Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8j6o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ SER 21.A O no hydrogen 3.470 N/A ASN 3.A N GLU 22.A O no hydrogen 2.976 N/A SER 5.A N VAL 24.A O no hydrogen 2.886 N/A LYS 7.A N ILE 26.A O no hydrogen 2.884 N/A LYS 7.A NZ ASP 17.A OD1 no hydrogen 3.257 N/A ALA 9.A N THR 28.A O no hydrogen 3.142 N/A GLU 10.A N TYR 15.A OH no hydrogen 2.655 N/A ARG 13.A N PHE 11.A O no hydrogen 3.210 N/A ARG 13.A NE TYR 15.A OH no hydrogen 3.302 N/A ARG 13.A NH2 TYR 15.A OH no hydrogen 3.282 N/A TYR 15.A N LEU 122.A O no hydrogen 3.034 N/A TYR 15.A OH GLU 10.A O no hydrogen 3.374 N/A ASP 17.A N TYR 120.A O no hydrogen 3.349 N/A VAL 19.A N THR 118.A O no hydrogen 3.183 N/A SER 21.A OG LEU 113.A O no hydrogen 2.848 N/A LEU 23.A N ASN 20.A O no hydrogen 3.282 N/A VAL 24.A N ASN 3.A O no hydrogen 3.253 N/A ASN 25.A N VAL 110.A O no hydrogen 2.969 N/A ASN 25.A ND2 GLU 18.A O no hydrogen 3.639 N/A ASN 25.A ND2 TYR 120.A OH no hydrogen 2.816 N/A ILE 26.A N SER 5.A O no hydrogen 2.923 N/A TYR 27.A N VAL 108.A O no hydrogen 3.049 N/A TYR 27.A OH ASP 17.A OD1 no hydrogen 2.267 N/A TYR 27.A OH TYR 120.A OH no hydrogen 2.654 N/A THR 28.A N LYS 7.A O no hydrogen 3.255 N/A PHE 29.A N PHE 106.A O no hydrogen 3.150 N/A HIS 31.A N GLN 104.A O no hydrogen 3.109 N/A VAL 33.A N GLU 102.A O no hydrogen 3.178 N/A THR 34.A OG1 ARG 37.A O no hydrogen 3.286 N/A ARG 35.A NH1 ASN 99.A O no hydrogen 2.692 N/A ARG 35.A NH2 LYS 98.A O no hydrogen 2.659 N/A ARG 35.A NH2 ASN 99.A O no hydrogen 2.975 N/A ARG 42.A N SER 125.A O no hydrogen 2.940 N/A ARG 42.A NE GLU 89.A OE1 no hydrogen 2.391 N/A ARG 42.A NH1 PRO 147.A O no hydrogen 3.209 N/A ARG 42.A NH2 PRO 147.A O no hydrogen 3.206 N/A VAL 43.A N ARG 90.A O no hydrogen 3.018 N/A SER 44.A N ARG 123.A O no hydrogen 2.965 N/A SER 44.A OG GLU 89.A OE2 no hydrogen 3.273 N/A VAL 45.A N VAL 88.A O no hydrogen 3.060 N/A ASN 46.A N GLN 121.A O no hydrogen 2.927 N/A VAL 47.A N GLN 86.A O no hydrogen 3.198 N/A LEU 48.A N THR 119.A O no hydrogen 3.354 N/A GLY 53.A N GLN 51.A OE1 no hydrogen 3.156 N/A LEU 56.A N VAL 71.A O no hydrogen 2.641 N/A LEU 57.A N SER 111.A O no hydrogen 2.789 N/A PHE 58.A N PHE 69.A O no hydrogen 2.868 N/A VAL 59.A N ASP 109.A O no hydrogen 2.710 N/A VAL 60.A N VAL 67.A O no hydrogen 2.697 N/A ARG 61.A N TYR 107.A O no hydrogen 2.625 N/A ARG 61.A NH1 ASP 109.A OD2 no hydrogen 2.776 N/A GLN 62.A N ALA 65.A O no hydrogen 2.846 N/A VAL 67.A N VAL 60.A O no hydrogen 2.909 N/A PHE 69.A N PHE 58.A O no hydrogen 2.956 N/A VAL 71.A N LEU 56.A O no hydrogen 2.664 N/A LEU 73.A N TYR 85.A O no hydrogen 2.709 N/A LEU 75.A N TYR 83.A O no