Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8v8h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 6.A OG GLU 666.A OE1 no hydrogen 2.865 N/A GLU 8.A N ILE 12.A O no hydrogen 3.137 N/A GLU 8.A N HIS 13.A O no hydrogen 3.231 N/A LEU 9.A N ILE 12.A O no hydrogen 3.400 N/A TRP 10.A N PHE 94.A O no hydrogen 3.224 N/A ILE 12.A N LEU 9.A O no hydrogen 3.029 N/A MET 15.A N GLU 8.A OE1 no hydrogen 2.481 N/A ILE 19.A N CYS 35.A O no hydrogen 2.898 N/A VAL 21.A N LEU 33.A O no hydrogen 2.869 N/A GLU 22.A N PRO 96.A O no hydrogen 3.114 N/A CYS 23.A N VAL 31.A O no hydrogen 2.904 N/A CYS 23.A SG VAL 21.A O no hydrogen 3.666 N/A LEU 24.A N LEU 98.A O no hydrogen 2.829 N/A LEU 25.A N MET 29.A O no hydrogen 2.799 N/A ASN 27.A ND2 LEU 57.A O no hydrogen 2.404 N/A GLY 28.A N LEU 25.A O no hydrogen 3.124 N/A VAL 31.A N CYS 23.A O no hydrogen 2.916 N/A LEU 33.A N VAL 21.A O no hydrogen 2.896 N/A CYS 35.A N ILE 19.A O no hydrogen 2.879 N/A CYS 35.A SG LEU 33.A O no hydrogen 3.855 N/A ARG 37.A N PRO 17.A O no hydrogen 2.975 N/A ARG 37.A NH1 GLU 8.A OE2 no hydrogen 2.577 N/A ARG 37.A NH2 GLN 694.A OE1 no hydrogen 2.955 N/A ARG 37.A NH2 ASP 699.A OD2 no hydrogen 3.043 N/A GLU 38.A N GLU 38.A OE1 no hydrogen 2.930 N/A ALA 39.A N LEU 36.A O no hydrogen 3.012 N/A THR 40.A OG1 THR 43.A OG1 no hydrogen 2.982 N/A LEU 41.A N ARG 86.A O no hydrogen 3.047 N/A ILE 42.A N GLU 84.A O no hydrogen 3.094 N/A THR 43.A N THR 40.A OG1 no hydrogen 3.331 N/A THR 43.A OG1 THR 40.A O no hydrogen 3.173 N/A THR 43.A OG1 THR 40.A OG1 no hydrogen 2.982 N/A ILE 44.A N THR 40.A O no hydrogen 3.053 N/A LYS 45.A N LEU 41.A O no hydrogen 2.830 N/A LYS 45.A NZ GLU 64.A O no hydrogen 3.253 N/A LYS 45.A NZ TYR 67.A O no hydrogen 3.554 N/A LYS 45.A NZ GLU 84.A OE1 no hydrogen 2.458 N/A HIS 46.A N ILE 42.A O no hydrogen 2.920 N/A HIS 46.A ND1 GLU 64.A OE2 no hydrogen 2.935 N/A GLU 47.A N THR 43.A O no hydrogen 2.870 N/A LEU 48.A N ILE 44.A O no hydrogen 2.865 N/A PHE 49.A N LYS 45.A O no hydrogen 2.892 N/A LYS 50.A N HIS 46.A O no hydrogen 2.889 N/A GLU 51.A N GLU 47.A O no hydrogen 2.969 N/A ARG 53.A N LYS 50.A O no hydrogen 3.300 N/A TYR 55.A N ALA 52.A O no hydrogen 3.221 N/A GLN 62.A N TYR 67.A OH no hydrogen 3.134 N/A SER 65.A N ASP 63.A OD1 no hydrogen 3.355 N/A SER 66.A N ASP 63.A O no hydrogen 2.987 N/A TYR 67.A N GLU 64.A O no hydrogen 3.405 N/A ILE 68.A N ILE 101.A O no hydrogen 2.889 N/A VAL 70.A N LYS 99.A O no hydrogen 2.806 N/A SER 71.A N GLU 79.A O no hydrogen 3.022 N/A SER 71.A OG PHE 97.A O no hydrogen 2.864 N/A VAL 72.A N SER 71.A OG no hydrogen 2.701 N/A THR 73.A N GLU 77.A O no hydrogen 3.116 N/A GLN 74.A N ARG 92.A O no hydrogen 2.868 N/A GLN 74.A NE2 GLY 7.A O no hydrogen 2.772 N/A GLN 74.A NE2 LEU 93.A O no hydrogen 3.534 N/A ALA 76.A N THR 73.A O no hydrogen 2.938 N/A GLU 79.A N SER 71.A O no hydrogen 2.918 N/A PHE 81.A N PHE 69.A O no hydrogen 2.885 N/A THR 85.A N ASP 83.A OD1 no hydrogen 2.785 N/A THR 85.A OG1 ASP 83.A OD1 no hydrogen 3.343 N/A ARG 87.A NE GLU 38.A O no hydrogen 3.076 N/A ARG 87.A NH1 ASP 702.A OD2 no hydrogen 2.710 N/A LEU 88.A N ALA 39.A O no hydrogen 2.925 N/A CYS 89.A N ARG 37.A O no hydrogen 3.223 N/A CYS 89.A SG ARG 37.A O no hydrogen 3.226 N/A CYS 89.A SG ASP 90.A OD1 no hydrogen 3.675 N/A LEU 91.A N LEU 88.A O no hydrogen 2.996 N/A ARG 92.A NH1 GLU 79.A OE1 no hydrogen 3.220 N/A PHE 94.A N VAL 72.A O no hydrogen 2.789 N/A PHE 97.A N GLN 95.A O no hydrogen 2.786 N/A LEU 98.A N GLU 22.A O no hydrogen 2.890 N/A LYS 99.A N VAL 70.A O no hydrogen 2.870 N/A VAL 100.A N LEU 24.A O no hydrogen 2.861 N/A ILE 101.A N ILE 68.A O no hydrogen 2.977 N/A GLU 109.A N ASN 106.A OD1 no hydrogen 3.160 N/A LYS 110.A N ASN 106.A O no hydrogen 3.453 N/A LYS 110.A NZ GLU 80.A OE1 no hydrogen 2.706 N/A LYS 110.A NZ VAL 104.A O no hydrogen 3.031 N/A ILE 111.A N ARG 107.A O no hydrogen 2.984 N/A LEU 112.A N GLU 108.A O no hydrogen 2.962 N/A ASN 113.A N GLU 109.A O no hydrogen 2.980 N/A ASN 113.A ND2 GLU 109.A O no hydrogen 3.287 N/A ARG 114.A N LYS 110.A O no hydrogen 2.968 N/A GLU 115.A N ILE 111.A O no hydrogen 2.938 N/A ILE 116.A N LEU 112.A O no hydrogen 2.976 N/A GLY 117.A N ASN 113.A O no hydrogen 2.908 N/A PHE 118.A N ARG 114.A O no hydrogen 2.929 N/A ALA 119.A N GLU 115.A O no hydrogen 2.956 N/A ILE 120.A N ILE 116.A O no hydrogen 2.966 N/A GLY 121.A N GLY 117.A O no hydrogen 3.068 N/A MET 122.A N GLY 117.A O no hydrogen 3.228 N/A GLU 126.A N PRO 123.A O no hydrogen 3.282 N/A PHE 127.A N VAL 124.A O no hydrogen 2.919 N/A MET 129.A N CYS 125.A O no hydrogen 3.198 N/A VAL 130.A N PHE 127.A O no hydrogen 3.155 N/A GLU 134.A N ASP 132.A OD1 no hydrogen 2.958 N/A VAL 135.A N ASP 132.A O no hydrogen 3.170 N/A GLN 136.A N ASP 132.A O no hydrogen 3.466 N/A GLN 136.A NE2 PHE 127.A O no hydrogen 2.826 N/A GLN 136.A NE2 VAL 130.A O no hydrogen 3.408 