Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6rxv_UV.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N ARG 1.A O no hydrogen 2.874 N/A VAL 6.A N ALA 2.A O no hydrogen 2.947 N/A LEU 7.A N ARG 3.A O no hydrogen 2.927 N/A GLU 8.A N ALA 4.A O no hydrogen 2.944 N/A THR 9.A N PHE 5.A O no hydrogen 2.885 N/A THR 9.A OG1 PHE 5.A O no hydrogen 2.538 N/A GLU 10.A N VAL 6.A O no hydrogen 2.924 N/A GLU 11.A N LEU 7.A O no hydrogen 2.925 N/A MET 12.A N GLU 8.A O no hydrogen 2.886 N/A LEU 13.A N THR 9.A O no hydrogen 2.931 N/A ASP 14.A N GLU 10.A O no hydrogen 2.876 N/A SER 15.A N GLU 11.A O no hydrogen 2.914 N/A VAL 16.A N MET 12.A O no hydrogen 2.864 N/A ASP 19.A N GLU 22.A OE2 no hydrogen 3.188 N/A SER 21.A N ASP 19.A OD2 no hydrogen 2.959 N/A SER 21.A OG ASP 19.A OD2 no hydrogen 3.076 N/A ALA 23.A N ASP 19.A O no hydrogen 3.039 N/A PHE 24.A N TYR 20.A O no hydrogen 2.798 N/A ALA 27.A N ALA 23.A O no hydrogen 2.977 N/A ASP 28.A N ALA 23.A O no hydrogen 3.479 N/A ALA 29.A N ASP 25.A O no hydrogen 2.836 N/A LEU 30.A N GLY 26.A O no hydrogen 3.087 N/A LEU 31.A N ALA 27.A O no hydrogen 2.848 N/A HIS 32.A N ASP 28.A O no hydrogen 2.853 N/A ARG 33.A N ALA 29.A O no hydrogen 2.981 N/A LEU 34.A N LEU 30.A O no hydrogen 2.877 N/A LYS 35.A N LEU 31.A O no hydrogen 2.874 N/A GLY 36.A N HIS 32.A O no hydrogen 2.937 N/A SER 37.A N ARG 33.A O no hydrogen 2.911 N/A SER 37.A OG ARG 33.A O no hydrogen 2.994 N/A ILE 38.A N LEU 34.A O no hydrogen 2.902 N/A GLU 39.A N LYS 35.A O no hydrogen 2.888 N/A THR 40.A N GLY 36.A O no hydrogen 2.924 N/A ILE 41.A N SER 37.A O no hydrogen 2.957 N/A HIS 44.A N PHE 81.A O no hydrogen 2.547 N/A GLN 47.A N VAL 79.A O no hydrogen 2.664 N/A GLN 47.A NE2 ASP 45.A OD1 no hydrogen 3.136 N/A ALA 52.A N PRO 48.A O no hydrogen 2.920 N/A ALA 53.A N LEU 49.A O no hydrogen 2.905 N/A ALA 54.A N LEU 50.A O no hydrogen 2.879 N/A LYS 55.A N ASP 51.A O no hydrogen 2.874 N/A LYS 55.A N ALA 52.A O no hydrogen 3.260 N/A LEU 56.A N ALA 52.A O no hydrogen 2.950 N/A GLU 57.A N ALA 53.A O no hydrogen 2.885 N/A LYS 61.A NZ ALA 137.A O no hydrogen 3.260 N/A LYS 61.A NZ TYR 155.A OH no hydrogen 2.625 N/A LYS 63.A NZ TYR 130.A OH no hydrogen 2.583 N/A ASN 74.A N PRO 71.A O no hydrogen 3.078 N/A SER 75.A N PRO 71.A O no hydrogen 2.961 N/A SER 75.A OG SER 75.A O no hydrogen 2.358 N/A VAL 79.A N GLN 47.A O no hydrogen 2.566 N/A PHE 81.A N HIS 44.A O no hydrogen 3.202 N/A GLN 86.A N VAL 112.A O no hydrogen 2.997 N/A ASN 88.A N ILE 110.A O no hydrogen 2.966 N/A VAL 90.A N ASP 108.A O no hydrogen 2.875 N/A LYS 96.A N TYR 93.A O no hydrogen 2.930 N/A LYS 96.A NZ TYR 93.A O no hydrogen 3.487 N/A THR 97.A OG1 THR 97.A O no hydrogen 2.572 N/A THR 97.A OG1 ARG 264.A O no hydrogen 2.820 N/A ARG 100.A N VAL 16.A O no hydrogen 2.700 N/A ASP 108.A N VAL 90.A O no hydrogen 2.936 N/A MET 109.A N ARG 192.A O no hydrogen 2.580 N/A ILE 110.A N ASN 88.A O no hydrogen 2.933 N/A VAL 111.A N ILE 194.A O no hydrogen 2.990 N/A VAL 112.A N GLN 86.A O no hydrogen 2.865 N/A LEU 113.A N CYS 196.A O no hydrogen 3.033 N/A GLN 119.A N ASP 122.A OD2 no hydrogen 2.939 N/A ASP 122.A N GLN 119.A O no hydrogen 2.928 N/A LEU 124.A N LYS 121.A O no hydrogen 2.969 N/A ASP 125.A N LEU 213.A O no hydrogen 3.289 N/A LEU 126.A N TYR 236.A OH no hydrogen 3.300 N/A TYR 128.A N ASP 122.A O no hydrogen 2.915 N/A TYR 128.A OH GLU 243.A OE1 no hydrogen 2.295 N/A TYR 130.A N LEU 126.A O no hydrogen 3.031 N/A LYS 131.A N ARG 127.A O no hydrogen 2.961 N/A LYS 131.A NZ ASP 122.A OD2 no hydrogen 2.721 N/A ARG 132.A N TYR 128.A O no hydrogen 2.844 N/A ARG 132.A NE PRO 195.A O no hydrogen 3.063 N/A ARG 132.A NH1 PRO 165.A O no hydrogen 2.354 N/A ARG 132.A NH2 PRO 165.A O no hydrogen 3.111 N/A ARG 132.A NH2 PRO 195.A O no hydrogen 3.108 N/A ALA 133.A N PHE 129.A O