Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5izr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A N GLN 1.A OE1 no hydrogen 2.759 N/A GLU 3.A N LEU 131.A O no hydrogen 3.021 N/A SER 5.A N GLU 129.A O no hydrogen 3.064 N/A SER 5.A OG GLN 67.A OE1 no hydrogen 2.902 N/A CYS 7.A SG GLU 129.A OE1 no hydrogen 3.887 N/A TRP 8.A N ILE 66.A O no hydrogen 2.898 N/A GLN 9.A N GLU 122.A O no hydrogen 2.828 N/A LEU 10.A N PHE 64.A O no hydrogen 3.290 N/A THR 11.A N LEU 120.A O no hydrogen 3.119 N/A THR 11.A OG1 LEU 120.A O no hydrogen 2.652 N/A VAL 12.A N PHE 62.A O no hydrogen 2.837 N/A ARG 13.A N GLU 118.A O no hydrogen 2.728 N/A VAL 14.A N GLU 60.A O no hydrogen 2.733 N/A LEU 15.A N ASP 116.A O no hydrogen 3.024 N/A ALA 17.A N PRO 56.A O no hydrogen 2.932 N/A ARG 18.A N GLU 114.A O no hydrogen 2.762 N/A ARG 18.A NH1 GLU 16.A OE1 no hydrogen 2.845 N/A ARG 18.A NH1 ASP 116.A OD2 no hydrogen 2.663 N/A ARG 18.A NH2 GLU 114.A OE1 no hydrogen 2.529 N/A ASN 19.A ND2 GLU 112.A O no hydrogen 2.765 N/A LEU 20.A N SER 54.A O no hydrogen 2.720 N/A ARG 21.A N GLU 113.A OE1 no hydrogen 3.443 N/A ARG 21.A NE GLU 113.A OE1 no hydrogen 3.289 N/A ARG 21.A NH2 GLU 113.A OE2 no hydrogen 2.922 N/A ALA 23.A N SER 27.A O no hydrogen 2.888 N/A LEU 25.A N ASP 24.A OD2 no hydrogen 2.688 N/A ASP 30.A N ASP 80.A OD1 no hydrogen 2.878 N/A TYR 32.A N TYR 79.A O no hydrogen 2.969 N/A TYR 32.A OH ASP 86.A OD1 no hydrogen 2.859 N/A VAL 33.A N THR 47.A OG1 no hydrogen 2.723 N/A ILE 34.A N SER 77.A O no hydrogen 2.840 N/A LEU 35.A N PHE 45.A O no hydrogen 3.114 N/A GLN 36.A N GLU 75.A O no hydrogen 3.065 N/A GLN 36.A NE2 GLU 75.A OE1 no hydrogen 3.211 N/A SER 38.A N VAL 73.A O no hydrogen 2.912 N/A SER 38.A OG VAL 73.A O no hydrogen 3.470 N/A THR 39.A OG1 ASN 72.A OD1 no hydrogen 2.545 N/A ALA 40.A N LEU 37.A O no hydrogen 2.815 N/A MET 43.A N ALA 40.A O no hydrogen 2.999 N/A PHE 45.A N LEU 35.A O no hydrogen 3.020 N/A THR 47.A N VAL 33.A O no hydrogen 3.157 N/A THR 47.A OG1 VAL 33.A O no hydrogen 3.385 N/A THR 47.A OG1 LYS 48.A O no hydrogen 3.365 N/A LYS 48.A N GLU 60.A OE2 no hydrogen 2.622 N/A LYS 48.A NZ TRP 58.A O no hydrogen 3.112 N/A THR 49.A OG1 GLU 81.A OE2 no hydrogen 2.886 N/A LEU 50.A N PRO 31.A O no hydrogen 3.093 N/A ASP 52.A N ASP 30.A OD2 no hydrogen 2.916 N/A THR 53.A N ALA 29.A O no hydrogen 2.828 N/A THR 53.A OG1 THR 51.A O no hydrogen 3.223 N/A SER 54.A OG LEU 20.A O no hydrogen 2.628 N/A HIS 55.A ND1 HIS 55.A O no hydrogen 2.729 N/A TRP 58.A N LEU 15.A O no hydrogen 2.865 N/A ASN 59.A N LEU 15.A O no hydrogen 3.122 N/A GLU 60.A N VAL 14.A O no hydrogen 3.063 N/A PHE 62.A N VAL 12.A O no hydrogen 2.693 N/A PHE 64.A N LEU 10.A O no hydrogen 2.860 N/A ILE 66.A N TRP 8.A O no hydrogen 3.104 N/A GLN 67.A NE2 SER 5.A O no hydrogen 3.385 N/A GLN 67.A NE2 GLU 129.A OE1 no hydrogen 3.111 N/A SER 68.A OG GLN 67.A OE1 no hydrogen 3.432 N/A GLN 69.A N GLN 67.A OE1 no hydrogen 3.071 N/A VAL 70.A N GLN 67.A O no hydrogen 3.153 N/A LYS 71.A N LEU 505.A O no hydrogen 2.895 N/A LYS 71.A NZ GLN 507.A O no hydrogen 3.285 N/A ASN 72.A ND2 GLN 67.A O no hydrogen 2.885 N/A VAL 