N/A ASP 137.A N PRO 133.A O no hydrogen 2.911 N/A PHE 138.A N GLU 134.A O no hydrogen 2.903 N/A ARG 139.A N VAL 135.A O no hydrogen 2.929 N/A ARG 139.A NE GLU 645.A OE2 no hydrogen 3.237 N/A ARG 139.A NH1 ASP 128.A OD1 no hydrogen 2.570 N/A ARG 139.A NH2 ASP 128.A OD1 no hydrogen 3.271 N/A ARG 139.A NH2 GLU 645.A OE2 no hydrogen 2.819 N/A ARG 140.A N GLN 136.A O no hydrogen 2.903 N/A ARG 140.A NH1 ASP 137.A OD1 no hydrogen 3.024 N/A ARG 140.A NH2 ASP 137.A OD1 no hydrogen 3.360 N/A ASN 141.A N ASP 137.A O no hydrogen 2.905 N/A ILE 142.A N PHE 138.A O no hydrogen 2.926 N/A ASN 144.A N ASN 141.A O no hydrogen 2.643 N/A CYS 146.A N ILE 142.A O no hydrogen 3.088 N/A CYS 146.A SG ILE 142.A O no hydrogen 3.431 N/A CYS 146.A SG SER 646.A O no hydrogen 3.650 N/A LYS 147.A N LEU 143.A O no hydrogen 2.829 N/A GLU 148.A N ASN 144.A O no hydrogen 2.933 N/A ALA 149.A N VAL 145.A O no hydrogen 2.928 N/A VAL 150.A N CYS 146.A O no hydrogen 2.977 N/A ASP 151.A N LYS 147.A O no hydrogen 2.853 N/A LEU 152.A N GLU 148.A O no hydrogen 2.953 N/A ARG 153.A N ALA 149.A O no hydrogen 2.933 N/A ARG 153.A NH1 LEU 614.A O no hydrogen 3.288 N/A ARG 153.A NH1 ALA 650.A O no hydrogen 3.093 N/A ARG 153.A NH2 ALA 650.A O no hydrogen 3.104 N/A ASP 154.A N VAL 150.A O no hydrogen 2.969 N/A SER 157.A OG ASP 154.A O no hydrogen 3.450 N/A SER 160.A N ASN 156.A O no hydrogen 2.878 N/A SER 160.A OG LEU 152.A O no hydrogen 2.980 N/A SER 160.A OG ARG 153.A O no hydrogen 3.011 N/A MET 163.A N HIS 159.A O no hydrogen 2.934 N/A TYR 164.A N SER 160.A O no hydrogen 2.891 N/A TYR 164.A OH CYS 651.A O no hydrogen 3.198 N/A VAL 165.A N ARG 161.A O no hydrogen 3.012 N/A TYR 166.A N ALA 162.A O no hydrogen 2.873 N/A ASN 169.A ND2 GLU 258.A OE1 no hydrogen 3.180 N/A ASN 169.A ND2 GLU 258.A OE2 no hydrogen 3.561 N/A GLU 171.A N GLN 268.A O no hydrogen 2.790 N/A SER 172.A OG ASP 582.A OD2 no hydrogen 2.424 N/A GLU 175.A N SER 173.A OG no hydrogen 3.299 N/A ILE 180.A N PRO 177.A O no hydrogen 2.867 N/A TYR 181.A N PRO 177.A O no hydrogen 2.997 N/A ASN 182.A N LYS 178.A O no hydrogen 2.918 N/A LYS 183.A N ILE 180.A O no hydrogen 2.972 N/A LYS 183.A NZ MET 277.A O no hydrogen 3.111 N/A LYS 183.A NZ ASP 786.A OD2 no hydrogen 3.379 N/A LEU 184.A N TYR 181.A O no hydrogen 3.436 N/A GLN 188.A N ASP 185.A O no hydrogen 2.833 N/A ILE 189.A N ILE 210.A O no hydrogen 2.854 N/A VAL 191.A N LEU 208.A O no hydrogen 2.898 N/A VAL 192.A N PRO 282.A O no hydrogen 3.147 N/A ILE 193.A N TYR 206.A O no hydrogen 2.941 N/A TRP 194.A N LEU 284.A O no hydrogen 2.874 N/A VAL 195.A N GLN 204.A O no hydrogen 2.918 N/A VAL 197.A N ASP 202.A O no hydrogen 3.218 N/A LYS 203.A NZ GLU 747.A OE1 no hydrogen 3.178 N/A GLN 204.A N VAL 195.A O no hydrogen 3.000 N/A LEU 208.A N VAL 191.A O no hydrogen 2.850 N/A ILE 210.A N ILE 189.A O no hydrogen 2.969 N/A CYS 214.A N ASN 211.A O no hydrogen 3.166 N/A CYS 214.A SG ASN 211.A O no hydrogen 3.476 N/A CYS 214.A SG GLN 218.A OE1 no hydrogen 3.459 N/A VAL 215.A N GLN 218.A OE1 no hydrogen 3.173 N/A VAL 219.A N VAL 215.A O no hydrogen 3.199 N/A ILE 220.A N PRO 216.A O no hydrogen 2.922 N/A ALA 221.A N GLU 217.A O no hydrogen 2.901 N/A GLU 222.A N GLN 218.A O no hydrogen 2.967 N/A ALA 223.A N VAL 219.A O no hydrogen 2.978 N/A ILE 224.A N ILE 220.A O no hydrogen 2.867 N/A ARG 225.A N ALA 221.A O no hydrogen 2.917 N/A ARG 225.A NE GLU 222.A OE1 no hydrogen 3.438 N/A ARG 225.A NH2 GLU 222.A OE1 no hydrogen 3.273 N/A LYS 226.A N GLU 222.A O no hydrogen 2.938 N/A LYS 227.A N ALA 223.A O no hydrogen 2.955 N/A LYS 227.A NZ TYR 206.A OH no hydrogen 3.534 N/A THR 228.A N ILE 224.A O no hydrogen 2.645 N/A THR 228.A OG1 ILE 224.A O no hydrogen 2.947 N/A SER 230.A OG LYS 227.A O no hydrogen 3.340 N/A SER 234.A N GLN 237.A OE1 no hydrogen 3.224 N/A LEU 238.A N SER 234.A O no hydrogen 2.700 N/A LYS 239.A N SER 235.A O no hydrogen 2.980 N/A LEU 240.A N GLU 236.A O no hydrogen 2.867 N/A CYS 241.A N GLN 237.A O no hydrogen 2.831 N/A VAL 242.A N LEU 238.A O no hydrogen 3.000 N/A LEU 243.A N LYS 239.A O no hydrogen 2.936 N/A GLU 244.A N LEU 240.A O no hydrogen 3.210 N/A TYR 245.A N CYS 241.A O no hydrogen 3.013 N/A GLN 246.A N VAL 242.A O no hydrogen 2.705 N/A LYS 252.A N MET 285.A O no hydrogen 2.934 N/A LYS 252.A NZ VAL 253.A O no hydrogen 2.805 N/A LYS 252.A NZ ASP 743.A OD2 no hydrogen 3.350 N/A VAL 253.A N GLU 258.A O no hydrogen 3.019 N/A CYS 254.A N ASN 283.A O no hydrogen 3.174 N/A CYS 256.A N VAL 253.A O no hydrogen 3.428 N/A ASP 257.A N ALA 714.A O no hydrogen 2.920 N/A PHE 260.A N LEU 251.A O no hydrogen 3.048 N/A LYS 263.A N GLU 262.A OE2 no hydrogen 2.931 N/A LYS 263.A NZ GLU 217.A OE1 no hydrogen 2.734 N/A TYR 264.A N GLU 262.A O no hydrogen 2.824 N/A LEU 266.A N CYS 214.A O no hydrogen 2.714 N/A SER 267.A N HIS 212.A O no hydrogen 3.004 N/A SER 267.A OG HIS 212.A ND1 no