no hydrogen 2.945 N/A TYR 134.A N TYR 130.A O no hydrogen 2.984 N/A TYR 135.A N LYS 131.A O no hydrogen 2.910 N/A LEU 136.A N ARG 132.A O no hydrogen 2.951 N/A ALA 137.A N ALA 133.A O no hydrogen 2.939 N/A VAL 138.A N TYR 134.A O no hydrogen 3.003 N/A VAL 139.A N TYR 135.A O no hydrogen 2.934 N/A ALA 140.A N LEU 136.A O no hydrogen 2.925 N/A ALA 141.A N ALA 137.A O no hydrogen 2.941 N/A HIS 142.A N VAL 138.A O no hydrogen 2.986 N/A HIS 142.A ND1 HIS 142.A O no hydrogen 2.914 N/A LEU 143.A N VAL 139.A O no hydrogen 2.864 N/A GLN 144.A N ALA 140.A O no hydrogen 2.946 N/A LYS 145.A N ALA 141.A O no hydrogen 2.943 N/A ASP 146.A N HIS 142.A O no hydrogen 2.867 N/A LEU 147.A N LEU 143.A O no hydrogen 2.826 N/A THR 152.A N LYS 170.A O no hydrogen 3.338 N/A SER 154.A N SER 168.A O no hydrogen 3.023 N/A SER 154.A OG LEU 153.A O no hydrogen 2.882 N/A TYR 155.A N TRP 484.A O no hydrogen 3.194 N/A GLU 156.A N VAL 166.A O no hydrogen 3.314 N/A HIS 158.A N LEU 164.A O no hydrogen 3.427 N/A HIS 158.A NE2 ASP 108.A OD2 no hydrogen 2.355 N/A ASN 161.A N HIS 158.A O no hydrogen 3.185 N/A SER 162.A OG HIS 442.A ND1 no hydrogen 3.044 N/A LEU 164.A N ASN 161.A O no hydrogen 3.427 N/A VAL 166.A N GLU 156.A O no hydrogen 2.981 N/A LEU 167.A N ILE 193.A O no hydrogen 2.934 N/A SER 168.A N SER 154.A O no hydrogen 2.850 N/A SER 168.A OG GLU 156.A OE1 no hydrogen 2.777 N/A VAL 169.A N ILE 191.A O no hydrogen 2.918 N/A LYS 170.A N THR 152.A O no hydrogen 2.865 N/A LYS 170.A NZ TYR 189.A OH no hydrogen 3.314 N/A LYS 175.A N LYS 180.A O no hydrogen 3.182 N/A LYS 182.A N GLY 173.A O no hydrogen 2.864 N/A LYS 182.A NZ GLU 174.A OE1 no hydrogen 3.316 N/A ILE 191.A N VAL 169.A O no hydrogen 2.907 N/A ARG 192.A N ILE 107.A O no hydrogen 3.065 N/A ILE 193.A N LEU 167.A O no hydrogen 2.890 N/A ILE 194.A N MET 109.A O no hydrogen 2.902 N/A CYS 196.A N VAL 111.A O no hydrogen 3.142 N/A CYS 196.A SG ILE 194.A O no hydrogen 4.025 N/A ARG 204.A NE SER 200.A OG no hydrogen 3.315 N/A ARG 204.A NH2 ARG 365.A O no hydrogen 3.163 N/A LYS 206.A NZ TYR 123.A OH no hydrogen 2.446 N/A LEU 207.A N PRO 203.A O no hydrogen 2.894 N/A ARG 215.A N ASP 125.A OD2 no hydrogen 3.083 N/A LYS 218.A NZ ARG 215.A O no hydrogen 2.789 N/A GLN 222.A NE2 GLU 221.A OE1 no hydrogen 2.638 N/A THR 233.A N ALA 211.A O no hydrogen 3.418 N/A THR 233.A OG1 PRO 231.A O no hydrogen 3.430 N/A TYR 236.A OH TYR 123.A O no hydrogen 3.109 N/A ASN 237.A N THR 233.A O no hydrogen 3.024 N/A ASN 237.A ND2 HIS 208.A O no hydrogen 2.835 N/A ASN 237.A ND2 ALA 211.A O no hydrogen 2.657 N/A SER 238.A N PRO 234.A O no hydrogen 2.897 N/A SER 238.A OG PRO 234.A O no hydrogen 2.339 N/A SER 238.A OG ASN 368.A OD1 no hydrogen 2.490 N/A THR 239.A N PHE 235.A O no hydrogen 2.856 N/A THR 239.A OG1 TYR 236.A O no hydrogen 2.508 N/A LEU 240.A N TYR 236.A O no hydrogen 3.052 N/A VAL 241.A N ASN 237.A O no hydrogen 2.975 N/A ALA 242.A N SER 238.A O no hydrogen 2.814 N/A GLU 243.A N THR 239.A O no hydrogen 2.977 N/A SER 244.A N LEU 240.A O no hydrogen 2.963 N/A SER 244.A OG LEU 240.A O no hydrogen 2.475 N/A SER 245.A N VAL 241.A O no hydrogen 2.885 N/A SER 245.A N ALA 242.A O no hydrogen 3.308 N/A SER 245.A OG VAL 241.A O no hydrogen 3.202 N/A TYR 249.A OH ASP 362.A OD1 no hydrogen 3.048 N/A LEU 250.A N TYR 246.A O no hydrogen 3.112 N/A LYS 251.A N LEU 247.A O no hydrogen 2.987 N/A LYS 251.A NZ LYS 251.A O no hydrogen 2.806 N/A LEU 252.A N GLN 248.A O no hydrogen 2.844 N/A LEU 253.A N TYR 249.A O no hydrogen 2.917 N/A ARG 254.A N LEU 250.A O no hydrogen 2.870 N/A GLN 255.A N LYS 251.A O no hydrogen 2.941 N/A THR 256.A N LEU 252.A O no hydrogen 2.968 N/A THR 256.A OG1 LEU 252.A O no hydrogen 3.418 N/A THR 256.A OG1 LEU 253.A O no hydrogen 2.970 N/A GLU 257.A N LEU 253.A O no hydrogen 2.877 N/A LYS 258.A