73.A N SER 38.A OG no hydrogen 3.170 N/A LEU 74.A N TYR 94.A O no hydrogen 2.942 N/A GLU 75.A N GLN 36.A O no hydrogen 2.863 N/A LEU 76.A N VAL 92.A O no hydrogen 3.140 N/A SER 77.A N ILE 34.A O no hydrogen 3.154 N/A SER 77.A OG GLU 75.A OE1 no hydrogen 3.495 N/A ILE 78.A N PHE 90.A O no hydrogen 2.799 N/A TYR 79.A N TYR 32.A O no hydrogen 2.675 N/A ASP 80.A N ASP 87.A O no hydrogen 2.967 N/A GLU 81.A N ASP 30.A O no hydrogen 2.858 N/A CYS 89.A N ILE 78.A O no hydrogen 3.115 N/A CYS 89.A SG ILE 78.A O no hydrogen 3.350 N/A PHE 90.A N ILE 78.A O no hydrogen 3.477 N/A VAL 92.A N LEU 76.A O no hydrogen 3.042 N/A TYR 94.A N LEU 74.A O no hydrogen 2.805 N/A TYR 94.A OH GLU 98.A OE2 no hydrogen 3.177 N/A ILE 96.A N ASN 72.A O no hydrogen 3.243 N/A SER 97.A N ASP 95.A OD2 no hydrogen 2.692 N/A SER 97.A OG ASP 95.A OD1 no hydrogen 3.512 N/A SER 97.A OG ASP 95.A OD2 no hydrogen 2.759 N/A SER 97.A OG GLN 507.A OE1 no hydrogen 3.064 N/A GLY 102.A N MET 121.A O no hydrogen 2.750 N/A LEU 105.A N PHE 119.A O no hydrogen 3.051 N/A ARG 106.A NE GLU 118.A OE2 no hydrogen 3.033 N/A ARG 106.A NH2 GLU 118.A OE2 no hydrogen 2.484 N/A LYS 107.A N VAL 117.A O no hydrogen 2.864 N/A LYS 107.A NZ GLU 98.A OE2 no hydrogen 3.126 N/A THR 108.A OG1 ASP 116.A OD1 no hydrogen 2.452 N/A PHE 109.A N LEU 115.A O no hydrogen 2.955 N/A GLU 114.A N ARG 18.A O no hydrogen 3.073 N/A LEU 115.A N PHE 109.A O no hydrogen 3.289 N/A ASP 116.A N GLU 16.A O no hydrogen 2.800 N/A VAL 117.A N LYS 107.A O no hydrogen 3.059 N/A GLU 118.A N ARG 13.A O no hydrogen 2.926 N/A PHE 119.A N LEU 105.A O no hydrogen 3.054 N/A LEU 120.A N THR 11.A O no hydrogen 2.906 N/A GLU 122.A N GLN 9.A O no hydrogen 2.853 N/A THR 124.A OG1 ASP 126.A OD2 no hydrogen 2.597 N/A ARG 127.A NH1 GLU 141.A OE2 no hydrogen 3.304 N/A ARG 127.A NH2 GLU 141.A OE1 no hydrogen 2.627 N/A GLU 129.A N SER 5.A O no hydrogen 2.661 N/A ASN 130.A N GLU 141.A OE2 no hydrogen 2.672 N/A LEU 131.A N GLU 3.A O no hydrogen 2.799 N/A ILE 132.A N ALA 139.A O no hydrogen 3.127 N/A THR 133.A N GLN 1.A O no hydrogen 3.222 N/A THR 133.A OG1 ILE 137.A O no hydrogen 2.765 N/A ASN 134.A N ILE 137.A O no hydrogen 2.791 N/A LYS 135.A N THR 133.A OG1 no hydrogen 3.103 N/A VAL 138.A N GLN 504.A O no hydrogen 2.667 N/A ALA 139.A N ILE 132.A O no hydrogen 2.859 N/A ARG 140.A NE GLU 129.A OE1 no hydrogen 3.059 N/A ARG 140.A NE GLU 129.A OE2 no hydrogen 3.282 N/A ARG 140.A NH1 GLN 504.A OE1 no hydrogen 2.884 N/A ARG 140.A NH2 GLU 129.A OE1 no hydrogen 3.156 N/A GLU 141.A N GLU 129.A OE2 no hydrogen 3.182 N/A SER 143.A N TYR 178.A O no hydrogen 2.912 N/A CYS 144.A N GLU 224.A O no hydrogen 2.864 N/A LEU 145.A N PHE 176.A O no hydrogen 2.903 N/A ASP 146.A N LYS 222.A O no hydrogen 3.044 N/A VAL 147.A N PHE 174.A O no hydrogen 2.864 N/A HIS 148.A N GLN 220.A O no hydrogen 2.881 N/A HIS 148.A NE2 ASP 146.A OD2 no hydrogen 2.425 N/A LEU 152.A N SER 166.A O no hydrogen 2.836 N/A GLU 153.A N ARG 189.A O no hydrogen 2.961 N/A LEU 154.A N GLN 164.A O no hydrogen 2.807 N/A VAL 155.A N SER 187.A O no hydrogen 2.865 N/A LEU 156.A N ASP 162.A O no hydrogen 3.042 N/A SER 159.A