1 no hydrogen 2.651 N/A ARG 862.A NH1 ASP 991.A OD2 no hydrogen 3.180 N/A ARG 862.A NH2 GLN 860.A OE1 no hydrogen 3.342 N/A ARG 862.A NH2 ASP 991.A OD1 no hydrogen 2.753 N/A GLU 865.A N ASP 868.A OD2 no hydrogen 2.354 N/A ASP 868.A N GLU 865.A O no hydrogen 3.099 N/A LYS 869.A N HIS 987.A O no hydrogen 3.414 N/A PHE 870.A N GLY 878.A O no hydrogen 2.645 N/A SER 871.A N GLN 983.A O no hydrogen 3.207 N/A ARG 873.A N SER 871.A OG no hydrogen 3.394 N/A ARG 873.A NH2 GLU 918.A OE2 no hydrogen 2.271 N/A HIS 874.A NE2 GLU 918.A OE1 no hydrogen 2.227 N/A GLY 875.A N GLN 669.A OE1 no hydrogen 3.477 N/A GLN 876.A NE2 GLY 906.A O no hydrogen 3.533 N/A GLN 876.A NE2 THR 912.A OG1 no hydrogen 3.173 N/A GLY 878.A N PHE 870.A O no hydrogen 2.383 N/A CYS 880.A SG LEU 882.A O no hydrogen 3.913 N/A GLY 881.A N LEU 738.A O no hydrogen 3.143 N/A VAL 884.A N LEU 740.A O no hydrogen 3.329 N/A GLU 887.A N GLU 887.A OE1 no hydrogen 2.486 N/A MET 889.A N GLN 886.A O no hydrogen 3.091 N/A PHE 891.A N THR 963.A O no hydrogen 3.279 N/A CYS 892.A N ILE 896.A O no hydrogen 3.345 N/A GLY 895.A N CYS 892.A O no hydrogen 3.309 N/A CYS 897.A SG PRO 890.A O no hydrogen 3.989 N/A ASP 899.A N THR 723.A O no hydrogen 2.822 N/A ILE 901.A N VAL 739.A O no hydrogen 3.307 N/A MET 902.A N ALA 725.A O no hydrogen 2.992 N/A GLY 906.A N ASN 903.A O no hydrogen 3.420 N/A PHE 907.A N PRO 904.A O no hydrogen 2.918 N/A ARG 910.A NH1 GLN 876.A OE1 no hydrogen 2.446 N/A ARG 910.A NH2 ASP 736.A OD2 no hydrogen 2.873 N/A MET 911.A N PHE 907.A O no hydrogen 2.566 N/A GLY 914.A N ASN 661.A OD1 no hydrogen 2.885 N/A LYS 915.A N THR 912.A O no hydrogen 3.094 N/A LYS 915.A NZ SER 872.A OG no hydrogen 2.508 N/A ILE 917.A N VAL 913.A O no hydrogen 2.971 N/A GLU 918.A N GLY 914.A O no hydrogen 2.844 N/A LEU 919.A N LYS 915.A O no hydrogen 2.884 N/A LEU 920.A N LEU 916.A O no hydrogen 2.966 N/A ALA 921.A N ILE 917.A O no hydrogen 2.906 N/A GLY 922.A N GLU 918.A O no hydrogen 2.830 N/A LYS 923.A N LEU 919.A O no hydrogen 2.950 N/A LYS 923.A NZ GLY 958.A O no hydrogen 3.295 N/A LYS 923.A NZ ASP 960.A OD1 no hydrogen 3.497 N/A LYS 923.A NZ ASP 960.A OD2 no hydrogen 2.615 N/A ALA 924.A N LEU 920.A O no hydrogen 2.976 N/A GLY 925.A N ALA 921.A O no hydrogen 2.860 N/A VAL 926.A N GLY 922.A O no hydrogen 2.914 N/A LEU 927.A N LYS 923.A O no hydrogen 2.946 N/A ASP 928.A N ALA 924.A O no hydrogen 2.944 N/A ARG 930.A N GLY 925.A O no hydrogen 2.972 N/A ARG 930.A N ASP 928.A OD1 no hydrogen 3.290 N/A TYR 933.A OH GLU 709.A OE2 no hydrogen 2.401 N/A GLY 934.A N LYS 704.A O no hydrogen 3.396 N/A PHE 937.A N HIS 659.A ND1 no hydrogen 2.876 N/A SER 940.A