Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ukt_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASP 1.A O no hydrogen 3.090 N/A THR 7.A N ASP 10.A OD2 no hydrogen 2.842 N/A THR 7.A OG1 ASP 10.A OD1 no hydrogen 3.342 N/A THR 7.A OG1 ASP 10.A OD2 no hydrogen 3.355 N/A ALA 8.A N GLU 629.A OE2 no hydrogen 2.743 N/A ASP 10.A N THR 7.A O no hydrogen 2.885 N/A SER 11.A N THR 7.A O no hydrogen 3.340 N/A SER 11.A OG ALA 8.A O no hydrogen 3.080 N/A SER 11.A OG ILE 658.A O no hydrogen 2.881 N/A TRP 12.A N GLU 9.A O no hydrogen 3.401 N/A ALA 13.A N ASP 10.A O no hydrogen 3.108 N/A ILE 15.A N SER 11.A O no hydrogen 2.962 N/A SER 16.A N TRP 12.A O no hydrogen 2.852 N/A SER 16.A OG TRP 12.A O no hydrogen 2.350 N/A SER 16.A OG TYR 726.A OH no hydrogen 2.609 N/A ALA 17.A N ALA 13.A O no hydrogen 2.894 N/A PHE 18.A N VAL 14.A O no hydrogen 2.949 N/A PHE 19.A N ILE 15.A O no hydrogen 2.958 N/A ARG 20.A N SER 16.A O no hydrogen 2.860 N/A ARG 20.A NH2 GLU 593.A O no hydrogen 3.174 N/A GLU 21.A N ALA 17.A O no hydrogen 2.925 N/A LYS 22.A N PHE 18.A O no hydrogen 2.953 N/A LYS 22.A NZ TYR 613.A OH no hydrogen 2.487 N/A GLY 23.A N PHE 19.A O no hydrogen 2.659 N/A GLN 27.A NE2 LEU 429.A O no hydrogen 3.634 N/A GLN 28.A NE2 LEU 160.A O no hydrogen 3.008 N/A GLN 28.A NE2 LEU 429.A O no hydrogen 3.369 N/A LEU 29.A N VAL 25.A O no hydrogen 3.486 N/A ASP 30.A N SER 26.A O no hydrogen 2.883 N/A SER 31.A N GLN 27.A O no hydrogen 2.937 N/A PHE 32.A N GLN 28.A O no hydrogen 3.004 N/A ASN 33.A N LEU 29.A O no hydrogen 2.857 N/A GLN 34.A N ASP 30.A O no hydrogen 2.904 N/A PHE 35.A N SER 31.A O no hydrogen 2.946 N/A VAL 36.A N PHE 32.A O no hydrogen 2.940 N/A ASP 37.A N ASN 33.A O no hydrogen 2.886 N/A TYR 38.A N GLN 34.A O no hydrogen 3.149 N/A THR 39.A N GLN 34.A O no hydrogen 3.458 N/A THR 39.A OG1 GLN 34.A O no hydrogen 3.291 N/A LEU 40.A N PHE 35.A O no hydrogen 2.979 N/A ASP 42.A N TYR 38.A O no hydrogen 3.084 N/A ILE 43.A N THR 39.A O no hydrogen 2.893 N/A ILE 44.A N LEU 40.A O no hydrogen 2.920 N/A CYS 45.A N GLN 41.A O no hydrogen 2.864 N/A GLU 46.A N ASP 42.A O no hydrogen 2.781 N/A SER 48.A N CYS 45.A O no hydrogen 3.148 N/A LEU 50.A N ILE 61.A O no hydrogen 2.901 N/A LEU 52.A N TYR 59.A O no hydrogen 2.901 N/A GLN 54.A N ARG 57.A O no hydrogen 2.550 N/A TYR 59.A N LEU 52.A O no hydrogen 2.883 N/A GLU 60.A N ARG 106.A O no hydrogen 2.883 N/A ILE 61.A N LEU 50.A O no hydrogen 2.898 N/A SER 62.A N LYS 104.A O no hydrogen 2.913 N/A SER 62.A OG GLU 60.A OE2 no hydrogen 2.228 N/A PHE 63.A N SER 48.A OG no hydrogen 2.820 N/A GLY 64.A N ASP 102.A O no hydrogen 2.641 N/A TYR 67.A N PHE 100.A O no hydrogen 2.421 N/A TYR 67.A OH ASP 102.A OD2 no hydrogen 2.621 N/A THR 69.A N GLY 98.A O no hydrogen 2.906 N/A THR 69.A OG1 LYS 70.A O no hydrogen 3.074 N/A LYS 70.A NZ GLU 131.A OE2 no hydrogen 2.962 N/A VAL 73.A N HIS 81.A O no hydrogen 2.938 N/A SER 76.A OG GLN 863.A O no hydrogen 2.749 N/A HIS 81.A N VAL 73.A O no hydrogen 2.896 N/A LEU 83.A N PRO 71.A O no hydrogen 3.181 N/A GLN 86.A NE2 LYS 141.A O no hydrogen 2.508 N/A ALA 88.A N TYR 84.A O no hydrogen 2.924 N/A ARG 89.A N PRO 85.A O no hydrogen 2.918 N/A ARG 89.A NH1 GLN 86.A OE1 no hydrogen 3.149 N/A LEU 90.A N GLN 86.A O no hydrogen 2.983 N/A ARG 91.A N GLU 87.A O no hydrogen 2.578 N/A ARG 91.A NE THR 861.A O no hydrogen 2.920 N/A ARG 91.A NH2 GLU 75.A OE2 no hydrogen 2.390 N/A ASN 92.A N ARG 89.A O no hydrogen 3.491 N/A LEU 93.A N ALA 88.A O no hydrogen 3.066 N/A TYR 95.A N ILE 152.A O no hydrogen 2.566 N/A SER 97.A N LEU 118.A O no hydrogen 2.899 N/A SER 97.A OG THR 69.A O no hydrogen 2.839 N/A SER 97.A OG ASN 126.A OD1 no hydrogen 2.917 N/A GLY 98.A N THR 69.A OG1 no hydrogen 2.908 N/A LEU 99.A N GLY 116.A O no hydrogen 2.897 N/A PHE 100.A N TYR 67.A O no hydrogen 2.601 N/A VAL 101.A N VAL 113.A O no hydrogen 2.872 N/A VAL 103.A N GLY 111.A O no hydrogen 3.482 N/A LYS 104.A N SER 62.A O no hydrogen 2.878 N/A ARG 106.A N GLU 60.A O no hydrogen 2.927 N/A VAL 113.A N VAL 101.A O no hydrogen 2.707 N/A ILE 115.A N LEU 99.A O no hydrogen 2.698 N/A ARG 117.A N THR 388.A OG1 no hydrogen 3.107 N/A LEU 118.A N SER 97.A O no hydrogen 2.898 N/A LEU 122.A N TYR 150.A O no hydrogen 3.093 N/A SER 124.A N MET 121.A O no hydrogen 3.094 N/A SER 124.A OG ASN 33.A OD1 no hydrogen 2.588 N/A LYS 125.A N ASN 33.A OD1 no hydrogen 2.979 N/A LYS 125.A NZ ASP 37.A OD2 no hydrogen 2.555 N/A ASN 126.A N SER 124.A OG no hydrogen 3.306 N/A ASN 126.A ND2 THR 69.A O no hydrogen 3.107 N/A CYS 127.A N SER 124.A O no hydrogen 3.041 N/A CYS 127.A SG TYR 95.A OH no hydrogen 3.518 N/A TYR 128.A OH PRO 71.A O no hydrogen 2.748 N/A SER 130.A OG SER 124.A O no hydrogen 2.560 N/A SER 130.A OG CYS 127.A O no hydrogen 2.597 N/A SER 130.A OG GLU 131.A OE1 no hydrogen 2.452 N/A ALA 132.A N LEU 129.A O no hydrogen 3.205 N/A THR 133.A OG1 ASP 136.A OD2 no hydrogen 3.457 N/A SER 135.A OG ASP 136.A OD1 no hydrogen 3.007 N/A LEU 137.A N THR 133.A O no hydrogen 2.597 N/A TYR 138.A N GLU 134.A O no hydrogen 2.874 N/A LYS 139.A N SER 135.A O no hydrogen 2.955 N/A LYS 139.A NZ SER 135.A O no hydrogen 2.894 N/A LEU 140.A N ASP 136.A O no hydrogen 2.870 N/A LYS 141.A N TYR 138.A O no hydrogen 3.042 N/A CYS 143.A SG THR 698.A OG1 no hydrogen 2.986 N/A