hydrogen 3.386 N/A GLN 268.A N PRO 265.A O no hydrogen 3.043 N/A TYR 269.A N LEU 266.A O no hydrogen 3.174 N/A TYR 269.A OH GLU 262.A O no hydrogen 2.958 N/A LYS 270.A N ASN 169.A O no hydrogen 2.899 N/A LYS 270.A NZ ASP 582.A OD1 no hydrogen 3.538 N/A ARG 273.A N TYR 269.A O no hydrogen 3.025 N/A ARG 273.A NH1 SER 173.A O no hydrogen 3.174 N/A ARG 273.A NH2 PRO 174.A O no hydrogen 3.133 N/A SER 274.A N LYS 270.A O no hydrogen 2.871 N/A CYS 275.A N TYR 271.A O no hydrogen 2.897 N/A CYS 275.A SG TYR 271.A O no hydrogen 3.229 N/A ILE 276.A N ILE 272.A O no hydrogen 2.874 N/A MET 277.A N ARG 273.A O no hydrogen 2.918 N/A LEU 278.A N SER 274.A O no hydrogen 2.881 N/A GLY 279.A N ILE 276.A O no hydrogen 2.876 N/A ASN 283.A N TYR 271.A OH no hydrogen 3.298 N/A LEU 284.A N VAL 192.A O no hydrogen 2.818 N/A MET 285.A N LYS 252.A O no hydrogen 2.847 N/A LEU 286.A N TRP 194.A O no hydrogen 2.807 N/A LYS 289.A NZ GLY 247.A O no hydrogen 3.104 N/A LEU 292.A N LYS 289.A O no hydrogen 3.075 N/A TYR 293.A N LYS 289.A O no hydrogen 2.957 N/A SER 294.A N GLU 290.A O no hydrogen 2.912 N/A SER 294.A OG GLU 290.A O no hydrogen 3.208 N/A GLN 295.A N LEU 292.A O no hydrogen 2.767 N/A LEU 296.A N TYR 293.A O no hydrogen 3.218 N/A SER 305.A OG GLU 109.A OE2 no hydrogen 3.070 N/A TYR 306.A OH GLU 645.A OE2 no hydrogen 2.878 N/A SER 307.A OG PRO 304.A O no hydrogen 3.019 N/A VAL 317.A N SER 314.A O no hydrogen 3.315 N/A ILE 318.A N LEU 315.A O no hydrogen 3.481 N/A LEU 322.A N ILE 377.A O no hydrogen 3.378 N/A ILE 324.A N LEU 373.A O no hydrogen 2.912 N/A LYS 325.A N GLU 457.A O no hydrogen 2.991 N/A LYS 325.A NZ ASN 370.A OD1 no hydrogen 3.441 N/A ILE 326.A N GLU 371.A O no hydrogen 2.908 N/A LEU 327.A N GLU 455.A O no hydrogen 3.232 N/A CYS 328.A N GLU 455.A O no hydrogen 3.313 N/A CYS 328.A SG ALA 329.A O no hydrogen 3.301 N/A CYS 328.A SG PRO 367.A O no hydrogen 3.005 N/A ALA 329.A N PRO 367.A O no hydrogen 3.507 N/A THR 330.A N CYS 453.A O no hydrogen 3.194 N/A THR 330.A OG1 CYS 453.A O no hydrogen 3.472 N/A TYR 331.A OH GLU 450.A O no hydrogen 3.116 N/A VAL 334.A N VAL 332.A O no hydrogen 3.017 N/A ILE 340.A N VAL 362.A O no hydrogen 3.334 N/A TYR 341.A N CYS 393.A O no hydrogen 2.877 N/A TYR 341.A OH HIS 400.A ND1 no hydrogen 2.724 N/A VAL 342.A N THR 359.A OG1 no hydrogen 2.488 N/A ARG 343.A N SER 391.A O no hydrogen 2.901 N/A THR 344.A N VAL 357.A O no hydrogen 2.818 N/A THR 344.A OG1 VAL 357.A O no hydrogen 2.759 N/A THR 344.A OG1 TYR 375.A OH no hydrogen 2.920 N/A TYR 347.A N ARG 387.A O no hydrogen 2.826 N/A TYR 347.A OH ASN 356.A OD1 no hydrogen 3.360 N/A HIS 348.A N GLU 351.A O no hydrogen 2.847 N/A LEU 353.A N ILE 346.A O no hydrogen 2.725 N/A CYS 354.A SG ASP 355.A O no hydrogen 3.635 N/A THR 359.A N VAL 342.A O no hydrogen 3.100 N/A THR 359.A OG1 VAL 342.A O no hydrogen 3.380 N/A GLN 360.A N GLU 371.A OE1 no hydrogen 3.073 N/A VAL 362.A N ILE 340.A O no hydrogen 3.075 N/A CYS 364.A SG ASP 338.A OD1 no hydrogen 2.974 N/A CYS 364.A SG ASP 338.A OD2 no hydrogen 3.429 N/A TRP 369.A N LEU 327.A O no hydrogen 3.109 N/A ASN 370.A N LEU 327.A O no hydrogen 2.969 N/A GLU 371.A N ILE 326.A O no hydrogen 2.934 N/A LEU 373.A N ILE 324.A O no hydrogen 2.782 N/A TYR 375.A N LEU 322.A O no hydrogen 2.772 N/A TYR 375.A OH THR 344.A OG1 no hydrogen 2.920 N/A ILE 377.A N TYR 375.A O no hydrogen 2.780 N/A ILE 379.A N SER 320.A O no hydrogen 3.166 N/A LEU 382.A N ILE 379.A O no hydrogen 3.060 N/A ARG 384.A NE ASP 415.A OD1 no hydrogen 2.974 N/A ARG 384.A NH1 ARG 384.A O no hydrogen 3.006 N/A ARG 384.A NH1 TYR 600.A OH no hydrogen 3.140 N/A ARG 384.A NH2 ASP 412.A O no hydrogen 2.949 N/A ARG 384.A NH2 ASP 415.A OD1 no hydrogen 2.771 N/A ALA 386.A N PRO 383.A O no hydrogen 3.345 N/A ARG 387.A N TYR 347.A O no hydrogen 3.151 N/A ARG 387.A NH2 PRO 439.A O no hydrogen 2.508 N/A LEU 388.A N ILE 408.A O no hydrogen 2.865 N/A CYS 389.A N GLY 345.A O no hydrogen 2.987 N/A CYS 389.A SG ASN 438.A O no hydrogen 3.619 N/A CYS 389.A SG PRO 439.A O no hydrogen 3.919 N/A LEU 390.A N GLY 406.A O no hydrogen 2.892 N/A SER 391.A N ARG 343.A O no hydrogen 2.918 N/A SER 391.A OG LEU 436.A O no hydrogen 2.430 N/A ILE 392.A N ALA 404.A O no hydrogen 2.940 N/A CYS 393.A N TYR 341.A O no hydrogen 2.842 N/A CYS 393.A SG SER 391.A OG no hydrogen 3.576 N/A CYS 393.A SG LEU 436.A O no hydrogen 3.835 N/A SER 394.A N CYS 401.A O no hydrogen 2.707 N/A SER 394.A OG CYS 401.A O no hydrogen 3.400 N/A VAL 395.A N LYS 339.A O no hydrogen 2.927 N/A LYS 396.A NZ GLU 399.A OE1 no hydrogen 2.851 N/A CYS 401.A N SER 394.A O no hydrogen 3.258 N/A LEU 403.A N ILE 392.A O no hydrogen 2.862 N/A TRP 405.A N TRP 427.A O no hydrogen 3.242 N/A TRP 405.A NE1 PRO 428.A O no hydrogen 2.717 N/A GLY 406.A N LEU 390.A O no hydrogen 2.920 N/A ASN 407.A ND2 ASN 438.A O no hydrogen 2.538 N/A ASN 407.A ND2 GLY 441.A