hydrogen 2.891 N/A MET 78.A N GLU 228.A OE1 no hydrogen 2.637 N/A ARG 81.A NE GLU 228.A OE2 no hydrogen 3.263 N/A TYR 83.A N LEU 75.A O no hydrogen 2.981 N/A TYR 83.A OH GLU 228.A OE2 no hydrogen 2.759 N/A LEU 84.A N VAL 247.A O no hydrogen 2.492 N/A TYR 85.A N LEU 73.A O no hydrogen 2.984 N/A LYS 87.A NZ SER 44.A OG no hydrogen 2.755 N/A LYS 87.A NZ GLU 89.A OE2 no hydrogen 2.818 N/A VAL 88.A N VAL 45.A O no hydrogen 3.035 N/A ARG 90.A N VAL 43.A O no hydrogen 3.142 N/A LEU 92.A N VAL 41.A O no hydrogen 2.930 N/A GLU 102.A N VAL 33.A O no hydrogen 3.092 N/A GLN 104.A N HIS 31.A O no hydrogen 2.953 N/A PHE 106.A N PHE 29.A O no hydrogen 3.113 N/A TYR 107.A N ARG 61.A O no hydrogen 2.792 N/A VAL 108.A N TYR 27.A O no hydrogen 2.967 N/A ASP 109.A N VAL 59.A O no hydrogen 2.386 N/A VAL 110.A N ASN 25.A O no hydrogen 3.033 N/A SER 111.A N LEU 57.A O no hydrogen 2.965 N/A THR 112.A OG1 PRO 55.A O no hydrogen 3.443 N/A THR 112.A OG1 SER 114.A OG no hydrogen 3.314 N/A SER 114.A N THR 112.A OG1 no hydrogen 3.215 N/A SER 114.A OG THR 112.A OG1 no hydrogen 3.314 N/A SER 114.A OG VAL 116.A O no hydrogen 3.328 N/A THR 118.A N VAL 19.A O no hydrogen 3.150 N/A THR 118.A OG1 VAL 19.A O no hydrogen 3.242 N/A TYR 120.A N ASP 17.A O no hydrogen 3.339 N/A TYR 120.A OH TYR 27.A OH no hydrogen 2.654 N/A GLN 121.A N ASN 46.A O no hydrogen 2.797 N/A LEU 122.A N TYR 15.A O no hydrogen 3.025 N/A ARG 123.A N SER 44.A O no hydrogen 2.916 N/A SER 125.A N ARG 42.A O no hydrogen 2.815 N/A SER 125.A OG ARG 42.A O no hydrogen 3.519 N/A ARG 126.A N GLU 12.A OE1 no hydrogen 2.862 N/A MET 127.A N GLY 40.A O no hydrogen 3.281 N/A LEU 132.A N LYS 151.A O no hydrogen 2.655 N/A THR 134.A OG1 TYR 152.A OH no hydrogen 2.777 N/A GLY 135.A N VAL 260.A O no hydrogen 2.946 N/A GLU 136.A N ARG 133.A O no hydrogen 3.272 N/A PHE 138.A N VAL 258.A O no hydrogen 3.461 N/A PHE 140.A N LEU 256.A O no hydrogen 3.314 N/A THR 142.A N LYS 254.A O no hydrogen 3.140 N/A THR 142.A OG1 THR 143.A O no hydrogen 3.471 N/A THR 142.A OG1 GLN 146.A O no hydrogen 2.420 N/A THR 143.A N GLN 146.A O no hydrogen 3.089 N/A GLN 146.A N THR 143.A O no hydrogen 2.838 N/A GLN 148.A N VAL 223.A O no hydrogen 3.415 N/A GLN 148.A NE2 ASN 141.A O no hydrogen 2.459 N/A PHE 150.A N VAL 221.A O no hydrogen 3.175 N/A LYS 151.A N PHE 130.A O no hydrogen 2.992 N/A TYR 152.A N PHE 219.A O no hydrogen 3.099 N/A TYR 152.A OH THR 134.A OG1 no hydrogen 2.777 N/A PHE 154.A N ASN 217.A O no hydrogen 2.907 N/A VAL 158.A N PRO 155.A O no hydrogen 3.206 N/A VAL 161.A N VAL 209.A O no hydrogen 3.084 N/A ILE 162.A N SER 261.A O no hydrogen 2.878 N/A VAL 163.A N ILE 207.A O no hydrogen 2.703 N/A LYS 