OG LEU 156.A O no hydrogen 2.229 N/A SER 159.A OG GLU 161.A O no hydrogen 2.629 N/A TYR 160.A N HIS 177.A O no hydrogen 3.101 N/A GLU 161.A N GLU 161.A OE1 no hydrogen 2.834 N/A GLN 164.A N LEU 154.A O no hydrogen 2.734 N/A GLN 164.A NE2 ARG 175.A O no hydrogen 2.550 N/A SER 166.A N LEU 152.A O no hydrogen 3.089 N/A PHE 174.A N VAL 147.A O no hydrogen 2.997 N/A PHE 176.A N LEU 145.A O no hydrogen 3.229 N/A HIS 177.A N GLU 161.A OE1 no hydrogen 2.936 N/A HIS 177.A ND1 GLU 161.A OE2 no hydrogen 2.550 N/A TYR 178.A N SER 143.A O no hydrogen 3.094 N/A ALA 180.A N GLU 141.A O no hydrogen 3.018 N/A THR 184.A N LEU 196.A O no hydrogen 3.167 N/A THR 184.A OG1 LYS 157.A O no hydrogen 2.846 N/A GLU 185.A N THR 184.A OG1 no hydrogen 2.629 N/A LEU 186.A N VAL 194.A O no hydrogen 2.869 N/A SER 187.A N VAL 155.A O no hydrogen 2.907 N/A GLY 188.A N LEU 192.A O no hydrogen 2.846 N/A ARG 189.A NH2 GLU 153.A OE1 no hydrogen 3.024 N/A LEU 192.A N GLY 188.A O no hydrogen 3.211 N/A VAL 194.A N LEU 186.A O no hydrogen 2.836 N/A LEU 196.A N THR 184.A O no hydrogen 2.540 N/A LEU 199.A N ALA 180.A O no hydrogen 3.322 N/A VAL 205.A N LEU 221.A O no hydrogen 2.794 N/A MET 207.A N LEU 219.A O no hydrogen 3.030 N/A VAL 209.A N VAL 217.A O no hydrogen 2.675 N/A VAL 217.A N VAL 209.A O no hydrogen 3.045 N/A ARG 218.A NH1 ASP 208.A OD2 no hydrogen 2.692 N/A GLN 220.A N HIS 148.A O no hydrogen 3.076 N/A LEU 221.A N VAL 205.A O no hydrogen 2.718 N/A LYS 222.A N ASP 146.A O no hydrogen 3.212 N/A GLU 224.A N CYS 144.A O no hydrogen 2.933 N/A CYS 226.A SG GLU 228.A O no hydrogen 3.238 N/A ALA 231.A N GLY 451.A O no hydrogen 2.906 N/A VAL 232.A N GLY 451.A O no hydrogen 3.306 N/A HIS 233.A N PHE 438.A O no hydrogen 2.810 N/A GLY 235.A N GLY 436.A O no hydrogen 2.793 N/A CYS 239.A SG GLU 429.A OE2 no hydrogen 3.359 N/A GLU 241.A N GLU 241.A OE1 no hydrogen 2.593 N/A GLN 243.A N CYS 239.A O no hydrogen 3.025 N/A ALA 244.A N ALA 240.A O no hydrogen 2.701 N/A PHE 245.A N GLU 241.A O no hydrogen 2.815 N/A LEU 246.A N GLU 242.A O no hydrogen 2.880 N/A SER 247.A OG GLU 269.A OE2 no hydrogen 2.675 N/A ARG 248.A N ALA 244.A O no hydrogen 3.198 N/A ARG 248.A NE LEU 404.A O no hydrogen 3.513 N/A ARG 248.A NH2 LEU 404.A O no hydrogen 3.157 N/A ARG 249.A N PHE 245.A O no hydrogen 2.746 N/A ARG 249.A NE VAL 306.A O no hydrogen 3.067 N/A ARG 249.A NH1 GLY 407.A O no hydrogen 2.919 N/A ARG 249.A NH2 VAL 306.A O no hydrogen 2.959 N/A LYS 250.A N LEU 246.A O no hydrogen 2.737 N/A GLN 251.A N SER 247.A O no hydrogen 3.369 N/A VAL 253.A N ARG 249.A O no hydrogen 3.114 N/A ALA 254.A N LYS 250.A O no hydrogen 3.071 N/A LYS 255.A N GLN 251.A O no hydrogen 2.829 N/A ALA 256.A N VAL 252.A O no hydrogen 2.894 N/A LEU 257.A N VAL 253.A O no hydrogen 2.654 N/A LYS 258.A N ALA 254.A O no hydrogen 3.051 N/A LYS 258.A NZ ASP 266.A OD2 no hydrogen 3.072 N/A ALA 260.A N ALA 256.A O no hydrogen 3.438 N/A LEU 261.A N LEU 257.A O no hydrogen 2.656 N/A GLN 262.A N GLN 259.A O no hydrogen 3.451 N/A LEU 263.A N LYS 258.A O no hydrogen 2.961 N/A GLN 268.A N GLU 271.A OE2 no hydrogen 3.122 N/A GLU 271.A N GLN 268.A O no