O no hydrogen 2.973 N/A ILE 408.A N LEU 388.A O no hydrogen 2.907 N/A ASN 409.A ND2 GLN 599.A O no hydrogen 3.291 N/A LEU 410.A N ALA 386.A O no hydrogen 3.249 N/A ASP 412.A N THR 416.A O no hydrogen 2.495 N/A TYR 413.A OH ASP 137.A OD2 no hydrogen 2.763 N/A THR 414.A OG1 THR 416.A OG1 no hydrogen 3.354 N/A ASP 415.A N ASP 412.A O no hydrogen 3.300 N/A THR 416.A OG1 THR 414.A OG1 no hydrogen 3.354 N/A LEU 417.A N VAL 465.A O no hydrogen 3.234 N/A VAL 418.A N LEU 410.A O no hydrogen 3.455 N/A GLY 420.A N PHE 458.A O no hydrogen 2.994 N/A MET 422.A N LEU 456.A O no hydrogen 2.886 N/A LEU 424.A N LEU 454.A O no hydrogen 2.902 N/A ASN 425.A N SER 445.A OG no hydrogen 3.173 N/A LEU 426.A N PRO 452.A O no hydrogen 2.686 N/A TRP 427.A N TRP 405.A O no hydrogen 3.042 N/A TRP 427.A NE1 GLY 444.A O no hydrogen 3.289 N/A GLY 444.A N ASN 407.A O no hydrogen 2.992 N/A ASN 446.A N ASN 425.A O no hydrogen 3.072 N/A ASN 446.A ND2 LEU 426.A O no hydrogen 3.132 N/A ASN 448.A N ASN 446.A OD1 no hydrogen 2.629 N/A LYS 449.A NZ ASN 446.A O no hydrogen 3.116 N/A THR 451.A OG1 ASN 448.A O no hydrogen 3.119 N/A CYS 453.A N THR 330.A OG1 no hydrogen 3.046 N/A CYS 453.A SG LEU 454.A O no hydrogen 3.801 N/A LEU 454.A N LEU 424.A O no hydrogen 2.895 N/A GLU 455.A N CYS 328.A O no hydrogen 2.953 N/A LEU 456.A N MET 422.A O no hydrogen 2.935 N/A GLU 457.A N LYS 325.A O no hydrogen 3.451 N/A PHE 458.A N GLY 420.A O no hydrogen 2.756 N/A VAL 464.A N SER 311.A O no hydrogen 2.880 N/A LYS 466.A N LYS 313.A O no hydrogen 3.099 N/A LYS 466.A NZ THR 414.A O no hydrogen 3.226 N/A PHE 467.A N ASP 415.A O no hydrogen 3.001 N/A ASP 469.A N ASP 469.A OD1 no hydrogen 2.569 N/A SER 471.A OG ASP 469.A OD2 no hydrogen 2.634 N/A VAL 472.A N ASP 469.A O no hydrogen 3.085 N/A ILE 473.A N ASP 469.A O no hydrogen 3.484 N/A GLU 474.A N MET 470.A O no hydrogen 2.945 N/A GLU 475.A N SER 471.A O no hydrogen 2.907 N/A HIS 476.A N VAL 472.A O no hydrogen 2.939 N/A ALA 477.A N ILE 473.A O no hydrogen 2.901 N/A ASN 478.A N GLU 474.A O no hydrogen 2.993 N/A LYS 488.A N LYS 484.A O no hydrogen 3.034 N/A ILE 490.A N GLN 486.A O no hydrogen 2.849 N/A SER 491.A N LEU 487.A O no hydrogen 3.453 N/A SER 491.A OG LEU 487.A O no hydrogen 3.023 N/A THR 492.A OG1 ALA 489.A O no hydrogen 2.741 N/A ARG 493.A NE SER 497.A OG no hydrogen 3.113 N/A ARG 493.A NH2 GLU 503.A OE1 no hydrogen 3.369 N/A SER 497.A N ASP 494.A O no hydrogen 2.931 N/A GLN 502.A N GLN 502.A OE1 no hydrogen 2.821 N/A GLU 503.A N THR 500.A OG1 no hydrogen 3.287 N/A LYS 504.A N THR 500.A O no hydrogen 2.607 N/A LYS 504.A NZ LEU 526.A O no hydrogen 3.269 N/A ASP 505.A N GLU 501.A O no hydrogen 2.945 N/A PHE 506.A N GLN 502.A O no hydrogen 2.878 N/A LEU 507.A N GLU 503.A O no hydrogen 2.891 N/A TRP 508.A N LYS 504.A O no hydrogen 2.952 N/A SER 509.A N ASP 505.A O no hydrogen 2.918 N/A SER 509.A OG ASP 505.A O no hydrogen 3.032 N/A SER 509.A OG PHE 506.A O no hydrogen 2.846 N/A HIS 510.A N PHE 506.A O no hydrogen 3.357 N/A ARG 511.A NH1 TRP 508.A O no hydrogen 2.652 N/A ARG 511.A NH2 GLN 538.A OE1 no hydrogen 2.240 N/A CYS 514.A N ARG 511.A O no hydrogen 3.030 N/A CYS 514.A SG HIS 510.A O no hydrogen 3.291 N/A THR 516.A N TYR 513.A O no hydrogen 2.820 N/A THR 516.A OG1 TYR 513.A O no hydrogen 2.727 N/A GLU 519.A N GLU 519.A OE1 no hydrogen 2.703 N/A ILE 520.A N ILE 517.A O no hydrogen 3.328 N/A LEU 521.A N PRO 518.A O no hydrogen 2.900 N/A LYS 523.A NZ ARG 493.A O no hydrogen 2.779 N/A LYS 523.A NZ ASP 494.A O no hydrogen 3.457 N/A LEU 524.A N ILE 520.A O no hydrogen 3.085 N/A LEU 525.A N LEU 521.A O no hydrogen 3.029 N/A LEU 526.A N PRO 522.A O no hydrogen 3.278 N/A LEU 526.A N LYS 523.A O no hydrogen 2.947 N/A SER 527.A N LEU 524.A O no hydrogen 2.956 N/A SER 527.A OG LYS 523.A O no hydrogen 3.489 N/A VAL 528.A N LEU 525.A O no hydrogen 3.422 N/A LYS 529.A N GLU 535.A OE1 no hydrogen 3.136 N/A ASN 531.A N ASN 531.A OD1 no hydrogen 2.541 N/A ARG 533.A N ASP 381.A OD1 no hydrogen 3.330 N/A VAL 536.A N SER 532.A O no hydrogen 2.867 N/A ALA 537.A N ARG 533.A O no hydrogen 2.842 N/A GLN 538.A N ASP 534.A O no hydrogen 3.034 N/A MET 539.A N GLU 535.A O no hydrogen 2.861 N/A TYR 540.A N VAL 536.A O no hydrogen 2.894 N/A TYR 540.A OH ASP 564.A OD1 no hydrogen 2.846 N/A CYS 541.A N ALA 537.A O no hydrogen 3.422 N/A CYS 541.A SG ALA 537.A O no hydrogen 3.455 N/A LEU 542.A N GLN 538.A O no hydrogen 3.030 N/A VAL 543.A N MET 539.A O no hydrogen 2.841 N/A LYS 544.A N TYR 540.A O no hydrogen 2.988 N/A TRP 546.A NE1 PRO 518.A O no hydrogen 3.137 N/A LYS 550.A N GLN 553.A OE1 no hydrogen 3.268 N/A GLU 552.A N GLU 552.A OE1 no hydrogen 2.684 N/A GLN 553.A N LYS 550.A O no hydrogen 3.084 N/A ALA 554.A N LYS 550.A O no hydrogen 3.090 N/A MET 555.A N PRO 551.A O no hydrogen 2.986 N/A GLU 556.A N GLN 553.A O no hydrogen 3.208 N/A LEU 557.A N ALA 