N ARG 254.A O no hydrogen 2.923 N/A LYS 259.A N GLN 255.A O no hydrogen 2.904 N/A CYS 260.A N THR 256.A O no hydrogen 2.929 N/A CYS 260.A SG PRO 316.A O no hydrogen 3.980 N/A ALA 261.A N PRO 316.A O no hydrogen 3.406 N/A ARG 264.A NE ASN 265.A OD1 no hydrogen 3.303 N/A ALA 266.A N ALA 262.A O no hydrogen 2.964 N/A CYS 267.A N PHE 263.A O no hydrogen 3.001 N/A CYS 267.A SG PHE 263.A O no hydrogen 3.185 N/A ILE 268.A N ARG 264.A O no hydrogen 2.923 N/A LEU 269.A N ASN 265.A O no hydrogen 2.937 N/A GLY 270.A N ALA 266.A O no hydrogen 2.974 N/A ARG 271.A N CYS 267.A O no hydrogen 2.869 N/A ILE 272.A N ILE 268.A O no hydrogen 3.021 N/A TRP 273.A N LEU 269.A O no hydrogen 2.926 N/A LEU 274.A N GLY 270.A O no hydrogen 2.906 N/A GLN 275.A N ARG 271.A O no hydrogen 2.944 N/A GLN 276.A N ILE 272.A O no hydrogen 2.985 N/A ARG 277.A N TRP 273.A O no hydrogen 2.875 N/A VAL 283.A N ASN 159.A O no hydrogen 2.880 N/A SER 284.A OG SER 284.A O no hydrogen 2.386 N/A LYS 285.A N ASP 282.A O no hydrogen 3.360 N/A GLY 287.A N ASP 282.A O no hydrogen 3.014 N/A TRP 293.A N GLY 289.A O no hydrogen 2.919 N/A ALA 294.A N TYR 290.A O no hydrogen 2.926 N/A VAL 295.A N PHE 291.A O no hydrogen 2.882 N/A LEU 296.A N GLU 292.A O no hydrogen 2.922 N/A LEU 297.A N TRP 293.A O no hydrogen 2.883 N/A ALA 298.A N ALA 294.A O no hydrogen 2.889 N/A LEU 299.A N VAL 295.A O no hydrogen 2.939 N/A LEU 300.A N LEU 296.A O no hydrogen 2.903 N/A LEU 301.A N LEU 297.A O no hydrogen 2.847 N/A GLN 302.A N ALA 298.A O no hydrogen 2.972 N/A GLY 304.A N ALA 351.A O no hydrogen 3.222 N/A ASP 307.A N ASP 307.A OD1 no hydrogen 2.410 N/A THR 308.A OG1 ALA 351.A O no hydrogen 3.119 N/A LEU 314.A N ALA 311.A O no hydrogen 3.365 N/A SER 315.A OG SER 317.A OG no hydrogen 3.275 N/A SER 317.A OG SER 315.A OG no hydrogen 3.275 N/A LEU 318.A N SER 315.A O no hydrogen 3.080 N/A SER 319.A OG THR 321.A OG1 no hydrogen 3.377 N/A SER 320.A OG ALA 262.A O no hydrogen 3.393 N/A THR 321.A OG1 SER 319.A OG no hydrogen 3.377 N/A THR 321.A OG1 GLN 322.A OE1 no hydrogen 3.157 N/A GLN 322.A N GLN 322.A OE1 no hydrogen 2.997 N/A LEU 323.A N SER 319.A O no hydrogen 3.011 N/A PHE 324.A N SER 320.A O no hydrogen 2.923 N/A LYS 325.A N THR 321.A O no hydrogen 2.897 N/A ALA 326.A N GLN 322.A O no hydrogen 2.896 N/A LEU 327.A N LEU 323.A O no hydrogen 2.944 N/A ILE 328.A N PHE 324.A O no hydrogen 2.888 N/A GLN 329.A N LYS 325.A O no hydrogen 2.950 N/A PHE 330.A N ALA 326.A O no hydrogen 2.926 N/A LEU 331.A N LEU 327.A O no hydrogen 2.880 N/A SER 332.A N ILE 328.A O no hydrogen 2.869 N/A SER 332.A N GLN 329.A O no hydrogen 3.054 N/A SER 332.A OG GLN 329.A O no hydrogen 2.392 N/A VAL 333.A N GLN 329.A O no hydrogen 2.967 N/A THR 334.A N PHE 330.A O no hydrogen 3.324 N/A ASN 335.A ND2 GLN 345.A O no hydrogen 3.168 N/A LYS 339.A NZ GLU 338.A OE1 no hydrogen 2.978 N/A CYS 341.A N GLU 338.A O no hydrogen 3.018 N/A VAL 342.A N GLU 338.A O no hydrogen 2.953 N/A LEU 343.A N LYS 339.A O no hydrogen 2.866 N/A GLY 344.A N LYS 339.A O no hydrogen 2.408 N/A GLN 345.A N ILE 354.A O no hydrogen 2.752 N/A GLN 345.A NE2 ASN 356.A O no hydrogen 2.327 N/A GLN 345.A NE2 ASN 356.A OD1 no hydrogen 3.073 N/A ALA 351.A N GLN 302.A O no hydrogen 3.249 N/A ILE 354.A N GLN 345.A O no hydrogen 3.351 N/A ASP 362.A N LEU 367.A O no hydrogen 2.866 N/A ARG 365.A NH2 GLU 199.A OE1 no hydrogen 3.175 N/A LEU 367.A N ASP 362.A O no hydrogen 2.948 N/A ILE 369.A N LEU 360.A O no hydrogen 2.890 N/A MET 373.A N ALA 370.A O no hydrogen 2.980 N/A ALA 378.A N GLY 374.A O no hydrogen 2.887 N/A ASP 379.A N PRO 375.A O no hydrogen 2.916 N/A LEU 380.A N TRP 376.A O no hydrogen 2.934 N/A LEU 381.A N SER 377.A O no hydrogen 2.844 N/A HIS 382.A N ALA 378.A O no hydrogen 2.922 N/A GLN 383.A N ASP 379.A O no hydrogen 2.945 N/A GLN 