hydrogen 3.066 N/A VAL 272.A N GLU 269.A O no hydrogen 3.203 N/A VAL 274.A N ASP 537.A OD2 no hydrogen 3.309 N/A GLY 276.A N LEU 538.A O no hydrogen 2.794 N/A ILE 277.A N TYR 308.A O no hydrogen 2.976 N/A MET 278.A N LEU 540.A O no hydrogen 2.903 N/A ALA 279.A N SER 310.A O no hydrogen 3.188 N/A THR 280.A N PHE 542.A O no hydrogen 3.282 N/A THR 280.A OG1 GLY 281.A O no hydrogen 2.949 N/A ARG 285.A NE TYR 633.A O no hydrogen 2.818 N/A ARG 285.A NH1 TYR 544.A O no hydrogen 2.290 N/A ALA 286.A N GLY 282.A O no hydrogen 2.849 N/A MET 287.A N GLY 283.A O no hydrogen 3.157 N/A THR 288.A N ALA 284.A O no hydrogen 3.081 N/A SER 289.A N ARG 285.A O no hydrogen 3.150 N/A SER 289.A OG SER 652.A OG no hydrogen 2.740 N/A LEU 290.A N ALA 286.A O no hydrogen 3.028 N/A TYR 291.A N MET 287.A O no hydrogen 3.209 N/A TYR 291.A OH HIS 321.A ND1 no hydrogen 3.359 N/A GLY 292.A N THR 288.A O no hydrogen 3.172 N/A HIS 293.A N SER 289.A O no hydrogen 2.862 N/A HIS 293.A ND1 TYR 544.A OH no hydrogen 3.127 N/A LEU 294.A N LEU 290.A O no hydrogen 2.797 N/A LEU 295.A N TYR 291.A O no hydrogen 2.805 N/A ALA 296.A N GLY 292.A O no hydrogen 3.059 N/A LEU 297.A N HIS 293.A O no hydrogen 3.067 N/A GLN 298.A N LEU 294.A O no hydrogen 2.816 N/A GLN 298.A NE2 SER 329.A O no hydrogen 3.201 N/A GLN 298.A NE2 ARG 331.A O no hydrogen 2.678 N/A LYS 299.A N LEU 295.A O no hydrogen 3.012 N/A LEU 300.A N ALA 296.A O no hydrogen 2.989 N/A GLY 301.A N GLN 298.A O no hydrogen 2.755 N/A LEU 302.A N LEU 297.A O no hydrogen 2.887 N/A LEU 303.A N LEU 297.A O no hydrogen 2.943 N/A CYS 305.A N LEU 302.A O no hydrogen 2.889 N/A VAL 306.A N LEU 303.A O no hydrogen 3.417 N/A THR 307.A N VAL 275.A O no hydrogen 2.973 N/A TYR 308.A N VAL 275.A O no hydrogen 3.335 N/A TYR 308.A OH GLU 242.A OE2 no hydrogen 3.328 N/A PHE 309.A N LEU 411.A O no hydrogen 2.942 N/A SER 310.A N ILE 277.A O no hydrogen 2.950 N/A SER 310.A OG ILE 277.A O no hydrogen 2.994 N/A SER 310.A OG SER 525.A OG no hydrogen 2.866 N/A GLY 311.A N LEU 413.A O no hydrogen 3.046 N/A SER 315.A OG THR 280.A O no hydrogen 2.266 N/A SER 315.A OG ILE 312.A O no hydrogen 3.459 N/A THR 316.A N SER 313.A O no hydrogen 3.048 N/A THR 316.A OG1 SER 313.A O no hydrogen 2.412 N/A TRP 317.A N GLY 314.A O no hydrogen 2.809 N/A TRP 317.A NE1 SER 470.A OG no hydrogen 3.202 N/A THR 318.A OG1 MET 287.A O no hydrogen 2.670 N/A MET 319.A N SER 315.A O no hydrogen 2.999 N/A ALA 320.A N THR 316.A O no hydrogen 2.711 N/A HIS 321.A N TRP 317.A O no hydrogen 3.224 N/A LEU 322.A N THR 318.A O no hydrogen 3.222 N/A TYR 323.A N MET 319.A O no hydrogen 3.075 N/A TYR 323.A OH PRO 410.A O no hydrogen 2.373 N/A GLY 324.A N HIS 321.A O no hydrogen 3.136 N/A GLU 327.A N ASP 325.A OD1 no hydrogen 2.988 N/A TRP 328.A N ASP 325.A O no hydrogen 3.278 N/A SER 329.A N ASN 409.A OD1 no hydrogen 3.066 N/A SER 329.A OG GLN 408.A O no hydrogen 2.672 N/A SER 329.A OG ASN 409.A OD1 no hydrogen 2.816 N/A GLN 330.A N GLU 327.A O no hydrogen 3.128 N/A GLN 330.A NE2 ASP 304.A OD2 no hydrogen 3.315 N/A GLN 330.A NE2 GLN 408.A O no hydrogen 3.584 N/A ARG 331.A N GLU 327.A O no hydrogen 3.271 N/A GLU 