164.A N LEU 259.A O no hydrogen 2.996 N/A VAL 165.A N ALA 205.A O no hydrogen 2.931 N/A THR 166.A N SER 257.A O no hydrogen 3.178 N/A THR 166.A OG1 SER 257.A OG no hydrogen 2.741 N/A SER 167.A N LYS 203.A O no hydrogen 2.962 N/A SER 167.A OG LYS 169.A O no hydrogen 2.728 N/A SER 167.A OG THR 255.A O no hydrogen 3.030 N/A SER 174.A N MET 201.A O no hydrogen 3.382 N/A SER 174.A OG PRO 172.A O no hydrogen 3.350 N/A VAL 175.A N VAL 224.A O no hydrogen 2.571 N/A ILE 176.A N GLN 199.A O no hydrogen 3.327 N/A SER 177.A N VAL 222.A O no hydrogen 2.542 N/A SER 177.A OG VAL 192.A O no hydrogen 3.557 N/A ILE 178.A N MET 197.A O no hydrogen 2.845 N/A GLN 179.A N TYR 220.A O no hydrogen 2.868 N/A GLN 179.A NE2 SER 177.A OG no hydrogen 3.417 N/A GLN 179.A NE2 TYR 186.A O no hydrogen 3.241 N/A LEU 182.A N ASP 180.A O no hydrogen 3.067 N/A TYR 186.A N GLN 179.A OE1 no hydrogen 3.347 N/A LEU 188.A N ASN 191.A OD1 no hydrogen 3.089 N/A PHE 194.A N ASN 191.A O no hydrogen 3.230 N/A MET 197.A N ILE 178.A O no hydrogen 3.226 N/A TYR 198.A N GLY 323.A O no hydrogen 3.201 N/A GLN 199.A N ILE 176.A O no hydrogen 3.110 N/A GLN 199.A NE2 ALA 206.A O no hydrogen 3.324 N/A GLN 199.A NE2 GLN 325.A OE1 no hydrogen 2.000 N/A THR 200.A N ASP 326.A OD1 no hydrogen 3.419 N/A THR 200.A N ASP 326.A OD2 no hydrogen 3.077 N/A THR 200.A OG1 ASP 326.A OD1 no hydrogen 3.360 N/A THR 200.A OG1 ASP 326.A OD2 no hydrogen 3.237 N/A MET 201.A N SER 174.A O no hydrogen 3.075 N/A THR 202.A OG1 ALA 594.A O no hydrogen 2.603 N/A THR 202.A OG1 GLU 598.A OE2 no hydrogen 2.721 N/A LYS 204.A NZ ASN 600.A O no hydrogen 3.198 N/A ALA 205.A N VAL 165.A O no hydrogen 3.111 N/A ILE 207.A N VAL 163.A O no hydrogen 2.917 N/A VAL 209.A N VAL 161.A O no hydrogen 2.870 N/A ARG 211.A N ASP 159.A O no hydrogen 2.992 N/A ARG 211.A NH2 PRO 155.A O no hydrogen 3.370 N/A ARG 211.A NH2 VAL 158.A O no hydrogen 2.730 N/A LYS 212.A NZ GLN 210.A OE1 no hydrogen 3.136 N/A LYS 212.A NZ ASP 213.A OD1 no hydrogen 3.184 N/A ASP 213.A N GLN 210.A O no hydrogen 3.300 N/A PHE 214.A N ARG 211.A O no hydrogen 3.217 N/A ASN 217.A N PHE 214.A O no hydrogen 3.123 N/A PHE 219.A N TYR 152.A O no hydrogen 3.165 N/A TYR 220.A N GLN 179.A O no hydrogen 2.526 N/A VAL 221.A N PHE 150.A O no hydrogen 2.699 N/A VAL 222.A N SER 177.A O no hydrogen 2.634 N/A VAL 223.A N GLN 148.A O no hydrogen 2.949 N/A VAL 224.A N VAL 175.A O no hydrogen 3.115 N/A LYS 226.A N CYS 173.A O no hydrogen 2.634 N/A THR 227.A OG1 ARG 76.A O no hydrogen 3.193 N/A CYS 232.A SG MET 201.A O no hydrogen 3.489 N/A GLY 233.A N ASP 229.A O no hydrogen 2.931 N/A GLY 233.A N GLN 230.A O no hydrogen 2.889 N/A GLY 234.A N ASP 229.A O