383.A NE2 HIS 384.A NE2 no hydrogen 3.337 N/A HIS 384.A N LEU 380.A O no hydrogen 2.974 N/A ALA 385.A N LEU 381.A O no hydrogen 2.850 N/A ARG 386.A N HIS 382.A O no hydrogen 2.929 N/A TRP 387.A N GLN 383.A O no hydrogen 2.920 N/A THR 388.A N HIS 384.A O no hydrogen 2.889 N/A THR 388.A OG1 HIS 384.A O no hydrogen 2.291 N/A THR 388.A OG1 ALA 385.A O no hydrogen 3.152 N/A ARG 389.A N ALA 385.A O no hydrogen 2.852 N/A LYS 390.A N ARG 386.A O no hydrogen 2.968 N/A LEU 391.A N TRP 387.A O no hydrogen 2.940 N/A LEU 392.A N THR 388.A O no hydrogen 2.847 N/A ALA 393.A N ARG 389.A O no hydrogen 2.853 N/A ASP 394.A N LYS 390.A O no hydrogen 2.956 N/A ASP 394.A N LEU 391.A O no hydrogen 2.784 N/A ALA 396.A N ASP 394.A OD1 no hydrogen 2.905 N/A ILE 405.A N PRO 832.A O no hydrogen 3.126 N/A LYS 407.A N ILE 405.A O no hydrogen 2.890 N/A LYS 407.A NZ VAL 835.A O no hydrogen 3.506 N/A LEU 410.A N LEU 406.A O no hydrogen 2.970 N/A THR 414.A OG1 PRO 411.A O no hydrogen 2.441 N/A TYR 415.A N ILE 501.A O no hydrogen 2.914 N/A ASP 416.A N GLN 584.A O no hydrogen 2.938 N/A LEU 417.A N ILE 499.A O no hydrogen 2.841 N/A VAL 418.A N GLN 582.A O no hydrogen 2.941 N/A VAL 426.A N PRO 423.A O no hydrogen 3.074 N/A SER 427.A N PRO 423.A O no hydrogen 2.647 N/A SER 427.A OG PRO 423.A O no hydrogen 3.232 N/A ALA 429.A N LEU 578.A O no hydrogen 2.957 N/A GLU 437.A N LYS 433.A O no hydrogen 2.892 N/A ALA 438.A N VAL 434.A O no hydrogen 2.880 N/A ARG 439.A N ALA 435.A O no hydrogen 2.912 N/A GLY 440.A N HIS 436.A O no hydrogen 2.927 N/A ARG 441.A NH2 ASN 161.A OD1 no hydrogen 2.691 N/A GLN 444.A NE2 GLU 437.A OE2 no hydrogen 2.820 N/A HIS 447.A N TRP 443.A O no hydrogen 2.898 N/A LYS 448.A N GLN 444.A O no hydrogen 2.901 N/A LYS 448.A NZ HIS 436.A ND1 no hydrogen 3.266 N/A VAL 449.A N VAL 445.A O no hydrogen 2.928 N/A TYR 450.A N GLY 446.A O no hydrogen 2.887 N/A TYR 450.A OH VAL 475.A O no hydrogen 3.120 N/A ARG 451.A N HIS 447.A O no hydrogen 3.002 N/A ILE 452.A N LYS 448.A O no hydrogen 2.952 N/A LEU 453.A N VAL 449.A O no hydrogen 2.925 N/A ARG 454.A N TYR 450.A O no hydrogen 3.047 N/A ARG 455.A N ARG 451.A O no hydrogen 2.957 N/A ALA 456.A N ILE 452.A O no hydrogen 2.940 N/A LEU 457.A N LEU 453.A O no hydrogen 2.917 N/A SER 458.A OG ARG 454.A O no hydrogen 2.270 N/A LYS 460.A NZ ASN 461.A O no hydrogen 3.489 N/A ASN 461.A N GLY 465.A O no hydrogen 3.234 N/A MET 462.A N ASN 461.A OD1 no hydrogen 2.604 N/A ARG 469.A N LEU 457.A O no hydrogen 3.158 N/A ARG 469.A NH1 ASP 515.A OD1 no hydrogen 2.846 N/A ARG 469.A NH2 ASP 515.A OD1 no hydrogen 3.397 N/A ILE 471.A N LEU 504.A O no hydrogen 2.624 N/A HIS 472.A N LEU 504.A O no hydrogen 2.961 N/A VAL 475.A N TYR 450.A OH no hydrogen 2.691 N/A SER 476.A N GLU 500.A O no hydrogen 2.910 N/A GLY 478.A N PRO 498.A O no hydrogen 2.934 N/A TRP 484.A N TYR 155.A O no hydrogen 3.158 N/A SER 485.A N GLU 488.A OE2 no hydrogen 2.679 N/A ASN 487.A ND2 HIS 60.A O no hydrogen 3.282 N/A GLN 491.A NE2 TYR 157.A OH no hydrogen 3.063 N/A ILE 499.A N LEU 417.A O no hydrogen 2.943 N/A GLU 500.A N SER 476.A O no hydrogen 2.891 N/A ILE 501.A N TYR 415.A O no hydrogen 2.949 N/A GLY 502.A N LYS 474.A O no hydrogen 2.915 N/A LEU 504.A N HIS 472.A O no hydrogen 2.860 N/A LEU 508.A N ASP 506.A OD1 no hydrogen 3.069 N/A ASN 509.A N ASP 506.A OD1 no hydrogen 3.304 N/A THR 513.A OG1 TRP 557.A O no hydrogen 2.232 N/A ASP 515.A N LEU 555.A O no hydrogen 2.361 N/A ARG 516.A N ASP 459.A OD2 no hydrogen 3.252 N/A THR 529.A N GLU 525.A O no hydrogen 2.966 N/A THR 529.A OG1 GLU 525.A O no hydrogen 2.772 N/A CYS 530.A N LYS 527.A O no hydrogen 3.417 N/A CYS 530.A SG LYS 527.A O no hydrogen 3.304 N/A ARG 535.A NE THR 529.A O no hydrogen 3.100 N/A TRP 537.A N PHE 533.A O no hydrogen 2.875 N/A GLY 538.A N ARG 534.A O no