334.A N ASP 332.A OD2 no hydrogen 2.670 N/A ILE 337.A N LEU 333.A O no hydrogen 3.073 N/A ARG 338.A N GLU 334.A O no hydrogen 3.341 N/A ARG 338.A NE GLU 342.A OE2 no hydrogen 2.903 N/A TYR 339.A N GLY 335.A O no hydrogen 3.144 N/A TYR 339.A OH HIS 389.A ND1 no hydrogen 3.031 N/A ALA 340.A N PRO 336.A O no hydrogen 2.922 N/A ARG 341.A N ILE 337.A O no hydrogen 2.819 N/A ARG 341.A NE GLU 646.A OE2 no hydrogen 3.001 N/A ARG 341.A NH2 GLU 646.A OE2 no hydrogen 2.695 N/A GLU 342.A N ARG 338.A O no hydrogen 2.966 N/A HIS 343.A N TYR 339.A O no hydrogen 3.178 N/A HIS 343.A ND1 TYR 339.A O no hydrogen 2.712 N/A LEU 344.A N ALA 340.A O no hydrogen 2.860 N/A ALA 345.A N ARG 341.A O no hydrogen 2.908 N/A LYS 346.A N GLU 342.A O no hydrogen 2.881 N/A LYS 348.A NZ LYS 346.A O no hydrogen 3.257 N/A LYS 348.A NZ MET 387.A O no hydrogen 3.499 N/A SER 353.A N GLU 350.A O no hydrogen 2.936 N/A SER 353.A OG GLU 350.A O no hydrogen 2.679 N/A ARG 356.A N SER 353.A O no hydrogen 2.868 N/A LEU 357.A N SER 353.A O no hydrogen 3.158 N/A ALA 358.A N PRO 354.A O no hydrogen 3.198 N/A SER 359.A OG ARG 356.A O no hydrogen 2.502 N/A TYR 360.A N ARG 356.A O no hydrogen 3.011 N/A TYR 360.A OH SER 386.A OG no hydrogen 2.805 N/A ARG 361.A N LEU 357.A O no hydrogen 3.054 N/A ARG 361.A NH1 GLU 365.A OE1 no hydrogen 3.541 N/A ARG 361.A NH2 GLU 365.A OE1 no hydrogen 3.299 N/A ARG 362.A N ALA 358.A O no hydrogen 2.775 N/A GLU 363.A N SER 359.A O no hydrogen 3.079 N/A LEU 364.A N TYR 360.A O no hydrogen 2.702 N/A GLU 365.A N ARG 361.A O no hydrogen 2.756 N/A LEU 366.A N ARG 362.A O no hydrogen 3.081 N/A ARG 367.A N GLU 363.A O no hydrogen 2.824 N/A ALA 368.A N LEU 364.A O no hydrogen 2.567 N/A GLU 369.A N GLU 365.A O no hydrogen 2.884 N/A GLN 370.A N LEU 366.A O no hydrogen 3.469 N/A ASP 378.A N THR 375.A O no hydrogen 3.197 N/A ASP 378.A N THR 375.A OG1 no hydrogen 3.317 N/A LEU 379.A N PHE 376.A O no hydrogen 2.889 N/A TRP 380.A N PHE 376.A O no hydrogen 2.971 N/A TRP 380.A NE1 SER 470.A O no hydrogen 3.025 N/A ALA 381.A N VAL 377.A O no hydrogen 2.897 N/A LEU 382.A N ASP 378.A O no hydrogen 3.373 N/A VAL 383.A N LEU 379.A O no hydrogen 2.930 N/A LEU 384.A N TRP 380.A O no hydrogen 2.971 N/A GLU 385.A N ALA 381.A O no hydrogen 2.950 N/A SER 386.A N LEU 382.A O no hydrogen 3.096 N/A SER 386.A OG TYR 360.A OH no hydrogen 2.805 N/A MET 387.A N VAL 383.A O no hydrogen 2.858 N/A LEU 388.A N LEU 384.A O no hydrogen 2.854 N/A HIS 389.A N GLU 385.A O no hydrogen 3.022 N/A HIS 389.A ND1 TYR 339.A OH no hydrogen 3.031 N/A MET 393.A N GLU 385.A OE2 no hydrogen 3.021 N/A GLN 395.A N MET 393.A O no hydrogen 3.073 N/A SER 398.A N GLU 459.A OE2 no hydrogen 3.131 N/A SER 398.A OG GLU 459.A OE1 no hydrogen 2.538 N/A SER 398.A OG GLU 459.A OE2 no hydrogen 3.110 N/A GLN 400.A N LEU 397.A O no hydrogen 3.115 N/A ARG 401.A N SER 398.A O no hydrogen 2.934 N/A ARG 401.A NE PRO 427.A O no hydrogen 3.071 N/A ALA 402.A N GLY 399.A O no hydrogen 3.251 N/A ALA 403.A N GLN 400.A O no hydrogen 3.101 N/A LEU 404.A N ARG 401.A O no hydrogen 3.004 N/A GLU 405.A N ALA 402.A O no hydrogen 3.494 N/A ARG 406.A N GLN 