no hydrogen 3.112 N/A VAL 247.A N LYS 82.A O no hydrogen 2.700 N/A GLN 249.A N LEU 84.A O no hydrogen 3.049 N/A ARG 252.A NH1 ASP 229.A OD1 no hydrogen 2.885 N/A ARG 252.A NH1 ASP 229.A OD2 no hydrogen 3.107 N/A LYS 254.A N THR 142.A O no hydrogen 3.059 N/A LYS 254.A NZ LYS 169.A O no hydrogen 3.136 N/A LYS 254.A NZ ALA 170.A O no hydrogen 2.803 N/A LYS 254.A NZ THR 202.A O no hydrogen 2.449 N/A THR 255.A OG1 ASN 141.A OD1 no hydrogen 2.992 N/A LEU 256.A N PHE 140.A O no hydrogen 3.265 N/A SER 257.A OG THR 166.A O no hydrogen 2.886 N/A SER 257.A OG THR 166.A OG1 no hydrogen 2.741 N/A VAL 258.A N PHE 138.A O no hydrogen 3.254 N/A LEU 259.A N LYS 164.A O no hydrogen 2.792 N/A SER 261.A N ILE 162.A O no hydrogen 3.072 N/A ALA 263.A N SER 160.A O no hydrogen 2.935 N/A GLU 267.A N THR 265.A OG1 no hydrogen 3.241 N/A VAL 270.A N SER 266.A O no hydrogen 3.119 N/A SER 271.A N GLU 267.A O no hydrogen 2.803 N/A SER 271.A OG GLU 267.A O no hydrogen 3.318 N/A SER 271.A OG ALA 268.A O no hydrogen 3.097 N/A GLY 272.A N ALA 268.A O no hydrogen 2.783 N/A MET 273.A N TYR 269.A O no hydrogen 2.936 N/A LEU 274.A N VAL 270.A O no hydrogen 2.804 N/A PHE 275.A N SER 271.A O no hydrogen 2.880 N/A CYS 276.A N GLY 272.A O no hydrogen 3.069 N/A CYS 276.A SG LEU 348.A O no hydrogen 3.157 N/A LEU 277.A N MET 273.A O no hydrogen 3.201 N/A GLY 278.A N LEU 274.A O no hydrogen 2.653 N/A ILE 279.A N PHE 275.A O no hydrogen 3.229 N/A LEU 281.A N LEU 277.A O no hydrogen 2.745 N/A SER 282.A N GLY 278.A O no hydrogen 3.131 N/A SER 282.A OG ILE 279.A O no hydrogen 2.717 N/A TYR 284.A N PHE 280.A O no hydrogen 3.366 N/A TYR 284.A OH LEU 355.A O no hydrogen 2.496 N/A LEU 285.A N LEU 281.A O no hydrogen 3.032 N/A LEU 286.A N SER 282.A O no hydrogen 2.844 N/A THR 287.A N PHE 283.A O no hydrogen 2.998 N/A VAL 288.A N TYR 284.A O no hydrogen 3.181 N/A LEU 289.A N LEU 285.A O no hydrogen 2.819 N/A LEU 290.A N LEU 286.A O no hydrogen 2.758 N/A ALA 291.A N THR 287.A O no hydrogen 2.699 N/A CYS 292.A N VAL 288.A O no hydrogen 2.757 N/A CYS 292.A SG LEU 289.A O no hydrogen 3.157 N/A TRP 293.A N LEU 289.A O no hydrogen 3.138 N/A GLU 294.A N LEU 290.A O no hydrogen 3.339 N/A ASN 295.A N ALA 291.A O no hydrogen 3.044 N/A TRP 296.A N CYS 292.A O no hydrogen 3.094 N/A ARG 297.A N TRP 293.A O no hydrogen 3.012 N/A GLN 298.A N GLU 294.A O no hydrogen 2.774 N/A PHE 303.A N THR 299.A O no hydrogen 2.978 N/A TYR 304.A N ILE 300.A O no hydrogen 2.894 N/A ALA 305.A N VAL 302.A O no hydrogen 3.001 N/A LEU 306.A N VAL 302.A O no hydrogen 3.070 N/A VAL 309.A N ALA 305.A O no hydrogen 2.993 N/A GLN 310.A N LEU 306.A O no hydrogen 3.108 N/A LEU 311.A N PRO 307.A O no