hydrogen 2.913 N/A GLU 542.A N THR 554.A O no hydrogen 2.913 N/A ARG 544.A N ARG 552.A O no hydrogen 2.846 N/A ASP 549.A N PHE 546.A O no hydrogen 3.320 N/A THR 550.A OG1 GLY 548.A O no hydrogen 2.867 N/A ARG 552.A N ARG 544.A O no hydrogen 2.953 N/A ARG 552.A NH1 ASN 461.A O no hydrogen 3.164 N/A ARG 552.A NH2 LYS 460.A O no hydrogen 2.653 N/A THR 554.A N GLU 542.A O no hydrogen 2.858 N/A LEU 555.A N ASP 515.A O no hydrogen 2.714 N/A TRP 557.A N THR 513.A O no hydrogen 2.399 N/A GLN 560.A NE2 ALA 559.A O no hydrogen 2.878 N/A CYS 566.A N ASP 564.A OD2 no hydrogen 2.893 N/A GLU 568.A N ASP 564.A O no hydrogen 3.039 N/A ILE 569.A N LEU 565.A O no hydrogen 2.889 N/A MET 570.A N CYS 566.A O no hydrogen 2.890 N/A ARG 571.A N GLU 567.A O no hydrogen 2.914 N/A TYR 572.A N GLU 568.A O no hydrogen 2.962 N/A ILE 573.A N ILE 569.A O no hydrogen 2.834 N/A LEU 574.A N MET 570.A O no hydrogen 2.952 N/A GLY 575.A N ARG 571.A O no hydrogen 2.922 N/A HIS 577.A N ILE 573.A O no hydrogen 2.885 N/A HIS 577.A ND1 HIS 577.A O no hydrogen 2.731 N/A LEU 578.A N LEU 574.A O no hydrogen 3.232 N/A ARG 579.A N LEU 574.A O no hydrogen 3.141 N/A GLN 582.A N VAL 418.A O no hydrogen 2.863 N/A GLN 584.A N ASP 416.A O no hydrogen 2.940 N/A SER 603.A OG THR 605.A OG1 no hydrogen 3.114 N/A THR 605.A N SER 603.A O no hydrogen 2.606 N/A THR 605.A OG1 SER 603.A OG no hydrogen 3.114 N/A PHE 608.A N THR 605.A O no hydrogen 3.327 N/A ASN 609.A N THR 605.A O no hydrogen 2.863 N/A ARG 612.A NE ARG 612.A O no hydrogen 2.733 N/A LYS 613.A N PHE 608.A O no hydrogen 2.539 N/A THR 614.A OG1 VAL 610.A O no hydrogen 2.275 N/A THR 614.A OG1 ALA 611.A O no hydrogen 2.974 N/A PHE 615.A N ALA 611.A O no hydrogen 2.910 N/A THR 616.A N ARG 612.A O no hydrogen 2.918 N/A THR 616.A OG1 ARG 612.A O no hydrogen 3.299 N/A THR 616.A OG1 LYS 613.A O no hydrogen 2.494 N/A SER 617.A N LYS 613.A O no hydrogen 2.936 N/A SER 617.A N THR 616.A OG1 no hydrogen 2.832 N/A ARG 620.A N PHE 615.A O no hydrogen 2.742 N/A LEU 622.A N PHE 618.A O no hydrogen 3.297 N/A ARG 623.A N GLU 619.A O no hydrogen 3.008 N/A ARG 623.A NE GLU 619.A O no hydrogen 2.853 N/A ASP 624.A N ARG 620.A O no hydrogen 2.884 N/A LEU 625.A N ASP 621.A O no hydrogen 2.903 N/A GLU 626.A N LEU 622.A O no hydrogen 2.918 N/A ARG 633.A N SER 667.A O no hydrogen 3.303 N/A ARG 633.A NH2 GLU 669.A OE2 no hydrogen 3.403 N/A HIS 634.A N SER 667.A O no hydrogen 2.919 N/A ASN 636.A N VAL 665.A O no hydrogen 2.871 N/A ILE 638.A N GLU 663.A O no hydrogen 2.914 N/A LEU 642.A N CYS 639.A O no hydrogen 2.925 N/A ARG 643.A N CYS 639.A O no hydrogen 2.974 N/A ARG 643.A NH1 ILE 638.A O no hydrogen 3.494 N/A SER 645.A N PRO 640.A O no hydrogen 2.962 N/A SER 645.A OG ARG 643.A O no hydrogen 3.442 N/A SER 651.A OG ALA 596.A O no hydrogen 3.539 N/A SER 655.A OG GLY 653.A O no hydrogen 3.443 N/A SER 657.A N PRO 654.A O no hydrogen 3.049 N/A GLU 663.A N GLU 663.A OE1 no hydrogen 2.711 N/A VAL 664.A N ARG 734.A O no hydrogen 2.591 N/A VAL 665.A N ASN 636.A O no hydrogen 2.891 N/A SER 667.A N HIS 634.A O no hydrogen 2.827 N/A SER 667.A OG GLN 738.A O no hydrogen 3.039 N/A LYS 673.A N SER 671.A OG no hydrogen 3.211 N/A ILE 681.A N SER 677.A O no hydrogen 2.900 N/A GLN 682.A N LEU 678.A O no hydrogen 2.903 N/A ARG 683.A N ILE 679.A O no hydrogen 2.946 N/A THR 684.A N ALA 680.A O no hydrogen 2.954 N/A THR 684.A OG1 ALA 680.A O no hydrogen 2.627 N/A LYS 685.A N ILE 681.A O no hydrogen 2.933 N/A LYS 685.A NZ ILE 737.A O no hydrogen 2.338 N/A ILE 686.A N GLN 682.A O no hydrogen 2.936 N/A ALA 687.A N ARG 683.A O no hydrogen 2.889 N/A PHE 688.A N THR 684.A O no hydrogen 2.960 N/A LEU 689.A N LYS 685.A O no hydrogen 2.925 N/A LEU 690.A N ILE 686.A O no hydrogen 2.735 N/A MET 691.A N ALA 687.A O no hydrogen 2.990 N/A ILE 692.A N PHE 688.A O