408.A OE1 no hydrogen 2.849 N/A GLY 407.A N LEU 404.A O no hydrogen 2.968 N/A GLN 408.A N GLN 408.A OE1 no hydrogen 2.620 N/A GLN 408.A NE2 PRO 326.A O no hydrogen 3.167 N/A GLN 408.A NE2 ALA 402.A O no hydrogen 2.657 N/A ASN 409.A ND2 PRO 326.A O no hydrogen 3.041 N/A ASN 409.A ND2 ALA 403.A O no hydrogen 2.787 N/A LEU 411.A N THR 307.A O no hydrogen 2.843 N/A LEU 413.A N PHE 309.A O no hydrogen 2.861 N/A TYR 414.A N PHE 425.A O no hydrogen 2.892 N/A TYR 414.A OH GLN 400.A OE1 no hydrogen 2.727 N/A LEU 415.A N GLY 311.A O no hydrogen 2.998 N/A SER 416.A N VAL 423.A O no hydrogen 2.798 N/A SER 416.A OG ILE 468.A O no hydrogen 3.380 N/A ASN 418.A N GLU 421.A O no hydrogen 2.921 N/A ASN 418.A ND2 GLU 421.A OE2 no hydrogen 3.446 N/A VAL 423.A N SER 416.A O no hydrogen 2.784 N/A GLU 424.A N GLY 431.A O no hydrogen 3.071 N/A PHE 425.A N TYR 414.A O no hydrogen 2.836 N/A SER 426.A N GLU 429.A O no hydrogen 2.703 N/A SER 426.A OG GLU 429.A O no hydrogen 2.861 N/A GLU 429.A N SER 426.A OG no hydrogen 3.176 N/A VAL 430.A N VAL 439.A O no hydrogen 2.574 N/A GLY 431.A N GLU 424.A O no hydrogen 3.008 N/A PHE 432.A N ALA 437.A O no hydrogen 3.063 N/A LEU 433.A N TRP 422.A O no hydrogen 3.293 N/A TYR 435.A OH GLU 421.A OE1 no hydrogen 3.395 N/A ALA 437.A N PHE 432.A O no hydrogen 3.428 N/A PHE 438.A N HIS 233.A O no hydrogen 2.992 N/A VAL 439.A N VAL 430.A O no hydrogen 2.800 N/A GLU 442.A N GLU 442.A OE1 no hydrogen 3.218 N/A LEU 443.A N PRO 440.A O no hydrogen 3.124 N/A SER 446.A N LEU 443.A O no hydrogen 2.758 N/A SER 446.A OG LEU 443.A O no hydrogen 2.824 N/A GLU 447.A N ARG 455.A O no hydrogen 3.061 N/A PHE 449.A N ARG 452.A O no hydrogen 2.770 N/A MET 450.A N GLN 501.A O no hydrogen 2.962 N/A ARG 452.A N PHE 449.A O no hydrogen 2.776 N/A MET 454.A N GLU 447.A O no hydrogen 2.900 N/A ARG 455.A N GLU 447.A O no hydrogen 3.357 N/A ILE 457.A N SER 446.A OG no hydrogen 3.280 N/A ARG 461.A NH2 GLU 363.A OE2 no hydrogen 3.418 N/A ILE 462.A N GLN 395.A O no hydrogen 2.811 N/A CYS 463.A SG ALA 381.A O no hydrogen 3.600 N/A PHE 464.A N ARG 461.A O no hydrogen 3.060 N/A GLU 466.A N ILE 462.A O no hydrogen 2.931 N/A ALA 467.A N CYS 463.A O no hydrogen 3.086 N/A ILE 468.A N PHE 464.A O no hydrogen 3.381 N/A TRP 469.A N LEU 465.A O no hydrogen 2.904 N/A SER 470.A N ALA 467.A O no hydrogen 3.277 N/A SER 470.A OG GLU 466.A O no hydrogen 2.425 N/A ASN 471.A ND2 PHE 473.A O no hydrogen 3.373 N/A PHE 473.A N ASN 471.A OD1 no hydrogen 2.790 N/A SER 474.A N LEU 513.A O no hydrogen 3.256 N/A SER 474.A OG ARG 512.A O no hydrogen 2.807 N/A SER 474.A OG LEU 513.A O no hydrogen 3.281 N/A ASN 476.A N SER 474.A OG no hydrogen 3.112 N/A THR 485.A OG1 LEU 481.A O no hydrogen 3.518 N/A THR 485.A OG1 GLN 482.A O no hydrogen 2.569 N/A ALA 486.A N GLN 482.A O no hydrogen 2.908 N/A LEU 487.A N PRO 483.A O no hydrogen 2.754 N/A ALA 488.A N GLY 484.A O no hydrogen 2.980 N/A GLN 489.A N THR 485.A O no hydrogen 3.168 N/A ALA 490.A N ALA 486.A O no hydrogen 3.190 N/A PHE 491.A N LEU 487.A O no hydrogen 2.986 N/A GLN 501.A N ASN 498.A O no hydrogen 3.384 N/A LEU 503.A N LEU 500.A O no hydrogen 2.789 