hydrogen 2.942 N/A VAL 312.A N VAL 308.A O no hydrogen 2.858 N/A ILE 313.A N VAL 309.A O no hydrogen 2.981 N/A THR 314.A N GLN 310.A O no hydrogen 3.071 N/A THR 314.A OG1 GLN 310.A O no hydrogen 2.898 N/A THR 314.A OG1 LEU 311.A O no hydrogen 3.081 N/A TYR 315.A N LEU 311.A O no hydrogen 2.905 N/A GLN 316.A N VAL 312.A O no hydrogen 2.938 N/A THR 317.A N ILE 313.A O no hydrogen 3.015 N/A THR 317.A OG1 ILE 313.A O no hydrogen 2.657 N/A THR 317.A OG1 THR 314.A O no hydrogen 2.674 N/A VAL 318.A N THR 314.A O no hydrogen 2.930 N/A VAL 319.A N TYR 315.A O no hydrogen 2.923 N/A ASN 320.A N GLN 316.A O no hydrogen 2.942 N/A ASN 320.A ND2 ASN 340.A O no hydrogen 3.421 N/A VAL 321.A N THR 317.A O no hydrogen 2.928 N/A THR 322.A N VAL 318.A O no hydrogen 2.897 N/A THR 322.A OG1 VAL 318.A O no hydrogen 2.182 N/A GLY 323.A N VAL 319.A O no hydrogen 3.201 N/A GLN 325.A N TYR 198.A O no hydrogen 3.204 N/A CYS 328.A SG TYR 330.A OH no hydrogen 3.446 N/A TYR 329.A N PRO 415.A O no hydrogen 2.359 N/A TYR 329.A OH LYS 591.A O no hydrogen 3.179 N/A TYR 330.A OH VAL 413.A O no hydrogen 2.748 N/A ASN 331.A ND2 ARG 601.A O no hydrogen 3.165 N/A CYS 334.A N ASN 331.A O no hydrogen 2.792 N/A CYS 334.A SG PHE 608.A O no hydrogen 3.526 N/A LEU 338.A N LEU 341.A O no hydrogen 2.923 N/A LEU 341.A N LEU 338.A O no hydrogen 3.189 N/A PHE 344.A N HIS 336.A O no hydrogen 2.776 N/A ASN 345.A ND2 PHE 608.A O no hydrogen 3.393 N/A ASN 346.A ND2 ASP 613.A OD1 no hydrogen 2.614 N/A ASN 346.A ND2 ASP 613.A OD2 no hydrogen 3.290 N/A LEU 348.A N PHE 344.A O no hydrogen 2.904 N/A SER 349.A N ASN 345.A O no hydrogen 2.877 N/A SER 349.A OG ASN 345.A O no hydrogen 3.494 N/A SER 349.A OG ASN 346.A O no hydrogen 2.622 N/A SER 349.A OG ASP 613.A OD1 no hydrogen 3.023 N/A SER 349.A OG HIS 616.A ND1 no hydrogen 3.008 N/A ASN 350.A N ASN 346.A O no hydrogen 2.969 N/A ASN 350.A ND2 ASN 346.A O no hydrogen 2.275 N/A LEU 351.A N LEU 348.A O no hydrogen 3.051 N/A GLY 352.A N SER 349.A O no hydrogen 3.362 N/A LEU 355.A N LEU 351.A O no hydrogen 2.960 N/A LEU 356.A N GLY 352.A O no hydrogen 2.911 N/A GLY 357.A N TYR 353.A O no hydrogen 2.863 N/A LEU 358.A N ILE 354.A O no hydrogen 2.962 N/A LEU 359.A N LEU 355.A O no hydrogen 2.931 N/A PHE 360.A N LEU 356.A O no hydrogen 2.884 N/A LEU 361.A N GLY 357.A O no hydrogen 2.896 N/A LEU 362.A N LEU 358.A O no hydrogen 2.944 N/A ILE 363.A N LEU 359.A O no hydrogen 2.930 N/A ILE 364.A N PHE 360.A O no hydrogen 2.887 N/A LEU 365.A N LEU 361.A O no hydrogen 2.891 N/A GLN 366.A N LEU 362.A O no hydrogen 2.925 N/A ARG 367.A N ILE 363.A O no hydrogen 2.939 N/A GLU 368.A N ILE 364.A O no hydrogen 2.858 N/A ILE 369.A N LEU 