ASP 146.A N CYS 143.A O no hydrogen 3.142 N/A GLY 148.A N ASP 146.A OD1 no hydrogen 2.838 N/A GLY 149.A N LEU 122.A O no hydrogen 2.776 N/A TYR 150.A OH ASP 146.A OD1 no hydrogen 2.763 N/A TYR 150.A OH ASP 146.A OD2 no hydrogen 2.834 N/A PHE 151.A N LYS 158.A O no hydrogen 2.898 N/A ILE 153.A N SER 156.A O no hydrogen 2.925 N/A ASN 154.A N THR 94.A OG1 no hydrogen 3.026 N/A GLY 155.A N LEU 93.A O no hydrogen 3.215 N/A SER 156.A N ILE 153.A O no hydrogen 2.909 N/A SER 156.A OG ILE 153.A O no hydrogen 2.779 N/A LYS 158.A N PHE 151.A O no hydrogen 2.854 N/A LYS 158.A NZ LEU 395.A O no hydrogen 3.199 N/A LYS 158.A NZ ALA 396.A O no hydrogen 2.670 N/A VAL 159.A N GLN 415.A O no hydrogen 2.852 N/A ILE 161.A N VAL 413.A O no hydrogen 2.801 N/A ALA 162.A N ARG 431.A O no hydrogen 3.075 N/A GLN 163.A N ASP 348.A O no hydrogen 2.985 N/A GLU 164.A N ASN 433.A O no hydrogen 2.653 N/A ARG 165.A N ARG 346.A O no hydrogen 2.935 N/A ARG 165.A NH1 SER 166.A O no hydrogen 3.316 N/A ALA 167.A N LYS 344.A O no hydrogen 2.850 N/A ASN 169.A N ARG 189.A O no hydrogen 2.419 N/A ASN 169.A ND2 ALA 191.A O no hydrogen 3.510 N/A ASN 169.A ND2 ASN 511.A O no hydrogen 3.487 N/A GLN 172.A N GLU 187.A O no hydrogen 2.942 N/A VAL 173.A N ASP 337.A OD1 no hydrogen 2.701 N/A PHE 174.A N VAL 185.A O no hydrogen 2.871 N/A LYS 175.A N GLN 336.A OE1 no hydrogen 2.804 N/A LYS 175.A NZ HIS 184.A NE2 no hydrogen 3.056 N/A LYS 175.A NZ CYS 329.A O no hydrogen 2.948 N/A LYS 175.A NZ ASP 332.A OD1 no hydrogen 2.888 N/A LYS 176.A N SER 183.A O no hydrogen 2.970 N/A SER 180.A N ALA 178.A O no hydrogen 2.933 N/A SER 180.A OG ILE 182.A O no hydrogen 3.386 N/A ILE 182.A N SER 180.A OG no hydrogen 3.292 N/A SER 183.A N LEU 206.A O no hydrogen 2.906 N/A VAL 185.A N PHE 174.A O no hydrogen 2.943 N/A ALA 186.A N VAL 204.A O no hydrogen 2.756 N/A GLU 187.A N GLN 172.A O no hydrogen 2.869 N/A ILE 188.A N LEU 202.A O no hydrogen 3.346 N/A SER 190.A N SER 200.A O no hydrogen 3.082 N/A SER 190.A OG HIS 304.A ND1 no hydrogen 3.181 N/A ALA 191.A N ASN 169.A OD1 no hydrogen 2.947 N/A SER 200.A N SER 190.A O no hydrogen 2.946 N/A LEU 202.A N ILE 188.A O no hydrogen 3.328 N/A VAL 204.A N ALA 186.A O no hydrogen 2.907 N/A LYS 205.A N LYS 218.A O no hydrogen 2.854 N/A LYS 205.A NZ LYS 218.A O no hydrogen 3.162 N/A LEU 206.A N HIS 184.A O no hydrogen 3.136 N/A TYR 207.A N THR 216.A O no hydrogen 2.600 N/A GLY 208.A N PRO 181.A O no hydrogen 2.675 N/A ARG 209.A NH1 ILE 182.A O no hydrogen 3.030 N/A ARG 209.A NH2 ALA 177.A O no hydrogen 3.550 N/A GLU 210.A N GLU 210.A OE1 no hydrogen 2.768 N/A SER 212.A OG ARG 209.A O no hydrogen 3.029 N/A LYS 218.A N LYS 205.A O no hydrogen 2.918 N/A ALA 219.A N ILE 228.A O no hydrogen 2.970 N/A THR 220.A N GLN 203.A O no hydrogen 2.954 N/A THR 220.A OG1 LEU 221.A O no hydrogen 3.326 N/A ILE 224.A N LEU 221.A O no hydrogen 3.221 N/A ILE 228.A N ALA 219.A O no hydrogen 2.945 N/A ILE 233.A N PRO 229.A O no hydrogen 3.120 N/A PHE 234.A N ILE 230.A O no hydrogen 2.860 N/A ARG 235.A N VAL 231.A O no hydrogen 2.887 N/A ARG 235.A NE ILE 240.A O no hydrogen 2.563 N/A ARG 235.A NH1 GLY 269.A O no hydrogen 2.782 N/A ARG 235.A NH2 ILE 240.A O no hydrogen 3.194 N/A ARG 235.A NH2 GLN 273.A OE1 no hydrogen 2.777 N/A ALA 236.A N ILE 232.A O no hydrogen 2.923 N/A LEU 237.A N ILE 233.A O no hydrogen 2.861 N/A GLY 238.A N PHE 234.A O no hydrogen 3.010 N/A GLY 238.A N ARG 235.A O no hydrogen 3.069 N/A ILE 239.A N PHE 234.A O no hydrogen 2.999 N/A ILE 245.A N PRO 241.A O no hydrogen 2.873 N/A LEU 246.A N ASP 242.A O no hydrogen 2.920 N/A GLU 247.A N GLY 243.A O no hydrogen 2.858 N/A HIS 248.A N GLU 244.A O no hydrogen 2.898 N/A ILE 249.A N ILE 245.A O no hydrogen 2.925 N/A CYS 250.A N LEU 246.A O no hydrogen 2.652 N/A CYS 250.A SG ASP 252.A O no hydrogen 3.042 N/A ASN 254.A N ASP 252.A OD1 no hydrogen 3.361 N/A ASP 255.A N ASP 252.A OD2 no hydrogen 3.312 N/A GLN 257.A N ASP 255.A OD1 no hydrogen 3.096 N/A GLN 257.A NE2 ASP 255.A OD1 no hydrogen 2.736 N/A MET 258.A N ASP 255.A OD2 no hydrogen 3.070 N/A GLU 260.A N TRP 256.A O no hydrogen 2.852 N/A MET 261.A N GLN 257.A O no hydrogen 2.941 N/A LEU 262.A N MET 258.A O no hydrogen 2.959 N/A LYS 263.A N LEU 259.A O no hydrogen 2.881 N/A LYS 263.A N GLU 260.A O no hydrogen 3.159 N/A LYS 263.A NZ GLU 260.A OE1 no hydrogen 3.416 N/A LYS 263.A NZ GLU 260.A OE2 no hydrogen 3.295 N/A CYS 265.A SG ILE 217.A O no hydrogen 4.050 N/A VAL 266.A N LEU 262.A O no hydrogen 2.957 N/A GLU 267.A N LYS 263.A O no hydrogen 2.876 N/A ASP 268.A N PRO 264.A O no hydrogen 2.939 N/A GLY 269.A N CYS 265.A O no hydrogen 2.877 N/A PHE 270.A N VAL 266.A O no hydrogen 2.893 N/A PHE 270.A N GLU 267.A O no hydrogen 3.351 N/A ILE 272.A N GLY 269.A O no hydrogen 3.245 N/A THR 277.A N ASP 274.A OD2 no hydrogen 2.783 N/A THR 277.A OG1 ASP 274.A O no hydrogen 2.956 N/A THR 277.A OG1 ASP 274.A OD1 no hydrogen 2.811 N/A THR 277.A OG1 ASP 274.A OD2 no hydrogen 2.981 N/A ALA 278.A N ASP 274.A O no hydrogen 3.291 N/A LEU 279.A N ARG 275.A O no hydrogen 2.923 N/A ASP 280.A N GLU 276.A O no hydrogen 2.890 N/A PHE 281.A N THR 277.A O no hydrogen 2.932 N/A ILE 282.A N ASP 280.A O no hydrogen 2.762 N/A ARG 289.A N LYS 286.A O no hydrogen 2.889 N/A ARG 289.A NH2 ASP 280.A OD2 no