N/A GLN 504.A N VAL 138.A O no hydrogen 2.885 N/A HIS 506.A N VAL 136.A O no hydrogen 3.128 N/A GLN 507.A N GLN 69.A O no hydrogen 2.743 N/A GLN 507.A NE2 GLN 507.A O no hydrogen 3.290 N/A LEU 515.A N ILE 472.A O no hydrogen 2.937 N/A TYR 520.A N ASP 517.A O no hydrogen 3.369 N/A PHE 521.A N ALA 518.A O no hydrogen 3.096 N/A ILE 522.A N ALA 518.A O no hydrogen 3.017 N/A SER 525.A OG ALA 279.A O no hydrogen 2.855 N/A SER 525.A OG SER 310.A OG no hydrogen 2.866 N/A SER 526.A OG THR 556.A OG1 no hydrogen 2.642 N/A PHE 530.A N PRO 527.A O no hydrogen 3.256 N/A ARG 531.A NH1 GLU 424.A OE2 no hydrogen 2.980 N/A ARG 531.A NH2 GLU 429.A OE2 no hydrogen 2.854 N/A ARG 534.A N ARG 531.A O no hydrogen 3.289 N/A ARG 534.A NE GLU 242.A OE2 no hydrogen 2.910 N/A ARG 534.A NH1 GLU 424.A OE1 no hydrogen 2.543 N/A ARG 534.A NH1 SER 528.A O no hydrogen 2.677 N/A ARG 534.A NH2 GLU 242.A OE1 no hydrogen 3.334 N/A ARG 534.A NH2 GLU 242.A OE2 no hydrogen 3.235 N/A ARG 534.A NH2 GLU 424.A OE1 no hydrogen 3.176 N/A ARG 534.A NH2 GLU 424.A OE2 no hydrogen 3.359 N/A ASP 537.A N VAL 274.A O no hydrogen 2.815 N/A LEU 538.A N VAL 274.A O no hydrogen 3.126 N/A ILE 539.A N ILE 593.A O no hydrogen 2.909 N/A LEU 540.A N GLY 276.A O no hydrogen 2.794 N/A SER 541.A N LEU 595.A O no hydrogen 2.782 N/A SER 541.A OG HIS 596.A ND1 no hydrogen 3.082 N/A PHE 542.A N MET 278.A O no hydrogen 3.088 N/A ASP 543.A N PHE 597.A O no hydrogen 3.212 N/A TYR 544.A N THR 280.A OG1 no hydrogen 3.277 N/A TYR 544.A OH HIS 293.A ND1 no hydrogen 3.127 N/A SER 545.A N ASP 543.A OD2 no hydrogen 2.984 N/A SER 545.A OG SER 547.A O no hydrogen 2.363 N/A GLN 554.A N PHE 550.A O no hydrogen 3.050 N/A GLN 555.A N GLU 551.A O no hydrogen 2.897 N/A GLN 555.A NE2 GLU 551.A OE1 no hydrogen 3.040 N/A THR 556.A N ALA 552.A O no hydrogen 3.214 N/A THR 556.A OG1 SER 526.A OG no hydrogen 2.642 N/A THR 556.A OG1 ALA 552.A O no hydrogen 2.901 N/A GLU 557.A N LEU 553.A O no hydrogen 2.876 N/A LEU 558.A N GLN 554.A O no hydrogen 2.926 N/A TYR 559.A N GLN 555.A O no hydrogen 2.800 N/A CYS 560.A N THR 556.A O no hydrogen 2.854 N/A CYS 560.A SG THR 556.A O no hydrogen 3.487 N/A ARG 561.A N GLU 557.A O no hydrogen 2.727 N/A ALA 562.A N LEU 558.A O no hydrogen 2.891 N/A ARG 563.A N CYS 560.A O no hydrogen 3.141 N/A ARG 563.A NH1 TYR 559.A O no hydrogen 2.997 N/A GLY 564.A N ARG 561.A O no hydrogen 3.520 N/A LEU 565.A N CYS 560.A O no hydrogen 3.024 N/A ARG 569.A NH1 GLU 571.A OE1 no hydrogen 3.337 N/A VAL 570.A N GLU 557.A OE2 no hydrogen 3.248 N/A SER 573.A N ASP 576.A OD2 no hydrogen 3.343 N/A ASP 576.A N SER 573.A O no hydrogen 2.760 N/A GLN 577.A N SER 573.A O no hydrogen 3.334 N/A HIS 578.A N PRO 574.A O no hydrogen 3.397 N/A HIS 578.A ND1 PRO 574.A O no hydrogen 2.883 N/A GLN 579.A N GLN 575.A O no hydrogen 3.240 N/A GLN 579.A NE2 GLN 575.A OE1 no hydrogen 2.990 N/A ARG 581.A N HIS 584.A NE2 no hydrogen 3.363 N/A GLU 582.A N GLU 582.A OE1 no hydrogen 3.080 N/A HIS 584.A N HIS 596.A O no hydrogen 2.855 N/A PHE 586.A N LEU 594.A O no hydrogen 3.013 N/A GLU 590.A N CYS 588.A O no hydrogen 2.453 N/A ALA 591.A N CYS 588.A O no