no hydrogen 2.959 N/A GLY 693.A N LEU 689.A O no hydrogen 2.895 N/A ARG 694.A N LEU 690.A O no hydrogen 2.857 N/A LEU 695.A N MET 691.A O no hydrogen 2.988 N/A LEU 696.A N ILE 692.A O no hydrogen 2.967 N/A GLU 697.A N GLY 693.A O no hydrogen 2.858 N/A ARG 698.A N ARG 694.A O no hydrogen 2.911 N/A ARG 698.A N LEU 695.A O no hydrogen 3.300 N/A PHE 699.A N LEU 695.A O no hydrogen 2.935 N/A GLY 702.A N PHE 699.A O no hydrogen 2.699 N/A ILE 704.A N PRO 701.A O no hydrogen 3.015 N/A ARG 705.A N ILE 726.A O no hydrogen 2.940 N/A HIS 707.A N ASP 724.A O no hydrogen 2.941 N/A GLY 709.A N PHE 722.A O no hydrogen 2.942 N/A ALA 713.A N ASP 711.A OD1 no hydrogen 3.068 N/A ARG 714.A NH1 GLN 766.A O no hydrogen 2.850 N/A ARG 714.A NH2 GLN 766.A O no hydrogen 2.511 N/A THR 717.A OG1 ARG 714.A O no hydrogen 3.384 N/A THR 717.A OG1 TYR 715.A O no hydrogen 3.238 N/A PHE 722.A N GLY 709.A O no hydrogen 2.842 N/A LEU 723.A N VAL 735.A O no hydrogen 2.861 N/A VAL 725.A N PHE 733.A O no hydrogen 2.887 N/A ILE 726.A N ARG 705.A O no hydrogen 2.847 N/A TYR 727.A N ALA 731.A O no hydrogen 2.944 N/A TYR 727.A OH SER 617.A O no hydrogen 3.180 N/A GLY 730.A N TYR 727.A O no hydrogen 2.827 N/A CYS 732.A SG ASP 724.A OD1 no hydrogen 3.253 N/A CYS 732.A SG ASP 724.A OD2 no hydrogen 3.390 N/A CYS 732.A SG VAL 725.A O no hydrogen 3.776 N/A PHE 733.A N VAL 725.A O no hydrogen 2.898 N/A ARG 734.A N MET 662.A O no hydrogen 2.424 N/A VAL 735.A N LEU 723.A O no hydrogen 2.847 N/A ARG 736.A N VAL 664.A O no hydrogen 2.920 N/A GLN 738.A N ILE 666.A O no hydrogen 2.554 N/A ALA 739.A N GLU 742.A OE1 no hydrogen 3.199 N/A SER 744.A OG GLU 747.A OE1 no hydrogen 3.048 N/A LEU 745.A N LEU 741.A O no hydrogen 2.855 N/A LEU 746.A N GLU 742.A O no hydrogen 2.953 N/A GLU 747.A N GLU 743.A O no hydrogen 2.891 N/A ARG 748.A N SER 744.A O no hydrogen 2.861 N/A GLN 749.A N LEU 745.A O no hydrogen 2.956 N/A THR 750.A N LEU 746.A O no hydrogen 2.897 N/A THR 750.A OG1 LEU 746.A O no hydrogen 3.082 N/A THR 750.A OG1 GLU 747.A O no hydrogen 2.509 N/A LYS 751.A N GLU 747.A O no hydrogen 2.922 N/A ASP 752.A N ARG 748.A O no hydrogen 2.956 N/A ALA 763.A N LEU 759.A O no hydrogen 2.960 N/A SER 764.A N ARG 760.A O no hydrogen 2.898 N/A SER 764.A OG GLN 761.A O no hydrogen 2.874 N/A THR 765.A N GLN 761.A O no hydrogen 2.862 N/A THR 765.A OG1 GLN 761.A O no hydrogen 2.289 N/A GLN 766.A N ARG 762.A O no hydrogen 2.946 N/A LEU 767.A N ALA 763.A O no hydrogen 2.986 N/A ALA 768.A N SER 764.A O no hydrogen 2.951 N/A SER 769.A N THR 765.A O no hydrogen 2.892 N/A SER 769.A OG THR 765.A O no hydrogen 3.288 N/A PHE 770.A N GLN 766.A O no hydrogen 3.015 N/A ARG 771.A N LEU 767.A O no hydrogen 2.955 N/A ARG 772.A N ALA 768.A O no hydrogen 2.858 N/A ARG 772.A NH1 SER 769.A OG no hydrogen 3.158 N/A ARG 772.A NH2 ASP 897.A OD1 no hydrogen 3.520 N/A THR 773.A N SER 769.A O no hydrogen 2.988 N/A THR 773.A OG1 THR 773.A O no hydrogen 2.637 N/A HIS 776.A N ARG 771.A O no hydrogen 3.276 N/A LEU 777.A N ARG 772.A O no hydrogen 3.076 N/A LEU 779.A N VAL 775.A O no hydrogen 3.025 N/A HIS 780.A N HIS 776.A O no hydrogen 2.820 N/A THR 781.A N LEU 777.A O no hydrogen 2.848 N/A THR 781.A OG1 CYS 639.A O no hydrogen 3.405 N/A GLN 782.A N PRO 778.A O no hydrogen 3.027 N/A TYR 783.A N LEU 779.A O no hydrogen 2.988 N/A ILE 784.A N HIS 780.A O no hydrogen 2.935 N/A THR 785.A N THR 781.A O no hydrogen 2.968 N/A THR 785.A OG1 LEU 642.A O no hydrogen 3.115 N/A THR 785.A OG1 THR 781.A O no hydrogen 3.126 N/A THR 786.A N GLN 782.A O no hydrogen 3.069 N/A THR 786.A OG1 GLN 782.A O no hydrogen 3.292 N/A THR 786.A OG1 TYR 783.A O no hydrogen 2.706 N/A ALA 787.A N TYR 783.A O no hydrogen 2.964 N/A THR 788.A N ILE 784.A O no hydrogen 2.808 N/A THR 788.A OG1 ILE 784.A O no hydrogen 2.189 N/A THR 789.A N