hydrogen 2.635 N/A ILE 290.A N LYS 286.A O no hydrogen 3.178 N/A GLN 291.A N GLU 287.A O no hydrogen 2.968 N/A GLN 291.A NE2 ASP 295.A OD1 no hydrogen 2.959 N/A GLN 291.A NE2 ASP 295.A OD2 no hydrogen 3.413 N/A TYR 292.A N LYS 288.A O no hydrogen 2.827 N/A ALA 293.A N ARG 289.A O no hydrogen 2.865 N/A LYS 294.A N ILE 290.A O no hydrogen 2.974 N/A ASP 295.A N GLN 291.A O no hydrogen 2.910 N/A ILE 296.A N TYR 292.A O no hydrogen 2.858 N/A LEU 297.A N ALA 293.A O no hydrogen 2.895 N/A GLN 298.A N LYS 294.A O no hydrogen 2.993 N/A GLN 298.A NE2 ASP 295.A OD1 no hydrogen 3.002 N/A LYS 299.A N ASP 295.A O no hydrogen 2.918 N/A GLU 300.A N ILE 296.A O no hydrogen 2.564 N/A PHE 301.A N ILE 296.A O no hydrogen 3.235 N/A HIS 304.A NE2 GLY 512.A O no hydrogen 2.830 N/A THR 306.A OG1 ILE 305.A O no hydrogen 2.545 N/A GLY 310.A N GLU 312.A OE1 no hydrogen 2.764 N/A LYS 315.A N PHE 311.A O no hydrogen 3.471 N/A LYS 315.A NZ LEU 297.A O no hydrogen 2.905 N/A LYS 315.A NZ GLN 298.A O no hydrogen 3.071 N/A LYS 315.A NZ PHE 301.A O no hydrogen 3.045 N/A LYS 315.A NZ THR 306.A O no hydrogen 3.036 N/A ALA 316.A N GLU 312.A O no hydrogen 2.862 N/A PHE 317.A N SER 313.A O no hydrogen 2.911 N/A PHE 318.A N ARG 314.A O no hydrogen 2.952 N/A LEU 319.A N LYS 315.A O no hydrogen 2.871 N/A GLY 320.A N ALA 316.A O no hydrogen 2.878 N/A TYR 321.A N PHE 317.A O no hydrogen 2.897 N/A TYR 321.A OH GLU 551.A OE1 no hydrogen 3.145 N/A TYR 321.A OH GLU 551.A OE2 no hydrogen 2.706 N/A MET 322.A N PHE 318.A O no hydrogen 2.917 N/A ILE 323.A N LEU 319.A O no hydrogen 2.913 N/A ASN 324.A N GLY 320.A O no hydrogen 2.860 N/A ARG 325.A N TYR 321.A O no hydrogen 2.934 N/A LEU 326.A N MET 322.A O no hydrogen 2.924 N/A LEU 327.A N ILE 323.A O no hydrogen 2.883 N/A LEU 328.A N ASN 324.A O no hydrogen 2.856 N/A CYS 329.A N ARG 325.A O no hydrogen 2.995 N/A ALA 330.A N LEU 326.A O no hydrogen 2.866 N/A LEU 331.A N LEU 327.A O no hydrogen 2.410 N/A ASP 332.A N CYS 329.A O no hydrogen 3.031 N/A LYS 334.A N LEU 328.A O no hydrogen 3.140 N/A ASP 337.A N VAL 173.A O no hydrogen 3.026 N/A HIS 341.A NE2 GLU 620.A OE2 no hydrogen 2.572 N/A PHE 342.A N THR 445.A OG1 no hydrogen 3.091 N/A GLY 343.A N HIS 341.A ND1 no hydrogen 2.977 N/A LYS 344.A NZ GLU 617.A OE2 no hydrogen 2.630 N/A LYS 345.A N HIS 341.A O no hydrogen 2.941 N/A ARG 346.A N ARG 165.A O no hydrogen 2.833 N/A ARG 346.A NE ALA 558.A O no hydrogen 3.303 N/A LEU 347.A N GLY 559.A O no hydrogen 2.776 N/A ASP 348.A N GLN 163.A O no hydrogen 2.846 N/A GLY 351.A N SER 31.A OG no hydrogen 2.949 N/A LEU 353.A N LEU 349.A O no hydrogen 3.435 N/A LEU 354.A N ALA 350.A O no hydrogen 2.914 N/A ALA 355.A N GLY 351.A O no hydrogen 2.854 N/A GLN 356.A N PRO 352.A O no hydrogen 2.939 N/A LEU 357.A N LEU 353.A O no hydrogen 2.994 N/A PHE 358.A N LEU 354.A O no hydrogen 2.866 N/A LYS 359.A N ALA 355.A O no hydrogen 2.862 N/A LYS 359.A NZ GLU 46.A OE1 no hydrogen 3.280 N/A THR 360.A N GLN 356.A O no hydrogen 3.060 N/A THR 360.A OG1 GLN 356.A O no hydrogen 2.973 N/A LEU 361.A N LEU 357.A O no hydrogen 2.925 N/A PHE 362.A N PHE 358.A O no hydrogen 2.819 N/A LYS 363.A N LYS 359.A O no hydrogen 2.931 N/A LYS 364.A N THR 360.A O no hydrogen 2.996 N/A LEU 365.A N LEU 361.A O no hydrogen 2.888 N/A THR 366.A N PHE 362.A O no hydrogen 2.872 N/A THR 366.A OG1 PHE 362.A O no hydrogen 2.608 N/A LYS 367.A N LYS 363.A O no hydrogen 2.913 N/A ASP 368.A N LYS 364.A O no hydrogen 2.925 N/A ILE 369.A N LEU 365.A O no hydrogen 2.901 N/A PHE 370.A N THR 366.A O no hydrogen 2.938 N/A ARG 371.A N LYS 367.A O no hydrogen 2.862 N/A ARG 371.A NH1 ASP 368.A OD1 no hydrogen 2.971 N/A TYR 372.A N ASP 368.A O no hydrogen 2.906 N/A MET 373.A N ILE 369.A O no hydrogen 3.021 N/A GLN 374.A N PHE 370.A O no hydrogen 2.862 N/A ARG 375.A N ARG 371.A O no hydrogen 2.876 N/A THR 376.A N TYR 372.A O no hydrogen 3.276 N/A LYS 385.A N ASN 383.A OD1 no hydrogen 3.085 N/A THR 386.A OG1 ASN 383.A O no hydrogen 2.615 N/A THR 388.A N ALA 384.A O no hydrogen 2.950 N/A THR 388.A OG1 ALA 384.A O no hydrogen 2.804 N/A SER 389.A N LYS 385.A O no hydrogen 2.797 N/A SER 389.A OG LYS 385.A O no hydrogen 2.675 N/A SER 389.A OG THR 386.A O no hydrogen 2.979 N/A GLY 390.A N THR 386.A O no hydrogen 2.912 N/A LEU 391.A N ILE 387.A O no hydrogen 3.019 N/A LYS 392.A N THR 388.A O no hydrogen 2.903 N/A LYS 392.A NZ THR 94.A OG1 no hydrogen 2.583 N/A TYR 393.A N SER 389.A O no hydrogen 2.805 N/A ALA 394.A N GLY 390.A O no hydrogen 2.991 N/A LEU 395.A N LEU 391.A O no hydrogen 2.942 N/A ALA 396.A N LYS 392.A O no hydrogen 2.834 N/A THR 397.A N TYR 393.A O no hydrogen 2.905 N/A THR 397.A OG1 TYR 393.A O no hydrogen 2.552 N/A THR 397.A OG1 ALA 394.A O no hydrogen 3.256 N/A THR 397.A OG1 ASN 399.A O no hydrogen 3.320 N/A ASN 399.A N THR 397.A OG1 no hydrogen 3.319 N/A SER 408.A N LYS 404.A O no hydrogen 3.441 N/A SER 408.A OG LYS 404.A O no hydrogen 2.681 N/A SER 409.A OG ALA 406.A O no hydrogen 2.280 N/A ARG 410.A NH2 TRP 400.A O no hydrogen 3.252 N/A GLY 412.A N ASN 399.A OD1 no hydrogen 3.384 N/A VAL 413.A N GLY 398.A O no hydrogen 2.543 N/A SER 414.A N GLY 398.A O no hydrogen 3.429 N/A SER 414.A OG LEU 395.A O no hydrogen 2.723 N/A GLN 415.A N VAL 159.A O no hydrogen 2.889 N/A LEU 417.A N GLU 157.A O no