554.A O no hydrogen 3.095 N/A LEU 558.A N MET 555.A O no hydrogen 2.830 N/A ASP 559.A N GLU 556.A O no hydrogen 3.102 N/A CYS 560.A SG ASP 559.A OD1 no hydrogen 3.512 N/A CYS 560.A SG TYR 597.A OH no hydrogen 3.481 N/A ASN 561.A N ASP 559.A OD1 no hydrogen 3.013 N/A TYR 562.A OH GLU 556.A OE2 no hydrogen 2.934 N/A MET 566.A N ASP 564.A OD2 no hydrogen 3.069 N/A ARG 568.A N ASP 564.A O no hydrogen 3.302 N/A ARG 568.A NH2 LEU 558.A O no hydrogen 2.334 N/A GLY 569.A N PRO 565.A O no hydrogen 2.841 N/A PHE 570.A N MET 566.A O no hydrogen 2.915 N/A ALA 571.A N VAL 567.A O no hydrogen 2.980 N/A VAL 572.A N ARG 568.A O no hydrogen 2.824 N/A ARG 573.A N GLY 569.A O no hydrogen 2.906 N/A CYS 574.A N PHE 570.A O no hydrogen 2.900 N/A CYS 574.A SG ILE 549.A O no hydrogen 3.683 N/A LEU 575.A N ALA 571.A O no hydrogen 2.935 N/A GLU 576.A N VAL 572.A O no hydrogen 2.832 N/A LYS 577.A N ARG 573.A O no hydrogen 3.022 N/A TYR 578.A N CYS 574.A O no hydrogen 2.860 N/A LEU 579.A N LEU 575.A O no hydrogen 3.186 N/A LYS 583.A N THR 580.A OG1 no hydrogen 3.235 N/A LYS 583.A NZ GLU 552.A OE2 no hydrogen 3.360 N/A LEU 584.A N THR 580.A O no hydrogen 2.836 N/A SER 585.A N ASP 581.A O no hydrogen 2.911 N/A GLN 586.A N ASP 582.A O no hydrogen 2.904 N/A TYR 587.A N LYS 583.A O no hydrogen 2.729 N/A LEU 588.A N SER 585.A O no hydrogen 3.419 N/A GLN 590.A N GLN 590.A OE1 no hydrogen 2.588 N/A GLN 590.A NE2 GLN 771.A OE1 no hydrogen 2.850 N/A LEU 591.A N TYR 587.A O no hydrogen 3.205 N/A VAL 592.A N LEU 588.A O no hydrogen 2.838 N/A GLN 593.A N ILE 589.A O no hydrogen 2.976 N/A GLN 593.A NE2 GLU 630.A OE2 no hydrogen 2.741 N/A VAL 594.A N GLN 590.A O no hydrogen 2.914 N/A LEU 595.A N VAL 592.A O no hydrogen 3.045 N/A LYS 596.A N GLN 593.A O no hydrogen 3.409 N/A LYS 596.A NZ GLN 593.A OE1 no hydrogen 2.998 N/A LYS 596.A NZ GLU 630.A OE2 no hydrogen 2.989 N/A TYR 597.A N VAL 594.A O no hydrogen 3.174 N/A TYR 600.A OH PHE 411.A O no hydrogen 3.007 N/A LEU 601.A N GLU 134.A OE2 no hydrogen 3.473 N/A ARG 607.A N ASN 603.A O no hydrogen 3.381 N/A ARG 607.A NE ASP 602.A OD1 no hydrogen 3.033 N/A ARG 607.A NH2 ASP 602.A OD2 no hydrogen 2.990 N/A PHE 608.A N LEU 604.A O no hydrogen 2.951 N/A LEU 609.A N LEU 605.A O no hydrogen 2.920 N/A LEU 610.A N VAL 606.A O no hydrogen 2.878 N/A LYS 611.A N ARG 607.A O no hydrogen 2.939 N/A LYS 611.A NZ GLU 148.A OE1 no hydrogen 2.767 N/A LYS 612.A N PHE 608.A O no hydrogen 2.972 N/A LYS 612.A NZ ASP 581.A OD1 no hydrogen 3.221 N/A ALA 613.A N LEU 609.A O no hydrogen 2.849 N/A LEU 614.A N LEU 610.A O no hydrogen 2.906 N/A THR 615.A OG1 LYS 611.A O no hydrogen 2.756 N/A ASN 616.A N LYS 612.A O no hydrogen 3.041 N/A GLN 617.A N TYR 164.A O no hydrogen 3.068 N/A ARG 618.A NH2 SER 585.A OG no hydrogen 3.428 N/A ILE 619.A N ASN 616.A OD1 no hydrogen 2.938 N/A GLY 620.A N ASN 616.A O no hydrogen 2.749 N/A HIS 621.A N GLN 617.A O no hydrogen 2.859 N/A HIS 621.A NE2 PRO 710.A O no hydrogen 2.787 N/A PHE 623.A N ILE 619.A O no hydrogen 2.860 N/A PHE 624.A N GLY 620.A O no hydrogen 2.844 N/A TRP 625.A N HIS 621.A O no hydrogen 2.985 N/A TRP 625.A NE1 GLN 661.A OE1 no hydrogen 3.010 N/A HIS 626.A N PHE 622.A O no hydrogen 2.853 N/A LEU 627.A N PHE 623.A O no hydrogen 3.024 N/A LYS 628.A N PHE 624.A O no hydrogen 2.856 N/A LYS 628.A NZ ALA 119.A O no hydrogen 3.400 N/A LYS 628.A NZ ILE 120.A O no hydrogen 3.410 N/A SER 629.A N TRP 625.A O no hydrogen 2.882 N/A SER 629.A OG TRP 625.A O no hydrogen 3.247 N/A SER 629.A OG HIS 626.A O no hydrogen 3.052 N/A GLU 630.A N LEU 627.A O no hydrogen 3.163 N/A MET 631.A N LYS 628.A O no hydrogen 2.982 N/A ASN 633.A N GLU 630.A O no hydrogen 3.365 N/A THR 635.A N ASN 633.A OD1 no hydrogen 3.011 N/A THR 635.A OG1 ASN 633.A OD1 no hydrogen 2.797 N/A SER 637.A N ASN 633.A O no hydrogen 2.829 N/A ARG 639.A NH1 TYR 600.A O no hydrogen 3.279 N/A PHE 640.A N VAL 636.A O no hydrogen 2.986 N/A GLY 641.A N SER 637.A O no hydrogen 2.823 N/A LEU 642.A N GLN 638.A O no hydrogen 2.872 N/A LEU 643.A N ARG 639.A O no hydrogen 2.982 N/A LEU 644.A N PHE 640.A O no hydrogen 2.877 N/A GLU 645.A N GLY 641.A O no hydrogen 2.836 N/A SER 646.A N LEU 642.A O no hydrogen 2.964 N/A SER 646.A OG LEU 642.A O no hydrogen 3.009 N/A TYR 647.A N LEU 643.A O no hydrogen 2.931 N/A CYS 648.A N LEU 644.A O no hydrogen 2.853 N/A CYS 648.A SG LEU 644.A O no hydrogen 3.179 N/A ARG 649.A N GLU 645.A O no hydrogen 2.968 N/A ARG 649.A NE GLU 645.A OE2 no hydrogen 3.550 N/A ARG 649.A NH2 ASN 113.A OD1 no hydrogen 3.295 N/A ARG 649.A NH2 GLU 645.A OE2 no hydrogen 3.561 N/A ALA 650.A N TYR 647.A O no hydrogen 2.896 N/A CYS 651.A N TYR 647.A O no hydrogen 2.757 N/A CYS 651.A SG TYR 647.A O no hydrogen 3.829 N/A CYS 651.A SG CYS 648.A O no hydrogen 3.924 N/A MET 653.A N ASP 299.A OD2 no hydrogen 2.940 N/A TYR 654.A OH HIS 621.A ND1 no hydrogen 2.728 