365.A O no hydrogen 2.900 N/A ASN 370.A N GLN 366.A O no hydrogen 2.926 N/A HIS 371.A N ARG 367.A O no hydrogen 2.880 N/A ASN 372.A N GLU 368.A O no hydrogen 2.902 N/A ARG 373.A N ILE 369.A O no hydrogen 2.911 N/A ALA 374.A N ASN 370.A O no hydrogen 2.895 N/A LEU 375.A N HIS 371.A O no hydrogen 2.907 N/A LEU 376.A N ASN 372.A O no hydrogen 2.902 N/A ARG 377.A N ARG 373.A O no hydrogen 2.960 N/A ASN 378.A N LEU 375.A O no hydrogen 2.782 N/A ASP 379.A N ALA 374.A O no hydrogen 3.430 N/A CYS 381.A N ASP 379.A OD1 no hydrogen 3.459 N/A LEU 383.A N ASP 379.A O no hydrogen 3.076 N/A GLU 384.A N LEU 380.A O no hydrogen 2.916 N/A CYS 385.A N CYS 381.A O no hydrogen 3.071 N/A CYS 385.A SG LEU 380.A O no hydrogen 3.590 N/A ILE 387.A N ASP 638.A OD1 no hydrogen 3.074 N/A TYR 395.A N PHE 391.A O no hydrogen 2.910 N/A ALA 396.A N GLY 392.A O no hydrogen 2.901 N/A MET 397.A N LEU 393.A O no hydrogen 2.911 N/A GLY 398.A N PHE 394.A O no hydrogen 2.936 N/A THR 399.A N TYR 395.A O no hydrogen 2.911 N/A THR 399.A OG1 TYR 395.A O no hydrogen 2.941 N/A ALA 400.A N ALA 396.A O no hydrogen 2.854 N/A LEU 401.A N MET 397.A O no hydrogen 2.908 N/A MET 402.A N GLY 398.A O no hydrogen 2.990 N/A MET 403.A N THR 399.A O no hydrogen 2.895 N/A GLU 404.A N ALA 400.A O no hydrogen 2.824 N/A GLY 405.A N LEU 401.A O no hydrogen 2.988 N/A LEU 406.A N MET 402.A O no hydrogen 2.995 N/A LEU 407.A N MET 403.A O no hydrogen 2.844 N/A SER 408.A N GLU 404.A O no hydrogen 2.866 N/A SER 408.A OG ASN 350.A OD1 no hydrogen 2.952 N/A SER 408.A OG ASP 423.A OD1 no hydrogen 2.730 N/A SER 408.A OG HIS 616.A NE2 no hydrogen 3.409 N/A ALA 409.A N GLY 405.A O no hydrogen 2.958 N/A CYS 410.A N LEU 406.A O no hydrogen 2.970 N/A CYS 410.A SG LEU 406.A O no hydrogen 3.376 N/A TYR 411.A N LEU 407.A O no hydrogen 2.856 N/A HIS 412.A N SER 408.A O no hydrogen 2.859 N/A VAL 413.A N ALA 409.A O no hydrogen 3.003 N/A CYS 414.A N TYR 411.A O no hydrogen 3.204 N/A THR 418.A N ASN 416.A OD1 no hydrogen 3.007 N/A THR 418.A OG1 THR 418.A O no hydrogen 2.651 N/A ASN 419.A N ASN 416.A O no hydrogen 2.783 N/A PHE 422.A N ASN 419.A O no hydrogen 3.102 N/A THR 424.A OG1 ALA 531.A O no hydrogen 2.904 N/A SER 425.A N GLN 421.A O no hydrogen 2.963 N/A SER 425.A OG TYR 304.A OH no hydrogen 2.855 N/A SER 425.A OG GLN 421.A O no hydrogen 2.793 N/A SER 425.A OG TYR 428.A OH no hydrogen 2.938 N/A TYR 428.A N THR 424.A O no hydrogen 3.379 N/A TYR 428.A OH SER 425.A OG no hydrogen 2.938 N/A TYR 428.A OH SER 464.A OG no hydrogen 2.764 N/A MET 429.A N SER 425.A O no hydrogen 3.295 N/A ILE 430.A N PHE 426.A O no hydrogen 2.825 N/A ALA 431.A N MET 427.A O no hydrogen 2.945 N/A GLY 432.A