THR 785.A O no hydrogen 3.017 N/A THR 789.A OG1 THR 786.A O no hydrogen 2.972 N/A ARG 790.A NE THR 786.A O no hydrogen 2.919 N/A SER 795.A OG HIS 644.A O no hydrogen 3.237 N/A THR 797.A N ALA 793.A O no hydrogen 2.954 N/A THR 797.A OG1 ALA 793.A O no hydrogen 2.245 N/A ILE 798.A N LEU 794.A O no hydrogen 2.904 N/A ARG 799.A N SER 795.A O no hydrogen 3.018 N/A LEU 800.A N PRO 796.A O no hydrogen 2.843 N/A VAL 801.A N THR 797.A O no hydrogen 2.948 N/A LYS 802.A N ILE 798.A O no hydrogen 2.925 N/A LYS 802.A NZ SER 645.A O no hydrogen 3.299 N/A HIS 803.A N ARG 799.A O no hydrogen 2.913 N/A TRP 804.A N LEU 800.A O no hydrogen 2.904 N/A PHE 805.A N VAL 801.A O no hydrogen 2.930 N/A SER 806.A N LYS 802.A O no hydrogen 2.852 N/A SER 806.A OG LYS 802.A O no hydrogen 3.152 N/A VAL 807.A N HIS 803.A O no hydrogen 2.877 N/A HIS 808.A N TRP 804.A O no hydrogen 2.908 N/A HIS 808.A ND1 TRP 804.A O no hydrogen 2.724 N/A LYS 809.A NZ VAL 807.A O no hydrogen 2.983 N/A LEU 810.A N PHE 805.A O no hydrogen 2.888 N/A HIS 813.A N ASN 812.A OD1 no hydrogen 2.671 N/A PHE 814.A N LEU 810.A O no hydrogen 3.028 N/A GLU 820.A N PRO 816.A O no hydrogen 2.943 N/A LEU 821.A N GLU 817.A O no hydrogen 2.891 N/A PHE 822.A N LEU 818.A O no hydrogen 2.878 N/A VAL 823.A N LEU 819.A O no hydrogen 3.037 N/A LEU 824.A N GLU 820.A O no hydrogen 2.819 N/A HIS 825.A N LEU 821.A O no hydrogen 2.860 N/A THR 826.A N PHE 822.A O no hydrogen 2.996 N/A PHE 827.A N VAL 823.A O no hydrogen 2.891 N/A LEU 828.A N LEU 824.A O no hydrogen 2.896 N/A ALA 829.A N HIS 825.A O no hydrogen 2.752 N/A TRP 833.A N PRO 830.A O no hydrogen 2.735 N/A SER 837.A OG PHE 505.A O no hydrogen 3.426 N/A GLY 842.A N SER 838.A O no hydrogen 2.970 N/A PHE 843.A N PRO 839.A O no hydrogen 2.893 N/A LEU 844.A N THR 840.A O no hydrogen 2.863 N/A ARG 845.A N THR 841.A O no hydrogen 2.965 N/A THR 846.A N GLY 842.A O no hydrogen 2.938 N/A THR 846.A OG1 GLY 842.A O no hydrogen 3.370 N/A THR 846.A OG1 PHE 843.A O no hydrogen 2.285 N/A LEU 847.A N PHE 843.A O no hydrogen 2.933 N/A LEU 848.A N LEU 844.A O no hydrogen 2.891 N/A PHE 849.A N ARG 845.A O no hydrogen 2.940 N/A LEU 850.A N THR 846.A O no hydrogen 2.968 N/A ALA 851.A N LEU 847.A O no hydrogen 2.884 N/A ARG 852.A N LEU 848.A O no hydrogen 2.968 N/A TRP 853.A NE1 ASP 858.A O no hydrogen 2.708 N/A LEU 860.A N PHE 881.A O no hydrogen 2.883 N/A ILE 862.A N ALA 883.A O no hydrogen 2.944 N/A ASP 863.A N ASP 863.A OD2 no hydrogen 2.475 N/A TRP 868.A NE1 THR 878.A OG1 no hydrogen 2.644 N/A ARG 869.A N LEU 865.A O no hydrogen 2.912 N/A LEU 871.A N ALA 867.A O no hydrogen 2.960 N/A ASP 872.A N TRP 868.A O no hydrogen 2.923 N/A ALA 883.A N LEU 860.A O no hydrogen 2.881 N/A THR 884.A N GLU 887.A O no hydrogen 2.912 N/A SER 889.A N GLU 887.A OE1 no hydrogen 2.706 N/A SER 889.A OG THR 891.A OG1 no hydrogen 2.732 N/A THR 891.A OG1 SER 889.A OG no hydrogen 2.732 N/A THR 894.A OG1 LEU 880.A O no hydrogen 3.430 N/A SER 895.A OG THR 891.A O no hydrogen 2.846 N/A GLY 898.A N THR 894.A O no hydrogen 2.971 N/A LYS 904.A NZ GLU 940.A O no hydrogen 2.364 N/A ARG 909.A N VAL 905.A O no hydrogen 2.904 N/A ARG 909.A NH1 LYS 939.A O no hydrogen 2.833 N/A ARG 909.A NH2 GLU 940.A O no hydrogen 2.890 N/A MET 910.A N VAL 906.A O no hydrogen 2.772 N/A THR 911.A N ALA 907.A O no hydrogen 3.016 N/A ALA 912.A N ALA 908.A O no hydrogen 2.895 N/A LEU 913.A N ARG 909.A O no hydrogen 2.871 N/A ALA 914.A N MET 910.A O no hydrogen 2.929 N/A LYS 915.A N THR 911.A O no hydrogen 2.938 N/A LYS 915.A NZ ALA 851.A O no hydrogen 3.327 N/A LYS 915.A NZ THR 911.A OG1 no hydrogen 2.618 N/A SER 916.A N ALA 912.A O no hydrogen 2.876 N/A SER 916.A OG LEU 913.A O no hydrogen 2.890 N/A ALA 917.A N LEU 913.A O no hydrogen 2.848 N/A ALA 918.A N ALA 914.A O no hydrogen 2.959 N/A ARG 