N TYR 933.A O no hydrogen 2.851 N/A SER 940.A OG TYR 657.A OH no hydrogen 2.593 N/A SER 940.A OG TYR 933.A O no hydrogen 3.117 N/A VAL 945.A N LYS 941.A O no hydrogen 3.528 N/A CYS 946.A N VAL 942.A O no hydrogen 2.909 N/A CYS 946.A SG VAL 942.A O no hydrogen 3.067 N/A CYS 946.A SG TYR 956.A O no hydrogen 3.166 N/A GLU 947.A N LYS 943.A O no hydrogen 2.921 N/A ASP 948.A N ASP 944.A O no hydrogen 2.928 N/A LEU 949.A N VAL 945.A O no hydrogen 2.884 N/A VAL 950.A N CYS 946.A O no hydrogen 2.936 N/A ARG 951.A N GLU 947.A O no hydrogen 2.927 N/A ARG 951.A NH1 ASP 948.A OD1 no hydrogen 3.352 N/A HIS 952.A N ASP 948.A O no hydrogen 3.240 N/A HIS 952.A N LEU 949.A O no hydrogen 3.163 N/A GLY 953.A N VAL 950.A O no hydrogen 3.237 N/A TYR 954.A N LEU 949.A O no hydrogen 3.155 N/A ASN 955.A ND2 LYS 959.A O no hydrogen 2.804 N/A LEU 957.A N ASN 955.A OD1 no hydrogen 3.345 N/A GLY 958.A N ASN 955.A O no hydrogen 3.293 N/A ASP 960.A N ILE 975.A O no hydrogen 2.652 N/A THR 963.A N PHE 891.A O no hydrogen 3.074 N/A SER 964.A N GLU 969.A O no hydrogen 2.940 N/A SER 964.A OG THR 967.A OG1 no hydrogen 3.374 N/A GLY 968.A N SER 964.A O no hydrogen 2.973 N/A GLU 969.A N THR 967.A OG1 no hydrogen 3.287 N/A LEU 971.A N VAL 962.A O no hydrogen 2.839 N/A ILE 975.A N ASP 960.A O no hydrogen 2.937 N/A TYR 976.A OH LEU 916.A O no hydrogen 3.121 N/A GLY 978.A N VAL 724.A O no hydrogen 2.975 N/A VAL 980.A N ALA 722.A O no hydrogen 2.898 N/A TYR 981.A OH GLN 699.A O no hydrogen 3.051 N/A TYR 982.A N GLN 720.A O no hydrogen 2.913 N/A LEU 985.A N LYS 869.A O no hydrogen 3.181 N/A LYS 986.A NZ HIS 987.A ND1 no hydrogen 3.501 N/A ASP 991.A N MET 988.A O no hydrogen 3.284 N/A LYS 992.A N MET 988.A O no hydrogen 3.341 N/A MET 993.A N VAL 989.A O no hydrogen 2.925 N/A HIS 994.A NE2 GLY 1016.A O no hydrogen 2.884 N/A ARG 996.A NE ALA 997.A O no hydrogen 2.719 N/A ARG 996.A NE ARG 998.A O no hydrogen 3.145 N/A ARG 996.A NH2 ARG 998.A O no hydrogen 2.415 N/A ARG 996.A NH2 PRO 1000.A O no hydrogen 2.584 N/A ALA 1002.A N GLN 1007.A O no hydrogen 3.007 N/A GLN 1007.A N THR 1005.A O no hydrogen 2.640 N/A THR 1009.A OG1 ARG 1014.A O no hydrogen 2.123 N/A ARG 1014.A N GLY 1011.A O no hydrogen 2.922 N/A ASP 1015.A N ARG 1012.A O no hydrogen 3.097 N/A GLY 1016.A N GLY 1011.A O no hydrogen 2.418 N/A GLY 1021.A N GLU 1024.A OE2 no hydrogen 2.879 N/A GLU 1022.A N GLU 1022.A OE1 no hydrogen 2.445 N/A GLU 1024.A N GLU 1024.A OE1 no hydrogen 2.344 N/A ARG 1025.A N GLY 1021.A O no hydrogen 3.356 N/A ASP 1026.A N GLU 1022.A O no hydrogen 2.884 N/A CYS 1027.A N MET 1023.A O no hydrogen 2.915 N/A CYS 1027.A SG MET 1023.A O no hydrogen 