hydrogen 3.314 N/A ARG 419.A NE GLU 157.A OE1 no hydrogen 2.684 N/A ARG 419.A NH2 ASP 146.A OD2 no hydrogen 2.479 N/A ARG 419.A NH2 GLU 157.A OE2 no hydrogen 2.712 N/A TYR 420.A N ASN 418.A OD1 no hydrogen 2.911 N/A THR 421.A N SER 424.A OG no hydrogen 3.037 N/A TYR 422.A OH PHE 145.A O no hydrogen 2.418 N/A SER 424.A OG ASN 418.A O no hydrogen 3.554 N/A SER 424.A OG ASN 418.A OD1 no hydrogen 2.562 N/A SER 424.A OG THR 421.A O no hydrogen 2.618 N/A THR 425.A N THR 421.A O no hydrogen 2.938 N/A THR 425.A OG1 ASN 418.A O no hydrogen 2.449 N/A THR 425.A OG1 THR 421.A O no hydrogen 3.220 N/A LEU 426.A N TYR 422.A O no hydrogen 2.940 N/A SER 427.A N SER 423.A O no hydrogen 2.923 N/A SER 427.A OG GLU 454.A OE2 no hydrogen 2.202 N/A SER 427.A OG ASN 466.A OD1 no hydrogen 2.843 N/A HIS 428.A N SER 424.A O no hydrogen 2.893 N/A HIS 428.A ND1 HIS 428.A O no hydrogen 2.700 N/A LEU 429.A N THR 425.A O no hydrogen 2.978 N/A LEU 429.A N LEU 426.A O no hydrogen 3.195 N/A ARG 430.A N LEU 426.A O no hydrogen 3.309 N/A ARG 430.A NE LEU 24.A O no hydrogen 3.313 N/A ARG 430.A NH2 LEU 24.A O no hydrogen 2.905 N/A ARG 431.A NE ASN 466.A OD1 no hydrogen 3.268 N/A ARG 431.A NH2 ASN 466.A OD1 no hydrogen 2.925 N/A THR 432.A N LYS 465.A O no hydrogen 2.668 N/A THR 432.A OG1 LYS 465.A O no hydrogen 2.957 N/A ASN 433.A N ALA 162.A O no hydrogen 2.597 N/A THR 434.A N LEU 463.A O no hydrogen 3.296 N/A THR 434.A OG1 GLU 164.A OE1 no hydrogen 2.342 N/A THR 434.A OG1 LEU 463.A O no hydrogen 3.043 N/A LYS 438.A N ASP 340.A OD2 no hydrogen 2.605 N/A GLN 441.A N GLN 441.A OE1 no hydrogen 2.717 N/A THR 445.A N HIS 443.A ND1 no hydrogen 3.050 N/A THR 445.A OG1 HIS 443.A ND1 no hydrogen 2.772 N/A HIS 446.A N HIS 443.A O no hydrogen 3.032 N/A TRP 447.A N ASN 444.A O no hydrogen 3.073 N/A TRP 447.A NE1 GLU 657.A OE2 no hydrogen 2.753 N/A LEU 449.A N HIS 446.A O no hydrogen 3.114 N/A VAL 450.A N HIS 446.A O no hydrogen 2.959 N/A CYS 451.A N ASN 466.A O no hydrogen 2.941 N/A THR 455.A OG1 PRO 456.A O no hydrogen 3.195 N/A THR 455.A OG1 VAL 464.A O no hydrogen 3.402 N/A ALA 460.A N GLN 459.A OE1 no hydrogen 2.686 N/A GLY 462.A N THR 455.A OG1 no hydrogen 2.670 N/A LYS 465.A N THR 432.A O no hydrogen 3.250 N/A LYS 465.A N THR 432.A OG1 no hydrogen 2.930 N/A LYS 465.A NZ GLU 164.A OE1 no hydrogen 2.347 N/A ASN 466.A ND2 GLU 454.A O no hydrogen 3.697 N/A SER 468.A N LEU 449.A O no hydrogen 3.368 N/A SER 468.A OG ILE 663.A O no hydrogen 2.868 N/A SER 471.A OG LEU 449.A O no hydrogen 3.516 N/A SER 471.A OG SER 468.A O no hydrogen 3.084 N/A CYS 472.A N TYR 562.A O no hydrogen 2.992 N/A CYS 472.A SG MET 470.A O no hydrogen 3.277 N/A SER 474.A N ARG 560.A O no hydrogen 3.194 N/A SER 474.A OG ASP 557.A O no hydrogen 3.205 N/A SER 474.A OG ARG 560.A O no hydrogen 3.232 N/A VAL 475.A N GLU 540.A OE1 no hydrogen 2.432 N/A GLY 476.A N GLU 540.A OE1 no hydrogen 3.435 N/A GLY 476.A N GLU 540.A OE2 no hydrogen 2.942 N/A THR 477.A N THR 556.A O no hydrogen 2.998 N/A THR 477.A OG1 GLU 540.A OE2 no hydrogen 3.189 N/A MET 480.A N ASP 478.A OD1 no hydrogen 2.855 N/A ILE 483.A N PRO 479.A O no hydrogen 2.940 N/A THR 484.A N MET 480.A O no hydrogen 2.870 N/A THR 484.A OG1 MET 480.A O no hydrogen 2.814 N/A PHE 485.A N PRO 481.A O no hydrogen 2.948 N/A LEU 486.A N ILE 482.A O no hydrogen 2.944 N/A SER 487.A N ILE 483.A O no hydrogen 2.918 N/A SER 487.A OG ILE 483.A O no hydrogen 3.500 N/A GLU 488.A N THR 484.A O no hydrogen 2.892 N/A TRP 489.A N PHE 485.A O no hydrogen 2.897 N/A TRP 489.A N LEU 486.A O no hydrogen 3.199 N/A MET 491.A N LEU 486.A O no hydrogen 3.042 N/A GLU 492.A N VAL 517.A O no hydrogen 3.027 N/A GLU 495.A N GLU 495.A OE2 no hydrogen 2.751 N/A HIS 500.A ND1 GLU 247.A OE2 no hydrogen 2.562 N/A SER 502.A N VAL 498.A O no hydrogen 3.227 N/A SER 502.A OG VAL 498.A O no hydrogen 3.063 N/A THR 506.A N HIS 518.A O no hydrogen 3.008 N/A ARG 507.A N LYS 550.A O no hydrogen 3.240 N/A ARG 507.A NH1 GLU 549.A O no hydrogen 2.494 N/A VAL 508.A N GLY 516.A O no hydrogen 2.867 N/A PHE 509.A N LEU 552.A O no hydrogen 2.715 N/A VAL 510.A N VAL 513.A O no hydrogen 2.648 N/A ASN 511.A N ILE 554.A O no hydrogen 2.686 N/A ASN 511.A ND2 THR 556.A OG1 no hydrogen 2.917 N/A VAL 513.A N VAL 510.A O no hydrogen 2.866 N/A TRP 514.A NE1 GLY 516.A O no hydrogen 2.558 N/A HIS 515.A N VAL 508.A O no hydrogen 3.112 N/A VAL 517.A N GLU 492.A O no hydrogen 3.416 N/A HIS 518.A N THR 506.A O no hydrogen 2.904 N/A HIS 518.A ND1 GLY 490.A O no hydrogen 2.753 N/A ARG 519.A NE GLU 492.A OE2 no hydrogen 3.238 N/A ARG 519.A NH2 GLU 492.A OE2 no hydrogen 3.450 N/A MET 525.A N PRO 521.A O no hydrogen 2.894 N/A GLU 526.A N ALA 522.A O no hydrogen 2.877 N/A THR 527.A N ARG 523.A O no hydrogen 2.940 N/A THR 527.A OG1 ARG 523.A O no hydrogen 3.029 N/A LEU 528.A N LEU 524.A O no hydrogen 2.884 N/A ARG 529.A N MET 525.A O no hydrogen 2.847 N/A THR 530.A N GLU 526.A O no hydrogen 2.915 N/A THR 530.A OG1 GLU 526.A O no hydrogen 3.147 N/A THR 530.A OG1 THR 527.A O no hydrogen 2.629 N/A LEU 531.A N THR 527.A O no hydrogen 2.903 N/A ARG 532.A N LEU 528.A O no hydrogen 2.896 N/A ARG 532.A NE VAL 541.A O no hydrogen 3.188 N/A ARG 532.A NH1 GLU 618.A OE2 no hydrogen 2.462 N/A ARG 532.A NH2 VAL 541.A O no hydrogen 2.568 N/A ARG 532.A NH2 