N TYR 428.A O no hydrogen 2.586 N/A LEU 433.A N MET 429.A O no hydrogen 2.724 N/A LEU 433.A N ILE 430.A O no hydrogen 3.094 N/A CYS 434.A N ILE 430.A O no hydrogen 2.880 N/A CYS 434.A SG ILE 430.A O no hydrogen 3.308 N/A MET 435.A N ALA 431.A O no hydrogen 2.662 N/A LYS 437.A N LEU 433.A O no hydrogen 3.042 N/A LYS 437.A N CYS 434.A O no hydrogen 3.319 N/A LYS 437.A NZ HIS 390.A O no hydrogen 3.338 N/A LYS 437.A NZ GLN 440.A OE1 no hydrogen 2.779 N/A GLN 440.A N LEU 436.A O no hydrogen 2.868 N/A LYS 441.A N LYS 437.A O no hydrogen 2.894 N/A LYS 441.A NZ LEU 630.A O no hydrogen 2.552 N/A ARG 442.A N LEU 438.A O no hydrogen 2.955 N/A ARG 442.A NH2 GLU 558.A OE1 no hydrogen 2.711 N/A ARG 442.A NH2 ASP 634.A OD1 no hydrogen 3.539 N/A HIS 443.A N TYR 439.A O no hydrogen 2.838 N/A HIS 443.A NE2 PHE 648.A O no hydrogen 2.804 N/A ILE 446.A N HIS 443.A O no hydrogen 3.200 N/A ALA 448.A N ASP 445.A O no hydrogen 3.218 N/A ALA 450.A N ASN 447.A O no hydrogen 3.425 N/A CYS 456.A N SER 452.A O no hydrogen 2.922 N/A LEU 457.A N ALA 453.A O no hydrogen 2.956 N/A ALA 458.A N TYR 454.A O no hydrogen 2.903 N/A ILE 459.A N ALA 455.A O no hydrogen 2.913 N/A VAL 460.A N CYS 456.A O no hydrogen 2.991 N/A ILE 461.A N LEU 457.A O no hydrogen 2.952 N/A PHE 462.A N ALA 458.A O no hydrogen 2.927 N/A PHE 463.A N ILE 459.A O no hydrogen 2.931 N/A SER 464.A N VAL 460.A O no hydrogen 2.947 N/A SER 464.A OG TYR 428.A OH no hydrogen 2.764 N/A SER 464.A OG VAL 460.A O no hydrogen 2.917 N/A SER 464.A OG ILE 461.A O no hydrogen 3.418 N/A VAL 465.A N PHE 462.A O no hydrogen 3.524 N/A VAL 469.A N VAL 465.A O no hydrogen 2.930 N/A PHE 470.A N LEU 466.A O no hydrogen 2.908 N/A GLY 471.A N GLY 467.A O no hydrogen 3.450 N/A VAL 480.A N ALA 476.A O no hydrogen 2.976 N/A PHE 481.A N PHE 477.A O no hydrogen 2.843 N/A SER 482.A N TRP 478.A O no hydrogen 2.839 N/A SER 482.A OG TRP 478.A O no hydrogen 2.874 N/A ILE 483.A N ILE 479.A O no hydrogen 2.945 N/A ILE 484.A N VAL 480.A O no hydrogen 2.913 N/A HIS 485.A N PHE 481.A O no hydrogen 2.827 N/A ILE 486.A N SER 482.A O no hydrogen 2.890 N/A ILE 487.A N ILE 483.A O no hydrogen 2.943 N/A ALA 488.A N ILE 484.A O no hydrogen 2.874 N/A THR 489.A N HIS 485.A O no hydrogen 2.865 N/A THR 489.A OG1 HIS 485.A O no hydrogen 2.660 N/A LEU 490.A N ILE 486.A O no hydrogen 2.910 N/A LEU 491.A N ILE 487.A O no hydrogen 2.880 N/A LEU 492.A N ALA 488.A O no hydrogen 2.886 N/A SER 493.A N THR 489.A O no hydrogen 2.920 N/A THR 494.A N LEU 490.A O no hydrogen 2.870 N/A THR 494.A OG1 LEU 490.A O no hydrogen 2.986 N/A GLN 495.A N LEU 491.A O no hydrogen 2.890 N/A LEU 496.A N LEU 492.A O no hydrogen 2.879 N/A TYR 497.A N