919.A N LYS 915.A O no hydrogen 2.883 N/A VAL 920.A N SER 916.A O no hydrogen 2.920 N/A ILE 921.A N ALA 917.A O no hydrogen 2.921 N/A ARG 922.A N ALA 918.A O no hydrogen 2.941 N/A ARG 922.A N ARG 919.A O no hydrogen 3.135 N/A GLU 923.A N ARG 919.A O no hydrogen 2.908 N/A GLN 924.A N VAL 920.A O no hydrogen 2.926 N/A GLN 924.A NE2 GLU 923.A OE2 no hydrogen 3.266 N/A LEU 928.A N ASP 927.A OD2 no hydrogen 2.833 N/A ARG 931.A NH1 PHE 934.A O no hydrogen 2.870 N/A ARG 932.A N ASP 929.A O no hydrogen 3.360 N/A ARG 932.A NH1 SER 916.A OG no hydrogen 3.281 N/A ARG 932.A NH2 SER 916.A OG no hydrogen 3.057 N/A PHE 934.A N ARG 931.A O no hydrogen 3.323 N/A VAL 935.A N ARG 932.A O no hydrogen 3.470 N/A LYS 939.A NZ SER 937.A OG no hydrogen 2.524 N/A VAL 943.A N ALA 1039.A O no hydrogen 2.967 N/A LEU 945.A N ILE 1037.A O no hydrogen 2.912 N/A LEU 947.A N LYS 1035.A O no hydrogen 2.775 N/A THR 949.A N ASN 948.A OD1 no hydrogen 2.741 N/A THR 949.A OG1 HIS 995.A NE2 no hydrogen 2.396 N/A VAL 951.A N THR 949.A O no hydrogen 3.060 N/A SER 954.A N GLU 967.A OE2 no hydrogen 3.144 N/A SER 954.A OG LYS 953.A O no hydrogen 2.731 N/A THR 958.A N SER 954.A O no hydrogen 3.285 N/A TYR 959.A N LEU 956.A O no hydrogen 2.920 N/A ILE 960.A N LEU 956.A O no hydrogen 2.878 N/A THR 961.A OG1 ILE 960.A O no hydrogen 2.624 N/A VAL 962.A N ARG 957.A O no hydrogen 2.711 N/A MET 968.A N ALA 965.A O no hydrogen 3.140 N/A LYS 972.A NZ ILE 600.A O no hydrogen 3.357 N/A GLY 973.A N GLY 970.A O no hydrogen 2.924 N/A LYS 979.A NZ ALA 728.A O no hydrogen 2.437 N/A ALA 982.A N PHE 978.A O no hydrogen 2.979 N/A THR 985.A OG1 GLU 987.A O no hydrogen 2.266 N/A THR 985.A OG1 PRO 988.A O no hydrogen 2.810 N/A LEU 990.A N GLU 987.A O no hydrogen 3.065 N/A ALA 993.A N LEU 990.A O no hydrogen 3.225 N/A GLN 994.A N PRO 991.A O no hydrogen 3.451 N/A GLN 994.A NE2 LEU 990.A O no hydrogen 3.265 N/A ASP 998.A N HIS 995.A O no hydrogen 3.403 N/A LEU 1000.A N PRO 996.A O no hydrogen 2.952 N/A LEU 1001.A N VAL 997.A O no hydrogen 2.885 N/A LYS 1002.A N ASP 998.A O no hydrogen 2.875 N/A GLN 1003.A N VAL 999.A O no hydrogen 2.883 N/A GLN 1003.A NE2 LEU 1000.A O no hydrogen 3.643 N/A LEU 1004.A N LEU 1000.A O no hydrogen 2.955 N/A SER 1005.A N LEU 1001.A O no hydrogen 2.871 N/A SER 1005.A OG LEU 1001.A O no hydrogen 3.144 N/A ALA 1006.A N GLN 1003.A O no hydrogen 3.070 N/A VAL 1007.A N LEU 1004.A O no hydrogen 2.864 N/A SER 1010.A N TYR 1008.A O no hydrogen 2.703 N/A SER 1010.A OG TYR 1008.A O no hydrogen 2.909 N/A SER 1010.A OG PRO 1055.A O no hydrogen 2.683 N/A GLY 1013.A N VAL 1040.A O no hydrogen 2.857 N/A SER 1015.A N GLY 1038.A O no hydrogen 2.892 N/A SER 1015.A OG TYR 941.A OH no hydrogen 2.506 N/A VAL 1021.A N SER 811.A O no hydrogen 2.992 N/A ARG 1024.A NE LYS 656.A O no hydrogen 3.371 N/A ARG 1024.A NH1 LYS 656.A O no hydrogen 3.538 N/A SER 1025.A OG SER 1025.A O no hydrogen 2.349 N/A SER 1025.A OG THR 1028.A OG1 no hydrogen 2.883 N/A THR 1027.A N ASP 1026.A OD2 no hydrogen 2.682 N/A THR 1027.A OG1 ASP 1026.A OD2 no hydrogen 3.452 N/A THR 1028.A OG1 SER 1025.A O no hydrogen 3.025 N/A THR 1028.A OG1 SER 1025.A OG no hydrogen 2.883 N/A ALA 1029.A N ASP 1026.A O no hydrogen 2.906 N/A THR 1030.A OG1 THR 1027.A O no hydrogen 2.674 N/A GLU 1032.A N THR 1030.A OG1 no hydrogen 3.058 N/A GLY 1033.A N THR 1030.A O no hydrogen 3.068 N/A ILE 1037.A N LEU 945.A O no hydrogen 2.920 N/A GLY 1038.A N SER 1015.A O no hydrogen 2.954 N/A ALA 1039.A N VAL 943.A O no hydrogen 2.846 N/A VAL 1040.A N GLY 1013.A O no hydrogen 2.861 N/A TRP 1041.A N ASP 942.A OD1 no hydrogen 2.990 N/A ASN 1042.A N ALA 1011.A O no hydrogen 2.921 N/A LEU 1045.A N ASN 1042.A O no hydrogen 3.056 N/A LYS 1047.A NZ LYS 1059.A O no hydrogen 3.549 N/A SER 1057.A OG SER 1057.A O no hydrogen 2.391 N/A