GLU 618.A OE1 no hydrogen 2.966 N/A ARG 533.A N ARG 529.A O no hydrogen 2.942 N/A ARG 533.A NE GLU 569.A OE2 no hydrogen 3.380 N/A ARG 533.A NH2 GLU 569.A OE2 no hydrogen 3.052 N/A LYS 534.A N THR 530.A O no hydrogen 2.862 N/A GLY 535.A N LEU 531.A O no hydrogen 2.591 N/A GLU 540.A N ASN 538.A OD1 no hydrogen 2.950 N/A VAL 541.A N ASN 538.A O no hydrogen 3.146 N/A SER 542.A N PHE 555.A O no hydrogen 2.970 N/A SER 542.A OG ASP 615.A OD2 no hydrogen 3.561 N/A MET 543.A N GLU 618.A OE1 no hydrogen 2.861 N/A ILE 544.A N LYS 553.A O no hydrogen 2.887 N/A ASP 546.A N GLU 551.A O no hydrogen 2.915 N/A GLU 549.A N ASP 546.A OD2 no hydrogen 3.260 N/A LYS 550.A N ILE 547.A O no hydrogen 2.811 N/A LYS 550.A NZ ALA 505.A O no hydrogen 3.312 N/A GLU 551.A N ASP 546.A O no hydrogen 2.980 N/A LEU 552.A N ARG 507.A O no hydrogen 2.901 N/A LYS 553.A N ILE 544.A O no hydrogen 2.834 N/A LYS 553.A NZ ILE 544.A O no hydrogen 3.026 N/A ILE 554.A N PHE 509.A O no hydrogen 2.616 N/A PHE 555.A N SER 542.A O no hydrogen 2.856 N/A THR 556.A N ASN 511.A OD1 no hydrogen 2.771 N/A THR 556.A OG1 THR 477.A O no hydrogen 2.928 N/A THR 556.A OG1 ASN 511.A OD1 no hydrogen 2.944 N/A GLY 559.A N SER 474.A O no hydrogen 3.064 N/A ARG 560.A N SER 474.A OG no hydrogen 2.784 N/A ARG 560.A NE ASP 557.A O no hydrogen 2.699 N/A ARG 560.A NH1 GLU 540.A O no hydrogen 2.372 N/A TYR 562.A N CYS 472.A O no hydrogen 2.841 N/A ARG 563.A N ILE 614.A O no hydrogen 2.896 N/A LEU 565.A N GLU 612.A O no hydrogen 2.881 N/A ILE 567.A N LEU 610.A O no hydrogen 3.225 N/A VAL 568.A N THR 654.A O no hydrogen 2.861 N/A GLU 569.A N GLU 578.A O no hydrogen 2.959 N/A ASP 571.A N HIS 576.A O no hydrogen 3.283 N/A GLU 572.A N ASP 571.A OD1 no hydrogen 2.692 N/A GLY 575.A N GLU 572.A O no hydrogen 2.579 N/A HIS 576.A ND1 HIS 576.A O no hydrogen 2.632 N/A GLU 578.A N GLU 569.A O no hydrogen 2.875 N/A LYS 580.A N ILE 567.A O no hydrogen 2.569 N/A LYS 580.A NZ GLU 569.A OE1 no hydrogen 2.974 N/A LYS 580.A NZ GLU 569.A OE2 no hydrogen 3.479 N/A ARG 582.A NE LEU 579.A O no hydrogen 3.185 N/A ARG 582.A NE VAL 581.A O no hydrogen 2.648 N/A ARG 582.A NH2 LEU 579.A O no hydrogen 2.808 N/A LYS 583.A N ALA 4.A O no hydrogen 2.851 N/A LYS 583.A NZ ASP 10.A OD1 no hydrogen 2.980 N/A LYS 583.A NZ ASP 10.A OD2 no hydrogen 2.584 N/A GLY 584.A N GLU 2.A O no hydrogen 3.373 N/A ILE 586.A N ARG 582.A O no hydrogen 3.009 N/A ALA 587.A N LYS 583.A O no hydrogen 2.848 N/A LYS 588.A N GLY 584.A O no hydrogen 2.939 N/A LEU 589.A N HIS 585.A O no hydrogen 2.909 N/A MET 590.A N ILE 586.A O no hydrogen 2.849 N/A ALA 591.A N ALA 587.A O no hydrogen 2.867 N/A THR 592.A N LYS 588.A O no hydrogen 2.922 N/A THR 592.A OG1 LYS 588.A O no hydrogen 2.989 N/A GLU 593.A N LEU 589.A O no hydrogen 2.900 N/A TYR 594.A N MET 590.A O no hydrogen 2.865 N/A GLN 595.A N ALA 591.A O no hydrogen 3.323 N/A TYR 600.A OH GLU 608.A OE2 no hydrogen 3.230 N/A THR 601.A OG1 GLU 21.A OE1 no hydrogen 3.153 N/A TRP 602.A NE1 TYR 613.A OH no hydrogen 2.571 N/A SER 603.A N GLU 21.A OE1 no hydrogen 2.562 N/A SER 603.A OG GLU 21.A OE2 no hydrogen 2.321 N/A SER 604.A N THR 601.A OG1 no hydrogen 2.712 N/A SER 604.A OG THR 601.A O no hydrogen 2.394 N/A LEU 605.A N THR 601.A O no hydrogen 3.000 N/A LEU 606.A N TRP 602.A O no hydrogen 2.949 N/A ASN 607.A N SER 603.A O no hydrogen 2.885 N/A GLU 608.A N SER 604.A O no hydrogen 2.867 N/A GLY 609.A N LEU 606.A O no hydrogen 3.093 N/A LEU 610.A N LEU 605.A O no hydrogen 3.051 N/A GLU 612.A N LEU 565.A O no hydrogen 2.954 N/A ILE 614.A N ARG 563.A O no hydrogen 2.887 N/A ALA 616.A N ASP 615.A OD1 no hydrogen 2.631 N/A GLU 619.A N ASP 615.A O no hydrogen 2.537 N/A GLU 620.A N ALA 616.A O no hydrogen 2.961 N/A GLU 620.A N GLU 617.A O no hydrogen 3.322 N/A SER 621.A OG GLU 618.A O no hydrogen 3.069 N/A ILE 622.A N GLU 619.A O no hydrogen 3.360 N/A LEU 623.A N THR 654.A OG1 no hydrogen 3.129 N/A ALA 625.A N HIS 655.A O no hydrogen 2.912 N/A GLU 629.A N GLU 629.A OE1 no hydrogen 2.673 N/A ASP 630.A N GLN 627.A O no hydrogen 3.112 N/A LEU 631.A N PRO 628.A O no hydrogen 3.114 N/A LYS 642.A N ASP 639.A O no hydrogen 3.344 N/A LYS 642.A NZ ASP 639.A OD2 no hydrogen 3.141 N/A ARG 643.A NH2 THR 953.A O no hydrogen 2.892 N/A THR 654.A N LEU 623.A O no hydrogen 2.599 N/A THR 654.A OG1 LEU 623.A O no hydrogen 2.733 N/A THR 654.A OG1 HIS 655.A ND1 no hydrogen 2.748 N/A HIS 655.A N LEU 623.A O no hydrogen 3.263 N/A CYS 656.A N PHE 566.A O no hydrogen 2.933 N/A CYS 656.A SG ALA 625.A O no hydrogen 3.549 N/A CYS 656.A SG GLU 657.A O no hydrogen 3.261 N/A GLU 657.A N ALA 625.A O no hydrogen 2.665 N/A HIS 659.A ND1 SER 661.A OG no hydrogen 2.496 N/A SER 661.A N HIS 659.A ND1 no hydrogen 3.368 N/A SER 661.A OG HIS 659.A ND1 no hydrogen 2.496 N/A MET 662.A N HIS 659.A O no hydrogen 3.153 N/A ILE 663.A N PRO 660.A O no hydrogen 2.936 N/A LEU 664.A N SER 661.A O no hydrogen 3.044 N/A ALA 667.A N GLU 454.A OE1 no hydrogen 3.379 N/A SER 669.A N GLY 665.A O no hydrogen 2.657 N/A SER 669.A OG GLY 665.A O no hydrogen 2.202 N/A ILE 670.A N VAL 666.A O no hydrogen 2.962 N/A ILE 671.A N ALA 668.A O no hydrogen 3.005 N/A PHE 673.A N ALA 949.A O no hydrogen 2.751 N/A HIS 676.A N PHE 673.A O no hydrogen 3.073 N/A HIS 676.A N ASP 675.A OD1 no hydrogen 