hydrogen 3.165 N/A ILE 593.A N ASP 537.A O no hydrogen 3.005 N/A LEU 595.A N ILE 539.A O no hydrogen 3.021 N/A HIS 596.A N HIS 584.A O no hydrogen 2.899 N/A HIS 596.A ND1 SER 541.A OG no hydrogen 3.082 N/A HIS 596.A NE2 PRO 549.A O no hydrogen 2.639 N/A PHE 597.A N SER 541.A O no hydrogen 2.725 N/A ASN 601.A ND2 GLY 622.A O no hydrogen 3.002 N/A SER 603.A N GLU 582.A OE2 no hydrogen 2.654 N/A SER 603.A OG GLU 582.A OE2 no hydrogen 2.756 N/A SER 603.A OG TYR 654.A OH no hydrogen 2.547 N/A HIS 607.A ND1 ASP 606.A OD1 no hydrogen 2.910 N/A SER 608.A N VAL 612.A O no hydrogen 3.230 N/A VAL 612.A N ALA 609.A O no hydrogen 2.896 N/A ARG 614.A N ASP 606.A O no hydrogen 2.858 N/A ARG 614.A NE PHE 604.A O no hydrogen 3.171 N/A ARG 614.A NH1 GLU 618.A O no hydrogen 2.794 N/A ARG 614.A NH2 PHE 604.A O no hydrogen 3.038 N/A ARG 614.A NH2 HIS 607.A O no hydrogen 2.921 N/A ALA 617.A N SER 615.A OG no hydrogen 3.052 N/A GLU 618.A N SER 615.A OG no hydrogen 3.277 N/A GLY 621.A N GLU 618.A O no hydrogen 2.893 N/A GLY 622.A N LEU 619.A O no hydrogen 2.955 N/A GLN 623.A N GLN 620.A O no hydrogen 3.258 N/A THR 630.A OG1 ALA 629.A O no hydrogen 2.670 N/A CYS 631.A SG ASP 625.A O no hydrogen 2.797 N/A TYR 633.A OH ASP 644.A O no hydrogen 2.859 N/A ASN 637.A N THR 634.A O no hydrogen 3.346 N/A ASN 637.A ND2 PRO 632.A O no hydrogen 2.655 N/A ASN 637.A ND2 THR 639.A O no hydrogen 3.122 N/A THR 639.A N ASN 637.A OD1 no hydrogen 3.104 N/A TYR 640.A N LEU 344.A O no hydrogen 3.082 N/A PHE 645.A N LYS 641.A O no hydrogen 2.974 N/A GLU 646.A N GLU 642.A O no hydrogen 3.239 N/A ARG 647.A N GLU 643.A O no hydrogen 3.308 N/A ARG 647.A NH1 GLN 623.A O no hydrogen 3.107 N/A LEU 648.A N ASP 644.A O no hydrogen 3.446 N/A LEU 649.A N PHE 645.A O no hydrogen 3.068 N/A ARG 650.A N GLU 646.A O no hydrogen 2.833 N/A LEU 651.A N ARG 647.A O no hydrogen 2.801 N/A SER 652.A N LEU 648.A O no hydrogen 2.987 N/A SER 652.A OG SER 289.A OG no hydrogen 2.740 N/A SER 652.A OG LEU 648.A O no hydrogen 2.661 N/A ASP 653.A N LEU 649.A O no hydrogen 2.855 N/A TYR 654.A N ARG 650.A O no hydrogen 2.757 N/A TYR 654.A OH SER 603.A OG no hydrogen 2.547 N/A ASN 655.A N LEU 651.A O no hydrogen 2.790 N/A ASN 655.A ND2 VAL 600.A O no hydrogen 3.053 N/A VAL 656.A N SER 652.A O no hydrogen 3.278 N/A GLN 657.A N ASP 653.A O no hydrogen 3.016 N/A THR 658.A N TYR 654.A O no hydrogen 2.727 N/A SER 659.A N VAL 656.A O no hydrogen 2.851 N/A SER 659.A OG ASN 655.A O no hydrogen 2.603 N/A GLN 660.A N GLN 657.A O no hydrogen 2.735 N/A ILE 663.A N SER 659.A O no hydrogen 3.368 N/A LEU 664.A N GLN 660.A O no hydrogen 3.004 N/A GLN 665.A N GLY 661.A O no hydrogen 2.829 N/A ALA 666.A N ALA 662.A O no hydrogen 2.833 N/A LEU 667.A N ILE 663.A O no hydrogen 2.774 N/A ARG 668.A N LEU 664.A O no hydrogen 2.947 N/A THR 669.A N GLN 665.A O no hydrogen 3.139 N/A THR 669.A OG1 GLN 665.A O no hydrogen 2.735 N/A ALA 670.A N ALA 666.A O no hydrogen 2.853 N/A LEU 671.A N LEU 667.A O no hydrogen 3.020 N/A LYS 672.A N ARG 668.A O no hydrogen 3.286 N/A HIS 673.A N THR 669.A O no hydrogen 3.181 N/A ARG 674.A N LEU 671.A O no hydrogen 3.205 N/A