N/A LEU 655.A N GLY 652.A O no hydrogen 3.413 N/A LEU 658.A N TYR 654.A O no hydrogen 2.963 N/A ASN 659.A N LEU 655.A O no hydrogen 2.863 N/A ASN 659.A ND2 GLU 115.A O no hydrogen 3.570 N/A ARG 660.A N LYS 656.A O no hydrogen 2.926 N/A ARG 660.A NH1 ALA 703.A O no hydrogen 3.173 N/A GLN 661.A N HIS 657.A O no hydrogen 2.972 N/A GLN 661.A NE2 TYR 654.A OH no hydrogen 3.165 N/A GLN 661.A NE2 HIS 657.A O no hydrogen 3.555 N/A VAL 662.A N LEU 658.A O no hydrogen 2.837 N/A GLU 663.A N ASN 659.A O no hydrogen 2.853 N/A ALA 664.A N ARG 660.A O no hydrogen 2.989 N/A MET 665.A N GLN 661.A O no hydrogen 2.917 N/A GLU 666.A N VAL 662.A O no hydrogen 2.795 N/A LYS 667.A N GLU 663.A O no hydrogen 3.015 N/A LYS 667.A NZ ASP 90.A OD1 no hydrogen 2.837 N/A LYS 667.A NZ ASP 699.A OD2 no hydrogen 3.204 N/A LEU 668.A N ALA 664.A O no hydrogen 2.982 N/A ILE 669.A N MET 665.A O no hydrogen 2.823 N/A ASN 670.A N GLU 666.A O no hydrogen 2.949 N/A ASN 670.A ND2 HIS 13.A O no hydrogen 3.087 N/A LEU 671.A N LYS 667.A O no hydrogen 2.946 N/A THR 672.A N LEU 668.A O no hydrogen 2.959 N/A THR 672.A OG1 LEU 668.A O no hydrogen 2.584 N/A THR 672.A OG1 ILE 669.A O no hydrogen 2.888 N/A ASP 673.A N ILE 669.A O no hydrogen 2.848 N/A ILE 674.A N ASN 670.A O no hydrogen 3.024 N/A LEU 675.A N LEU 671.A O no hydrogen 3.013 N/A LYS 676.A N THR 672.A O no hydrogen 2.875 N/A LYS 676.A NZ ASN 759.A O no hydrogen 3.330 N/A GLN 677.A N ASP 673.A O no hydrogen 2.750 N/A LYS 679.A N ILE 674.A O no hydrogen 3.125 N/A LYS 679.A NZ GLU 682.A OE2 no hydrogen 3.265 N/A LYS 680.A N GLN 677.A O no hydrogen 3.028 N/A GLU 682.A N LYS 679.A O no hydrogen 3.326 N/A GLN 684.A NE2 ILE 727.A O no hydrogen 3.028 N/A GLN 687.A N THR 683.A O no hydrogen 2.979 N/A GLN 687.A NE2 LEU 675.A O no hydrogen 2.935 N/A GLN 687.A NE2 LYS 679.A O no hydrogen 2.675 N/A MET 688.A N GLN 684.A O no hydrogen 2.852 N/A LYS 689.A N LYS 685.A O no hydrogen 2.924 N/A LYS 689.A NZ GLU 693.A OE2 no hydrogen 2.594 N/A PHE 690.A N VAL 686.A O no hydrogen 2.902 N/A LEU 691.A N GLN 687.A O no hydrogen 2.809 N/A VAL 692.A N MET 688.A O no hydrogen 2.920 N/A GLU 693.A N LYS 689.A O no hydrogen 2.996 N/A GLN 694.A N PHE 690.A O no hydrogen 2.889 N/A MET 695.A N LEU 691.A O no hydrogen 2.899 N/A ARG 696.A N VAL 692.A O no hydrogen 3.062 N/A ARG 697.A N GLN 694.A O no hydrogen 3.303 N/A ARG 697.A NH1 GLU 38.A OE2 no hydrogen 3.362 N/A PHE 700.A N ARG 697.A O no hydrogen 3.140 N/A MET 701.A N ARG 697.A O no hydrogen 3.218 N/A ASP 702.A N PRO 698.A O no hydrogen 2.891 N/A ALA 703.A N ASP 699.A O no hydrogen 2.981 N/A LEU 704.A N PHE 700.A O no hydrogen 2.750 N/A GLN 705.A NE2 MET 701.A O no hydrogen 3.310 N/A GLY 706.A N GLY 718.A O no hydrogen 2.845 N/A PHE 707.A N LEU 717.A O no hydrogen 3.108 N/A SER 709.A N HIS 715.A O no hydrogen 3.235 N/A LEU 711.A N SER 709.A OG no hydrogen 3.194 N/A ASN 712.A N SER 709.A O no hydrogen 3.019 N/A ALA 714.A N ASN 712.A OD1 no hydrogen 3.265 N/A HIS 715.A N ASN 712.A O no hydrogen 2.683 N/A LEU 717.A N PHE 707.A O no hydrogen 2.661 N/A GLY 718.A N GLU 740.A O no hydrogen 2.867 N/A LEU 720.A N GLN 705.A OE1 no hydrogen 2.608 N/A ARG 721.A N ASN 738.A O no hydrogen 2.869 N/A GLU 723.A N GLU 723.A OE1 no hydrogen 2.653 N/A GLU 724.A N ARG 721.A O no hydrogen 2.936 N/A CYS 725.A N ARG 721.A O no hydrogen 3.268 N/A CYS 725.A SG ARG 721.A O no hydrogen 3.690 N/A CYS 725.A SG ASN 738.A O no hydrogen 4.027 N/A ARG 726.A N TRP 736.A O no hydrogen 3.013 N/A MET 728.A N PRO 734.A O no hydrogen 3.338 N/A ARG 733.A N SER 730.A O no hydrogen 3.102 N/A ARG 733.A NH1 GLN 687.A OE1 no hydrogen 2.459 N/A ARG 733.A NH2 SER 729.A O no hydrogen 3.538 N/A ARG 733.A NH2 SER 730.A O no hydrogen 3.559 N/A LEU 735.A N PHE 757.A O no hydrogen 2.841 N/A TRP 736.A N ARG 726.A O no hydrogen 2.698 N/A LEU 737.A N ILE 755.A O no hydrogen 2.915 N/A TRP 739.A N ASN 753.A O no hydrogen 2.846 N/A TRP 739.A NE1 LEU 704.A O no hydrogen 3.126 N/A GLU 740.A N ASN 719.A O no hydrogen 2.812 N/A ASN 741.A ND2 GLY 255.A O no hydrogen 3.046 N/A ASN 741.A ND2 PHE 750.A O no hydrogen 3.255 N/A ASP 743.A N ASN 741.A OD1 no hydrogen 3.157 N/A MET 745.A N ASP 743.A OD1 no hydrogen 2.898 N/A SER 746.A N ASP 743.A O no hydrogen 2.990 N/A SER 746.A OG ASN 741.A O no hydrogen 3.247 N/A SER 746.A OG ASP 743.A O no hydrogen 3.523 N/A LEU 748.A N MET 745.A O no hydrogen 3.215 N/A LEU 749.A N SER 746.A O no hydrogen 3.509 N/A ASN 753.A N TRP 739.A O no hydrogen 2.966 N/A ILE 755.A N LEU 737.A O no hydrogen 2.934 N/A ILE 756.A N ILE 804.A O no hydrogen 2.872 N/A PHE 757.A N LEU 735.A O no hydrogen 2.925 N/A ASN 759.A ND2 THR 672.A OG1 no hydrogen 3.404 N/A ASN 759.A ND2 ASP 673.A OD1 no hydrogen 3.124 N/A GLY 760.A N CYS 800.A O no hydrogen 3.051 N/A ARG 764.A NE ASP 762.A OD1 no hydrogen 3.469 N/A ARG 764.A NH2 GLY 965.A O no hydrogen 2.994 