2.724 N/A HIS 676.A ND1 ASP 675.A OD1 no hydrogen 2.576 N/A ASN 677.A N PRO 674.A O no hydrogen 3.254 N/A GLN 678.A NE2 ARG 925.A O no hydrogen 2.616 N/A ARG 681.A NH1 GLY 890.A O no hydrogen 2.762 N/A ASN 682.A N GLN 678.A O no hydrogen 3.434 N/A ASN 682.A ND2 PRO 674.A O no hydrogen 3.171 N/A THR 683.A N SER 679.A O no hydrogen 2.961 N/A THR 683.A OG1 ALA 453.A O no hydrogen 2.599 N/A TYR 684.A N PRO 680.A O no hydrogen 2.949 N/A GLN 685.A N ARG 681.A O no hydrogen 2.915 N/A GLN 685.A NE2 GLN 998.A OE1 no hydrogen 3.115 N/A SER 686.A N ASN 682.A O no hydrogen 2.885 N/A SER 686.A OG ASN 682.A O no hydrogen 2.927 N/A SER 686.A OG THR 683.A O no hydrogen 2.469 N/A ALA 687.A N THR 683.A O no hydrogen 3.100 N/A MET 688.A N TYR 684.A O no hydrogen 2.927 N/A GLY 689.A N GLN 685.A O no hydrogen 2.849 N/A LYS 690.A NZ GLU 454.A OE2 no hydrogen 3.196 N/A LYS 690.A NZ SER 686.A O no hydrogen 3.170 N/A GLN 691.A N ALA 687.A O no hydrogen 3.105 N/A ALA 692.A N GLY 689.A O no hydrogen 3.290 N/A MET 693.A N ARG 999.A O no hydrogen 2.847 N/A ASN 699.A ND2 LYS 141.A O no hydrogen 2.898 N/A ARG 703.A N ASN 699.A O no hydrogen 2.769 N/A ALA 708.A N PHE 771.A O no hydrogen 2.959 N/A ILE 710.A N LEU 769.A O no hydrogen 2.940 N/A TYR 712.A N ARG 767.A O no hydrogen 2.798 N/A TYR 712.A OH THR 876.A OG1 no hydrogen 2.756 N/A GLN 715.A N GLY 735.A O no hydrogen 3.261 N/A LEU 718.A N ASN 737.A OD1 no hydrogen 3.353 N/A THR 720.A N GLY 947.A O no hydrogen 2.873 N/A THR 720.A OG1 GLU 946.A OE2 no hydrogen 2.673 N/A THR 721.A OG1 SER 669.A O no hydrogen 2.707 N/A ARG 722.A N SER 950.A OG no hydrogen 2.629 N/A ARG 722.A NH1 GLU 9.A OE1 no hydrogen 2.643 N/A ARG 722.A NH1 GLU 9.A OE2 no hydrogen 3.229 N/A ARG 722.A NH2 GLU 9.A OE2 no hydrogen 2.739 N/A MET 724.A N THR 721.A O no hydrogen 2.930 N/A TYR 726.A OH SER 16.A OG no hydrogen 2.609 N/A LEU 727.A N ALA 723.A O no hydrogen 2.903 N/A PHE 729.A N MET 724.A O no hydrogen 3.245 N/A ARG 730.A NH2 THR 720.A OG1 no hydrogen 2.616 N/A LEU 732.A N LYS 728.A O no hydrogen 2.987 N/A GLN 736.A N TYR 997.A O no hydrogen 2.889 N/A GLN 736.A NE2 TYR 713.A O no hydrogen 2.906 N/A ASN 737.A N GLN 715.A OE1 no hydrogen 3.311 N/A ILE 739.A N ASP 914.A OD2 no hydrogen 3.064 N/A VAL 740.A N GLY 993.A O no hydrogen 2.864 N/A ALA 741.A N LEU 915.A O no hydrogen 2.885 N/A ILE 742.A N PHE 991.A O no hydrogen 2.959 N/A ALA 743.A N ILE 917.A O no hydrogen 2.883 N/A SER 746.A OG TYR 745.A O no hydrogen 2.733 N/A SER 746.A OG TYR 899.A OH no hydrogen 2.863 N/A SER 753.A N GLN 750.A O no hydrogen 2.992 N/A SER 753.A OG TYR 748.A O no hydrogen 2.557 N/A SER 753.A OG GLN 750.A O no hydrogen 2.362 N/A MET 754.A N THR 894.A O no hydrogen 3.011 N/A ILE 755.A N ILE 916.A O no hydrogen 3.014 N/A MET 756.A N ILE 897.A O no hydrogen 3.328 N/A ASN 757.A N ASP 914.A O no hydrogen 2.957 N/A ASN 757.A ND2 SER 759.A OG no hydrogen 3.061 N/A ASN 757.A ND2 TYR 899.A O no hydrogen 2.943 N/A GLN 758.A N TYR 899.A O no hydrogen 2.421 N/A GLN 758.A NE2 THR 898.A OG1 no hydrogen 2.965 N/A SER 760.A N ASN 757.A OD1 no hydrogen 3.024 N/A SER 760.A OG ASN 757.A OD1 no hydrogen 2.367 N/A SER 760.A OG ASP 914.A OD1 no hydrogen 3.102 N/A ILE 761.A N ASN 757.A O no hydrogen 3.068 N/A ASP 762.A N GLN 758.A O no hydrogen 2.878 N/A ARG 763.A N SER 759.A O no hydrogen 2.943 N/A GLY 764.A N ILE 761.A O no hydrogen 3.084 N/A LEU 765.A N SER 760.A O no hydrogen 2.955 N/A PHE 766.A N GLN 736.A OE1 no hydrogen 2.799 N/A ARG 767.A NH1 ILE 761.A O no hydrogen 3.443 N/A SER 768.A N LYS 877.A O no hydrogen 2.980 N/A LEU 769.A N ILE 710.A O no hydrogen 2.857 N/A PHE 770.A N THR 875.A O no hydrogen 2.866 N/A PHE 771.A N ALA 708.A O no hydrogen 2.859 N/A ARG 772.A N VAL 873.A O no hydrogen 2.943 N/A ARG 772.A NE GLU 850.A OE2 no hydrogen 2.986 N/A ARG 772.A NH2 GLU 850.A OE2 no hydrogen 2.714 N/A SER 773.A N THR 706.A O no hydrogen 3.051 N/A SER 773.A OG ASP 705.A O no hydrogen 2.570 N/A TYR 774.A N VAL 871.A O no hydrogen 2.907 N/A ASP 776.A N VAL 869.A O no hydrogen 2.940 N/A GLU 778.A N LYS 867.A O no hydrogen 3.194 N/A LYS 779.A N GLU 787.A OE1 no hydrogen 2.552 N/A TYR 781.A OH PRO 832.A O no hydrogen 2.674 N/A ILE 785.A N GLY 782.A O no hydrogen 3.233 N/A THR 786.A OG1 GLU 787.A O no hydrogen 2.753 N/A GLU 787.A N LYS 779.A O no hydrogen 2.916 N/A THR 788.A N THR 830.A O no hydrogen 2.990 N/A PHE 789.A N GLU 778.A OE2 no hydrogen 3.046 N/A GLU 790.A N GLY 828.A O no hydrogen 3.228 N/A LYS 791.A N ASP 810.A O no hydrogen 2.701 N/A LYS 791.A NZ TYR 805.A O no hydrogen 2.495 N/A THR 797.A N GLN 793.A O no hydrogen 2.964 N/A LEU 798.A N LYS 839.A O no hydrogen 3.025 N/A LYS 801.A N TYR 805.A OH no hydrogen 3.157 N/A LYS 801.A N ASP 841.A OD2 no hydrogen 3.341 N/A GLY 803.A N LYS 801.A O no hydrogen 2.747 N/A TYR 805.A OH LYS 801.A O no hydrogen 3.219 N/A ASP 806.A N THR 804.A OG1 no hydrogen 3.184 N/A LYS 807.A NZ ARG 819.A O no hydrogen 2.988 N/A LYS 807.A NZ ASP 824.A OD2 no hydrogen 2.573 N/A ASP 809.A N LEU 813.A O no hydrogen 3.024 N/A GLY 812.A N ASP 809.A O no hydrogen 3.336 N/A LEU 813.A N ASP 811.A OD1 no hydrogen 2.734 N/A GLY 817.A N VAL 854.A O no hydrogen 2.977 N/A VAL 818.A N ALA 815.A O no hydrogen 3.439 N/A VAL 820.A N GLY 852.A O no hydrogen 2.902 N/A