3.149 N/A LEU 1028.A N GLU 1024.A O no hydrogen 2.925 N/A ILE 1029.A N ARG 1025.A O no hydrogen 2.867 N/A GLY 1030.A N ASP 1026.A O no hydrogen 2.895 N/A TYR 1031.A N CYS 1027.A O no hydrogen 2.941 N/A GLY 1032.A N LEU 1028.A O no hydrogen 2.966 N/A ALA 1033.A N LEU 1028.A O no hydrogen 3.389 N/A LEU 1037.A N ALA 1033.A O no hydrogen 2.916 N/A LEU 1038.A N SER 1034.A O no hydrogen 2.914 N/A GLU 1039.A N MET 1035.A O no hydrogen 2.880 N/A ARG 1040.A N LEU 1036.A O no hydrogen 2.876 N/A LEU 1041.A N LEU 1037.A O no hydrogen 2.944 N/A MET 1042.A N LEU 1038.A O no hydrogen 2.879 N/A SER 1044.A N GLU 1039.A O no hydrogen 2.957 N/A SER 1044.A OG GLU 1039.A O no hydrogen 3.338 N/A SER 1045.A OG LEU 1041.A O no hydrogen 2.463 N/A SER 1045.A OG ASP 1046.A OD1 no hydrogen 2.869 N/A ASP 1046.A N MET 1042.A O no hydrogen 3.142 N/A PHE 1048.A N ILE 1079.A O no hydrogen 2.903 N/A VAL 1050.A N LEU 1077.A O no hydrogen 2.908 N/A VAL 1052.A N SER 1075.A O no hydrogen 3.261 N/A CYS 1053.A N LEU 1058.A O no hydrogen 3.160 N/A GLY 1054.A N HIS 1073.A O no hydrogen 3.018 N/A CYS 1056.A SG CYS 1053.A O no hydrogen 3.511 N/A CYS 1056.A SG LEU 1058.A O no hydrogen 3.540 N/A GLY 1057.A N CYS 1053.A O no hydrogen 2.647 N/A GLY 1060.A N ASP 1051.A O no hydrogen 2.311 N/A TYR 1061.A N TRP 1064.A O no hydrogen 2.966 N/A GLY 1063.A N ASP 1051.A OD2 no hydrogen 2.568 N/A TRP 1064.A N TYR 1061.A O no hydrogen 2.757 N/A CYS 1065.A N SER 1070.A O no hydrogen 2.753 N/A LYS 1069.A N HIS 1066.A O no hydrogen 3.052 N/A LYS 1069.A NZ HIS 1066.A O no hydrogen 2.366 N/A SER 1070.A N CYS 1065.A O no hydrogen 3.042 N/A CYS 1072.A N SER 1070.A OG no hydrogen 3.045 N/A CYS 1072.A SG SER 1070.A OG no hydrogen 3.413 N/A SER 1075.A OG VAL 1052.A O no hydrogen 3.410 N/A SER 1076.A OG GLU 1049.A OE2 no hydrogen 2.573 N/A LEU 1077.A N GLU 1049.A OE2 no hydrogen 2.547 N/A LEU 1077.A N VAL 1050.A O no hydrogen 2.927 N/A ILE 1079.A N PHE 1048.A O no hydrogen 2.887 N/A TYR 1081.A N ASP 1046.A O no hydrogen 3.429 N/A ALA 1082.A N ASP 1046.A OD2 no hydrogen 3.237 N/A LYS 1084.A N PRO 1080.A O no hydrogen 3.172 N/A LEU 1085.A N TYR 1081.A O no hydrogen 2.913 N/A LEU 1086.A N ALA 1082.A O no hydrogen 2.880 N/A PHE 1087.A N CYS 1083.A O no hydrogen 2.905 N/A GLN 1088.A N LYS 1084.A O no hydrogen 2.934 N/A GLU 1089.A N LEU 1085.A O no hydrogen 2.882 N/A LEU 1090.A N LEU 1086.A O no hydrogen 2.895 N/A GLN 1091.A N PHE 1087.A O no hydrogen 2.891 N/A SER 1092.A N GLN 1088.A O no hydrogen 2.954 N/A SER 1092.A OG GLU 1089.A O no hydrogen 2.671 N/A ASN 1094.A N GLN 1091.A O no hydrogen 2.850 N/A LEU 1099.A N GLY 1057.A O no hydrogen 2.452 N/A