N/A GLN 765.A NE2 GLU 968.A OE1 no hydrogen 2.930 N/A MET 767.A N LEU 763.A O no hydrogen 2.860 N/A LEU 768.A N ARG 764.A O no hydrogen 2.990 N/A THR 769.A N GLN 765.A O no hydrogen 2.956 N/A THR 769.A OG1 GLN 765.A O no hydrogen 2.894 N/A LEU 770.A N ASP 766.A O no hydrogen 2.911 N/A GLN 771.A N MET 767.A O no hydrogen 2.934 N/A GLN 771.A NE2 GLN 590.A OE1 no hydrogen 3.384 N/A ILE 772.A N LEU 768.A O no hydrogen 2.974 N/A ILE 773.A N THR 769.A O no hydrogen 2.840 N/A ARG 774.A N LEU 770.A O no hydrogen 2.889 N/A ILE 775.A N GLN 771.A O no hydrogen 2.995 N/A MET 776.A N ILE 772.A O no hydrogen 2.874 N/A GLU 777.A N ILE 773.A O no hydrogen 2.952 N/A ASN 778.A N ARG 774.A O no hydrogen 3.003 N/A ILE 779.A N ILE 775.A O no hydrogen 2.924 N/A TRP 780.A N MET 776.A O no hydrogen 2.906 N/A TRP 780.A NE1 ALA 943.A O no hydrogen 3.230 N/A GLN 781.A N GLU 777.A O no hydrogen 2.987 N/A GLN 781.A NE2 HIS 179.A NE2 no hydrogen 3.327 N/A GLN 781.A NE2 ASP 786.A OD1 no hydrogen 2.559 N/A ASN 782.A N ASN 778.A O no hydrogen 2.936 N/A GLN 783.A N ILE 779.A O no hydrogen 3.074 N/A GLY 784.A N GLN 781.A O no hydrogen 3.146 N/A LEU 785.A N TRP 780.A O no hydrogen 2.718 N/A LEU 787.A N LEU 785.A O no hydrogen 2.853 N/A MET 789.A N GLU 777.A OE2 no hydrogen 2.804 N/A TYR 792.A N LEU 790.A O no hydrogen 2.882 N/A GLY 793.A N GLU 805.A OE1 no hydrogen 3.248 N/A CYS 794.A SG LEU 803.A O no hydrogen 3.891 N/A LEU 795.A N LEU 803.A O no hydrogen 3.253 N/A SER 796.A OG GLY 798.A O no hydrogen 3.390 N/A ILE 797.A N VAL 801.A O no hydrogen 2.748 N/A GLY 798.A N VAL 801.A O no hydrogen 2.913 N/A CYS 800.A SG ASP 799.A OD1 no hydrogen 3.520 N/A VAL 801.A N GLY 798.A O no hydrogen 2.930 N/A LEU 803.A N LEU 795.A O no hydrogen 2.933 N/A ILE 804.A N ILE 756.A O no hydrogen 2.899 N/A GLU 805.A N GLY 793.A O no hydrogen 3.246 N/A VAL 806.A N GLU 754.A O no hydrogen 3.109 N/A SER 810.A OG VAL 807.A O no hydrogen 2.979 N/A HIS 811.A N VAL 879.A O no hydrogen 2.920 N/A THR 812.A N GLN 815.A OE1 no hydrogen 3.360 N/A THR 812.A OG1 GLN 815.A OE1 no hydrogen 3.468 N/A ILE 813.A N ILE 877.A O no hydrogen 3.137 N/A MET 814.A N ASN 874.A O no hydrogen 2.486 N/A GLN 815.A N THR 812.A OG1 no hydrogen 2.800 N/A ILE 816.A N THR 812.A O no hydrogen 2.658 N/A GLN 817.A N ILE 813.A O no hydrogen 2.911 N/A CYS 818.A N MET 814.A O no hydrogen 2.989 N/A GLY 820.A N ILE 816.A O no hydrogen 3.041 N/A GLY 821.A N CYS 818.A O no hydrogen 2.600 N/A ALA 825.A N LEU 822.A O no hydrogen 2.526 N/A SER 830.A OG ASN 829.A O no hydrogen 2.417 N/A HIS 831.A N ASN 829.A O no hydrogen 2.704 N/A THR 832.A OG1 PHE 828.A O no hydrogen 2.409 N/A HIS 834.A N HIS 831.A O no hydrogen 2.743 N/A HIS 834.A NE2 TYR 846.A OH no hydrogen 2.644 N/A TRP 836.A N THR 832.A O no hydrogen 2.748 N/A LEU 837.A N LEU 833.A O no hydrogen 2.938 N/A LYS 838.A N HIS 834.A O no hydrogen 2.847 N/A ASP 839.A N GLN 835.A O no hydrogen 2.699 N/A LYS 840.A N TRP 836.A O no hydrogen 3.213 N/A ASN 841.A ND2 LEU 837.A O no hydrogen 2.907 N/A ASN 841.A ND2 ASP 881.A O no hydrogen 2.918 N/A GLU 844.A N GLU 844.A OE1 no hydrogen 2.418 N/A ILE 845.A N LYS 842.A O no hydrogen 3.267 N/A TYR 846.A OH HIS 834.A NE2 no hydrogen 2.644 N/A ALA 849.A N ILE 845.A O no hydrogen 2.923 N/A ILE 850.A N TYR 846.A O no hydrogen 2.890 N/A ASP 851.A N ASP 847.A O no hydrogen 2.925 N/A LEU 852.A N ALA 848.A O no hydrogen 2.947 N/A PHE 853.A N ALA 849.A O no hydrogen 2.920 N/A THR 854.A N ILE 850.A O no hydrogen 2.942 N/A THR 854.A OG1 ILE 850.A O no hydrogen 3.472 N/A THR 854.A OG1 ASP 851.A O no hydrogen 3.015 N/A ARG 855.A N ASP 851.A O no hydrogen 2.946 N/A ARG 855.A NE ASP 851.A OD1 no hydrogen 3.135 N/A ARG 855.A NE ASP 851.A OD2 no hydrogen 3.295 N/A ARG 855.A NH1 ASP 786.A O no hydrogen 2.741 N/A SER 856.A N LEU 852.A O no hydrogen 2.973 N/A SER 856.A OG LEU 852.A O no hydrogen 3.018 N/A SER 856.A OG PHE 853.A O no hydrogen 2.775 N/A CYS 857.A N PHE 853.A O no hydrogen 2.807 N/A ALA 858.A N THR 854.A O no hydrogen 2.908 N/A TYR 860.A N SER 856.A O no hydrogen 2.986 N/A CYS 861.A N CYS 857.A O no hydrogen 2.894 N/A VAL 862.A N ALA 858.A O no hydrogen 2.966 N/A ALA 863.A N GLY 859.A O no hydrogen 2.954 N/A THR 864.A N TYR 860.A O no hydrogen 2.849 N/A THR 864.A OG1 TYR 860.A O no hydrogen 2.416 N/A PHE 865.A N CYS 861.A O no hydrogen 2.968 N/A PHE 865.A N VAL 862.A O no hydrogen 3.146 N/A ILE 866.A N VAL 862.A O no hydrogen 2.917 N/A LEU 867.A N ALA 863.A O no hydrogen 3.007 N/A ILE 869.A N LEU 867.A O no hydrogen 2.666 N/A ARG 872.A NE GLY 870.A O no hydrogen 3.090 N/A ARG 872.A NH1 HIS 887.A ND1 no hydrogen 3.497 N/A ARG 872.A NH1 ILE 888.A O no hydrogen 2.763 N/A ARG 872.A NH2 ILE 888.A O no hydrogen 2.834 N/A HIS 873.A N ASN 876.A OD1 no hydrogen 2.545 N/A ASN 876.A N HIS 873.A O no hydrogen 3.139 N/A MET 878.A N PHE 886.A O no hydrogen 