SER 821.A N ASP 824.A OD2 no hydrogen 2.870 N/A GLY 822.A N GLU 850.A O no hydrogen 3.232 N/A ASP 824.A N SER 821.A O no hydrogen 3.512 N/A VAL 825.A N THR 804.A O no hydrogen 3.460 N/A GLY 828.A N GLY 812.A O no hydrogen 2.922 N/A LYS 829.A NZ ASP 776.A OD1 no hydrogen 2.585 N/A LYS 829.A NZ GLN 777.A O no hydrogen 2.345 N/A LYS 829.A NZ GLU 787.A OE1 no hydrogen 2.684 N/A THR 830.A N THR 788.A O no hydrogen 2.783 N/A THR 830.A OG1 THR 788.A O no hydrogen 3.022 N/A THR 830.A OG1 GLU 790.A OE2 no hydrogen 2.687 N/A THR 831.A N ARG 840.A O no hydrogen 2.860 N/A SER 834.A OG ILE 833.A O no hydrogen 2.763 N/A HIS 837.A ND1 THR 797.A O no hydrogen 3.093 N/A LYS 839.A NZ GLU 790.A OE2 no hydrogen 2.640 N/A ARG 840.A N THR 831.A O no hydrogen 2.892 N/A ASP 841.A N LEU 798.A O no hydrogen 3.338 N/A ALA 842.A N LYS 829.A O no hydrogen 2.703 N/A SER 843.A N ASP 841.A OD1 no hydrogen 2.995 N/A SER 843.A OG ASP 841.A OD1 no hydrogen 2.476 N/A SER 843.A OG ASP 841.A OD2 no hydrogen 3.260 N/A THR 844.A N ILE 827.A O no hydrogen 3.082 N/A LEU 846.A N ASP 824.A O no hydrogen 3.221 N/A SER 848.A OG GLU 823.A OE1 no hydrogen 2.609 N/A THR 849.A OG1 ASP 1005.A O no hydrogen 3.305 N/A GLU 850.A N ARG 847.A O no hydrogen 3.077 N/A GLY 852.A N VAL 820.A O no hydrogen 2.898 N/A ILE 853.A N ARG 874.A O no hydrogen 2.814 N/A VAL 854.A N VAL 818.A O no hydrogen 3.111 N/A GLN 856.A N ARG 872.A O no hydrogen 2.993 N/A LEU 858.A N LYS 870.A O no hydrogen 2.827 N/A THR 860.A N PHE 868.A O no hydrogen 2.981 N/A THR 860.A OG1 THR 861.A O no hydrogen 3.279 N/A THR 861.A OG1 GLY 865.A O no hydrogen 2.644 N/A THR 861.A OG1 LEU 866.A O no hydrogen 3.564 N/A ASN 862.A N LEU 866.A O no hydrogen 3.407 N/A GLN 863.A NE2 ASN 74.A O no hydrogen 2.668 N/A GLY 865.A N ASN 862.A O no hydrogen 3.126 N/A GLY 865.A N ASN 862.A OD1 no hydrogen 3.270 N/A PHE 868.A N THR 860.A O no hydrogen 2.845 N/A VAL 869.A N ASP 776.A O no hydrogen 2.890 N/A LYS 870.A N LEU 858.A O no hydrogen 2.915 N/A LYS 870.A NZ LEU 90.A O no hydrogen 3.318 N/A LYS 870.A NZ ASN 92.A OD1 no hydrogen 2.704 N/A VAL 871.A N TYR 774.A O no hydrogen 2.856 N/A ARG 872.A N GLN 856.A O no hydrogen 2.854 N/A ARG 872.A NH1 ASN 701.A O no hydrogen 2.960 N/A ARG 872.A NH2 ASN 701.A O no hydrogen 2.611 N/A VAL 873.A N ARG 772.A O no hydrogen 2.905 N/A ARG 874.A N ILE 853.A O no hydrogen 2.637 N/A THR 875.A N PHE 770.A O no hydrogen 2.903 N/A THR 875.A OG1 ASN 851.A O no hydrogen 2.529 N/A THR 876.A OG1 TYR 712.A OH no hydrogen 2.756 N/A LYS 877.A N SER 768.A O no hydrogen 2.777 N/A GLN 880.A N ASP 883.A OD2 no hydrogen 2.765 N/A GLN 880.A NE2 ASP 1005.A OD1 no hydrogen 3.443 N/A ASP 883.A N GLN 880.A O no hydrogen 2.979 N/A LYS 884.A N HIS 1002.A O no hydrogen 3.249 N/A PHE 885.A N GLY 893.A O no hydrogen 2.927 N/A ALA 886.A N GLN 998.A O no hydrogen 2.935 N/A SER 887.A N GLN 891.A O no hydrogen 2.845 N/A ARG 888.A NH1 ILE 670.A O no hydrogen 3.506 N/A ARG 888.A NH1 GLY 719.A O no hydrogen 2.938 N/A ARG 888.A NH2 GLY 719.A O no hydrogen 3.020 N/A ARG 888.A NH2 GLU 933.A OE2 no hydrogen 2.462 N/A HIS 889.A N SER 887.A OG no hydrogen 3.123 N/A HIS 889.A NE2 GLU 933.A OE1 no hydrogen 2.580 N/A GLY 896.A N MET 754.A O no hydrogen 2.843 N/A TYR 899.A N MET 756.A O no hydrogen 3.032 N/A TYR 899.A OH SER 746.A OG no hydrogen 2.863 N/A ARG 900.A NE GLU 902.A OE2 no hydrogen 2.516 N/A ARG 900.A NH2 GLU 902.A OE2 no hydrogen 2.835 N/A ARG 901.A N SER 759.A OG no hydrogen 2.929 N/A GLU 902.A N GLU 902.A OE1 no hydrogen 2.817 N/A MET 904.A N ARG 900.A O no hydrogen 3.129 N/A PHE 906.A N TYR 978.A O no hydrogen 3.329 N/A THR 907.A N ILE 911.A O no hydrogen 3.242 N/A THR 907.A OG1 GLU 975.A OE1 no hydrogen 2.920 N/A THR 907.A OG1 VAL 976.A O no hydrogen 3.550 N/A GLY 910.A N THR 907.A O no hydrogen 2.936 N/A LEU 915.A N ILE 739.A O no hydrogen 2.907 N/A ILE 916.A N ILE 755.A O no hydrogen 2.796 N/A ILE 917.A N ALA 741.A O no hydrogen 2.957 N/A HIS 920.A N ASN 918.A OD1 no hydrogen 2.862 N/A ILE 922.A N PRO 919.A O no hydrogen 2.940 N/A ARG 925.A NH2 ASP 752.A OD1 no hydrogen 3.129 N/A MET 926.A N ILE 922.A O no hydrogen 3.173 N/A THR 927.A OG1 GLN 891.A OE1 no hydrogen 2.642 N/A ALA 929.A N ASN 677.A OD1 no hydrogen 2.610 N/A ILE 932.A N VAL 928.A O no hydrogen 2.972 N/A GLU 933.A N ALA 929.A O no hydrogen 2.781 N/A CYS 934.A N HIS 930.A O no hydrogen 2.987 N/A CYS 934.A SG HIS 930.A O no hydrogen 3.161 N/A CYS 934.A SG THR 995.A OG1 no hydrogen 2.751 N/A LEU 935.A N LEU 931.A O no hydrogen 3.038 N/A LEU 936.A N ILE 932.A O no hydrogen 2.860 N/A SER 937.A N GLU 933.A O no hydrogen 2.847 N/A SER 937.A OG GLU 933.A O no hydrogen 2.642 N/A LYS 938.A N CYS 934.A O no hydrogen 2.970 N/A LYS 938.A NZ GLY 973.A O no hydrogen 3.082 N/A LYS 938.A NZ GLU 975.A OE2 no hydrogen 2.806 N/A LYS 938.A NZ PHE 992.A O no hydrogen 2.646 N/A VAL 939.A N LEU 935.A O no hydrogen 3.031 N/A ALA 940.A N LEU 936.A O no hydrogen 2.835 N/A ALA 941.A N SER 937.A O no hydrogen 2.856 N/A LEU 942.A N LYS 938.A O no hydrogen 3.046 N/A SER 943.A N VAL 939.A O no hydrogen 2.896 N/A SER 943.A OG VAL 939.A O no hydrogen 3.160 N/A SER 943.A OG ALA 940.A O no hydrogen 3.250 N/A GLY 944.A N ALA 940.A O no hydrogen 2.697 N/A ASN 945.A N SER 943.A OG no hydrogen 2.973 N/A GLY 947.A N LEU 718.A O no hydrogen 3.292 N/A ALA 949.A N THR 720.A O no hydrogen 3.206 N/A SER 950.A N ASP 948.A OD1 no hydrogen 3.016 N/A SER 950.A OG ASP 948.A OD1 no hydrogen 2.688 N/A PHE 952.A N ASP 675.A OD2 no hydrogen 2.870 N/A THR 953.A OG1 SER 950.A O no hydrogen 2.606 N/A GLY 959.A N THR 956.A OG1 no hydrogen 3.031 N/A ILE 960.A N THR 956.A O no hydrogen 3.035 N/A SER 961.A N VAL 957.A O no hydrogen 2.874 N/A SER 961.A OG VAL 957.A O no hydrogen 2.866 N/A SER 961.A OG SER 971.A O no hydrogen 2.909 N/A LYS 962.A N GLU 958.A O no hydrogen 2.865 N/A LEU 963.A N GLY 959.A O no hydrogen 2.962 N/A LEU 964.A N ILE 960.A O no hydrogen 2.928 N/A ARG 965.A N SER 961.A O no hydrogen 2.862 N/A GLU 966.A N LYS 962.A O no hydrogen 2.918 N/A HIS 967.A N LEU 963.A O no hydrogen 2.942 N/A GLY 968.A N ARG 965.A O no hydrogen 2.969 N/A TYR 969.A OH GLU 909.A OE1 no hydrogen 2.379 N/A GLY 973.A N GLN 970.A O no hydrogen 2.983 N/A GLU 975.A N ILE 990.A O no hydrogen 2.888 N/A TYR 978.A N PHE 906.A O no hydrogen 3.033 N/A ASN 979.A N LYS 984.A O no hydrogen 2.679 N/A GLY 980.A N TYR 745.A OH no hydrogen 2.509 N/A THR 982.A N ASN 979.A OD1 no hydrogen 2.634 N/A THR 982.A OG1 ASN 979.A OD1 no hydrogen 2.589 N/A GLY 983.A N ASN 979.A O no hydrogen 2.869 N/A LYS 984.A N THR 982.A OG1 no hydrogen 3.009 N/A LEU 986.A N MET 977.A O no hydrogen 2.769 N/A ILE 990.A N GLU 975.A O no hydrogen 3.052 N/A PHE 992.A N GLY 973.A O no hydrogen 3.328 N/A GLY 993.A N VAL 740.A O no hydrogen 2.973 N/A THR 995.A N ALA 738.A O no hydrogen 2.862 N/A THR 995.A OG1 GLY 993.A O no hydrogen 3.528 N/A TYR 996.A OH GLN 715.A O no hydrogen 2.804 N/A TYR 996.A OH GLY 735.A O no hydrogen 2.908 N/A TYR 997.A N GLN 736.A O no hydrogen 2.917 N/A TYR 997.A OH HIS 930.A NE2 no hydrogen 3.362 N/A GLN 998.A N ALA 886.A O no hydrogen 2.884 N/A LEU 1000.A N LYS 884.A O no hydrogen 2.935 N/A VAL 1004.A N ASP 883.A OD1 no hydrogen 3.043 N/A LYS 1007.A N VAL 1004.A O no hydrogen 2.654 N/A ILE 1008.A N VAL 1004.A O no hydrogen 3.040 N/A ARG 1011.A NH1 PRO 1015.A O no hydrogen 3.058 N/A ARG 1011.A NH1 ASP 1030.A O no hydrogen 3.126 N/A ARG 1011.A NH2 PRO 1015.A O no hydrogen 3.559 N/A GLN 1017.A N GLN 1022.A O no hydrogen 2.830 N/A THR 1020.A OG1 GLN 1017.A O no hydrogen 3.525 N/A ARG 1021.A N GLN 1017.A O no hydrogen 2.773 N/A GLN 1022.A N THR 1020.A OG1 no hydrogen 2.976 N/A VAL 1024.A N PRO 1015.A O no hydrogen 3.302 N/A ARG 1027.A NH1 ILE 1008.A O no hydrogen 3.547 N/A ASP 1030.A N ARG 1027.A O no hydrogen 2.692 N/A GLY 1031.A N GLY 1026.A O no hydrogen 2.640 N/A ARG 1040.A N GLY 1036.A O no hydrogen 2.814 N/A ASP 1041.A N GLU 1037.A O no hydrogen 2.908 N/A CYS 1042.A N MET 1038.A O no hydrogen 2.883 N/A CYS 1042.A SG MET 1038.A O no hydrogen 3.190 N/A MET 1043.A N GLU 1039.A O no hydrogen 2.929 N/A ILE 1044.A N ARG 1040.A O no hydrogen 2.903 N/A ALA 1045.A N ASP 1041.A O no hydrogen 2.926 N/A HIS 1046.A N CYS 1042.A O no hydrogen 2.905 N/A GLY 1047.A N MET 1043.A O no hydrogen 2.819 N/A LEU 1052.A N ALA 1048.A O no hydrogen 3.431 N/A LYS 1053.A N ALA 1049.A O no hydrogen 2.914 N/A LYS 1053.A NZ GLU 1058.A OE1 no hydrogen 2.785 N/A LYS 1053.A NZ GLU 1058.A OE2 no hydrogen 3.209 N/A GLU 1054.A N SER 1050.A O no hydrogen 2.851 N/A ARG 1055.A N PHE 1051.A O no hydrogen 2.940 N/A LEU 1056.A N LEU 1052.A O no hydrogen 2.874 N/A MET 1057.A N LYS 1053.A O no hydrogen 2.735 N/A ALA 1059.A N GLU 1054.A O no hydrogen 2.720 N/A PHE 1063.A N ILE 1101.A O no hydrogen 2.917 N/A ARG 1064.A NH1 GLN 1098.A OE1 no hydrogen 2.944 N/A VAL 1065.A N ILE 1099.A O no hydrogen 2.952 N/A ILE 1067.A N TYR 1097.A O no hydrogen 2.878 N/A CYS 1068.A SG CYS 1071.A O no hydrogen 3.236 N/A CYS 1071.A SG LEU 1073.A O no hydrogen 3.830 N/A THR 1075.A N LEU 1073.A O no hydrogen 2.812 N/A ILE 1077.A N GLU 1086.A O no hydrogen 2.864 N/A LYS 1079.A N GLN 1084.A O no hydrogen 2.909 N/A ASN 1083.A N LEU 1080.A O no hydrogen 3.046 N/A GLN 1084.A N LYS 1079.A O no hydrogen 2.941 N/A GLU 1086.A N ILE 1077.A O no hydrogen 2.941 N/A CYS 1087.A SG THR 1075.A OG1 no hydrogen 2.774 N/A CYS 1087.A SG LYS 1088.A O no hydrogen 3.252 N/A CYS 1090.A N LYS 1088.A O no hydrogen 2.645 N/A ASP 1091.A N CYS 1087.A O no hydrogen 2.920 N/A ASP 1095.A N ASN 1092.A OD1 no hydrogen 3.367 N/A TYR 1097.A N ILE 1067.A O no hydrogen 2.929 N/A TYR 1097.A OH ASP 1124.A OD1 no hydrogen 3.206 N/A ILE 1099.A N VAL 1065.A O no hydrogen 2.972 N/A ILE 1101.A N PHE 1063.A O no hydrogen 2.885 N/A TYR 1103.A N ASP 1061.A O no hydrogen 2.507 N/A TYR 1103.A N ASP 1061.A OD1 no hydrogen 3.237 N/A LYS 1106.A N PRO 1102.A O no hydrogen 3.241 N/A LYS 1106.A NZ TYR 1103.A OH no hydrogen 2.610 N/A LEU 1107.A N TYR 1103.A O no hydrogen 2.893 N/A LEU 1108.A N ALA 1104.A O no hydrogen 2.879 N/A PHE 1109.A N ALA 1105.A O no hydrogen 2.880 N/A GLN 1110.A N LYS 1106.A O no hydrogen 2.946 N/A GLU 1111.A N LEU 1107.A O no hydrogen 2.893 N/A LEU 1112.A N LEU 1108.A O no hydrogen 2.829 N/A MET 1113.A N PHE 1109.A O no hydrogen 2.911 N/A ALA 1114.A N GLN 1110.A O no hydrogen 2.896 N/A MET 1115.A N GLU 1111.A O no hydrogen 2.588 N/A ASN 1116.A N MET 1113.A O no hydrogen 3.088 N/A LEU 1121.A N GLY 1072.A O no hydrogen 2.932 N/A THR 1123.A OG1 ASP 1124.A OD1 no hydrogen 3.500 N/A