2.839 N/A VAL 879.A N HIS 811.A O no hydrogen 2.874 N/A LYS 880.A N GLN 884.A O no hydrogen 3.032 N/A GLY 883.A N LYS 880.A O no hydrogen 2.872 N/A GLN 884.A N ASP 882.A OD1 no hydrogen 3.211 N/A GLN 884.A NE2 MET 789.A O no hydrogen 2.852 N/A LEU 885.A N SER 856.A OG no hydrogen 2.805 N/A PHE 886.A N MET 878.A O no hydrogen 2.931 N/A ILE 888.A N ASN 876.A O no hydrogen 2.825 N/A HIS 892.A ND1 GLU 968.A OE2 no hydrogen 3.276 N/A ASP 895.A N GLY 868.A O no hydrogen 2.939 N/A THR 913.A OG1 PHE 910.A O no hydrogen 3.059 N/A GLN 914.A NE2 GLY 1006.A O no hydrogen 3.444 N/A PHE 916.A N LEU 912.A O no hydrogen 3.108 N/A LEU 917.A N THR 913.A O no hydrogen 2.867 N/A ILE 918.A N GLN 914.A O no hydrogen 2.936 N/A ILE 920.A N PHE 916.A O no hydrogen 2.709 N/A SER 921.A OG ILE 920.A O no hydrogen 2.483 N/A SER 921.A OG THR 930.A OG1 no hydrogen 3.304 N/A CYS 927.A SG LEU 917.A O no hydrogen 3.751 N/A THR 930.A OG1 SER 921.A OG no hydrogen 3.304 N/A THR 930.A OG1 GLU 932.A OE1 no hydrogen 3.370 N/A GLU 932.A N GLU 932.A OE1 no hydrogen 2.945 N/A PHE 933.A N THR 930.A OG1 no hydrogen 3.260 N/A GLU 934.A N THR 930.A O no hydrogen 3.092 N/A ARG 935.A N ARG 931.A O no hydrogen 3.007 N/A PHE 936.A N GLU 932.A O no hydrogen 2.927 N/A GLN 937.A N PHE 933.A O no hydrogen 2.874 N/A GLU 938.A N GLU 934.A O no hydrogen 2.971 N/A MET 939.A N ARG 935.A O no hydrogen 2.967 N/A CYS 940.A N PHE 936.A O no hydrogen 3.011 N/A CYS 940.A SG PHE 936.A O no hydrogen 3.227 N/A TYR 941.A N GLN 937.A O no hydrogen 2.926 N/A LYS 942.A N GLU 938.A O no hydrogen 2.969 N/A ALA 943.A N MET 939.A O no hydrogen 2.953 N/A TYR 944.A N CYS 940.A O no hydrogen 2.944 N/A TYR 944.A OH THR 981.A O no hydrogen 2.618 N/A LEU 945.A N TYR 941.A O no hydrogen 3.003 N/A ALA 946.A N LYS 942.A O no hydrogen 2.858 N/A ILE 947.A N ALA 943.A O no hydrogen 2.999 N/A ARG 948.A N TYR 944.A O no hydrogen 2.963 N/A ARG 948.A NH1 LEU 982.A O no hydrogen 2.884 N/A ARG 948.A NH1 ALA 983.A O no hydrogen 2.523 N/A ARG 948.A NH2 LYS 986.A O no hydrogen 2.926 N/A GLN 949.A N LEU 945.A O no hydrogen 2.860 N/A GLN 949.A NE2 LEU 945.A O no hydrogen 3.248 N/A HIS 950.A N ILE 947.A O no hydrogen 2.992 N/A ALA 951.A N ARG 948.A O no hydrogen 3.320 N/A LEU 953.A N HIS 950.A O no hydrogen 2.806 N/A ILE 955.A N ALA 951.A O no hydrogen 2.985 N/A ASN 956.A N ASN 952.A O no hydrogen 2.914 N/A LEU 957.A N LEU 953.A O no hydrogen 2.872 N/A PHE 958.A N PHE 954.A O no hydrogen 2.964 N/A SER 959.A N ILE 955.A O no hydrogen 2.878 N/A SER 959.A OG ILE 955.A O no hydrogen 2.726 N/A MET 960.A N ASN 956.A O no hydrogen 2.872 N/A MET 961.A N LEU 957.A O no hydrogen 3.043 N/A SER 964.A OG MET 961.A O no hydrogen 3.106 N/A MET 966.A N SER 964.A O no hydrogen 2.604 N/A LEU 969.A N MET 966.A O no hydrogen 3.499 N/A GLN 970.A NE2 MET 966.A O no hydrogen 2.810 N/A SER 971.A N ASP 974.A OD1 no hydrogen 3.056 N/A SER 971.A OG ASP 974.A OD1 no hydrogen 2.824 N/A ASP 974.A N SER 971.A O no hydrogen 3.091 N/A ALA 976.A N PHE 972.A O no hydrogen 2.948 N/A TYR 977.A N ASP 974.A O no hydrogen 2.988 N/A TYR 977.A OH ASP 895.A OD2 no hydrogen 2.944 N/A ILE 978.A N ILE 975.A O no hydrogen 3.305 N/A ARG 979.A NE ASP 494.A OD1 no hydrogen 2.950 N/A ARG 979.A NE ASP 494.A OD2 no hydrogen 3.232 N/A ARG 979.A NH2 ASP 494.A OD2 no hydrogen 3.283 N/A ARG 979.A NH2 ASP 985.A OD1 no hydrogen 3.128 N/A LYS 980.A N TYR 977.A O no hydrogen 2.771 N/A THR 981.A N TYR 977.A O no hydrogen 2.987 N/A THR 981.A OG1 ILE 866.A O no hydrogen 2.933 N/A THR 981.A OG1 ILE 978.A O no hydrogen 3.129 N/A LEU 982.A N ILE 978.A O no hydrogen 2.973 N/A ALA 983.A N LYS 980.A O no hydrogen 3.231 N/A LEU 984.A N ARG 979.A O no hydrogen 3.161 N/A ALA 991.A N THR 987.A O no hydrogen 3.003 N/A TYR 994.A N GLU 990.A O no hydrogen 3.051 N/A PHE 995.A N ALA 991.A O no hydrogen 2.932 N/A MET 996.A N LEU 992.A O no hydrogen 2.942 N/A LYS 997.A N GLU 993.A O no hydrogen 2.938 N/A GLN 998.A N TYR 994.A O no hydrogen 3.068 N/A MET 999.A N PHE 995.A O no hydrogen 2.977 N/A ASN 1000.A N MET 996.A O no hydrogen 2.934 N/A ASN 1000.A ND2 MET 996.A O no hydrogen 2.290 N/A ASP 1001.A N LYS 997.A O no hydrogen 2.985 N/A ALA 1002.A N GLN 998.A O no hydrogen 3.020 N/A ARG 1003.A N MET 999.A O no hydrogen 2.939 N/A HIS 1004.A N ASN 1000.A O no hydrogen 3.032 N/A GLY 1005.A N ASP 1001.A O no hydrogen 2.950 N/A GLY 1006.A N ALA 1002.A O no hydrogen 2.926 N/A TRP 1007.A N ARG 1003.A O no hydrogen 2.957 N/A THR 1008.A N HIS 1004.A O no hydrogen 3.098 N/A THR 1008.A OG1 GLN 1020.A OE1 no hydrogen 2.402 N/A THR 1009.A N GLY 1005.A O no hydrogen 3.327 N/A THR 1009.A OG1 GLY 1005.A O no hydrogen 3.001 N/A HIS 1016.A N ASP 1012.A O no hydrogen 3.031 N/A HIS 1016.A ND1 HIS 1016.A O no hydrogen 2.702 N/A THR 1017.A OG1 ILE 1018.A O no hydrogen 3.561 N/A LYS 1019.A NZ LYS 1019.A O no hydrogen 3.549 N/A