SER 493.A O no hydrogen 2.951 N/A TYR 498.A N THR 494.A O no hydrogen 3.180 N/A MET 499.A N GLN 495.A O no hydrogen 3.035 N/A ARG 504.A NH1 PHE 648.A OXT no hydrogen 3.432 N/A ARG 504.A NH2 PHE 648.A OXT no hydrogen 3.209 N/A MET 505.A N TYR 501.A O no hydrogen 2.962 N/A VAL 506.A N VAL 502.A O no hydrogen 2.930 N/A LEU 507.A N ASP 503.A O no hydrogen 2.888 N/A LEU 508.A N ARG 504.A O no hydrogen 2.994 N/A VAL 509.A N MET 505.A O no hydrogen 2.898 N/A MET 510.A N VAL 506.A O no hydrogen 2.987 N/A GLY 511.A N LEU 507.A O no hydrogen 2.958 N/A ASN 512.A N LEU 508.A O no hydrogen 2.871 N/A VAL 513.A N VAL 509.A O no hydrogen 2.964 N/A ILE 514.A N MET 510.A O no hydrogen 2.842 N/A ASN 515.A N GLY 511.A O no hydrogen 2.954 N/A TRP 516.A N ASN 512.A O no hydrogen 2.929 N/A SER 517.A N VAL 513.A O no hydrogen 2.902 N/A SER 517.A OG VAL 513.A O no hydrogen 2.839 N/A LEU 518.A N ILE 514.A O no hydrogen 2.962 N/A ALA 519.A N ASN 515.A O no hydrogen 2.717 N/A ALA 520.A N TRP 516.A O no hydrogen 2.886 N/A ALA 520.A N SER 517.A O no hydrogen 3.093 N/A GLY 522.A N LEU 518.A O no hydrogen 2.998 N/A LEU 523.A N ALA 520.A O no hydrogen 2.693 N/A ARG 526.A N GLY 522.A O no hydrogen 3.383 N/A PHE 530.A N ASP 529.A OD1 no hydrogen 2.990 N/A TYR 533.A N ASP 529.A O no hydrogen 3.259 N/A LEU 534.A N PHE 530.A O no hydrogen 2.609 N/A LEU 535.A N ALA 531.A O no hydrogen 3.441 N/A ALA 536.A N SER 532.A O no hydrogen 2.889 N/A ILE 537.A N TYR 533.A O no hydrogen 2.579 N/A GLY 538.A N LEU 534.A O no hydrogen 2.790 N/A ILE 539.A N LEU 535.A O no hydrogen 2.797 N/A CYS 540.A N ALA 536.A O no hydrogen 2.797 N/A CYS 540.A SG ALA 536.A O no hydrogen 3.081 N/A ASN 541.A N ILE 537.A O no hydrogen 2.705 N/A LEU 542.A N GLY 538.A O no hydrogen 2.791 N/A LEU 543.A N ILE 539.A O no hydrogen 2.917 N/A LEU 544.A N CYS 540.A O no hydrogen 2.930 N/A TYR 545.A N ASN 541.A O no hydrogen 2.921 N/A PHE 546.A N LEU 542.A O no hydrogen 2.880 N/A ALA 547.A N LEU 543.A O no hydrogen 2.942 N/A PHE 548.A N LEU 544.A O no hydrogen 2.890 N/A TYR 549.A N TYR 545.A O no hydrogen 2.909 N/A TYR 549.A OH ASP 634.A OD1 no hydrogen 3.051 N/A TYR 549.A OH ASP 634.A OD2 no hydrogen 2.834 N/A ILE 550.A N PHE 546.A O no hydrogen 2.945 N/A ILE 551.A N ALA 547.A O no hydrogen 2.896 N/A MET 552.A N PHE 548.A O no hydrogen 2.886 N/A LYS 553.A N TYR 549.A O no hydrogen 2.912 N/A LYS 553.A NZ GLU 558.A O no hydrogen 3.525 N/A LEU 554.A N ILE 550.A O no hydrogen 2.947 N/A ARG 555.A N ILE 551.A O no hydrogen 2.880 N/A SER 556.A N MET 552.A O no hydrogen 2.918 N/A SER 556.A OG MET 552.A O no hydrogen 3.272 N/A GLY 557.A N LEU 554.A O no hydrogen 3.311 N/A ARG 559.A N ASP 636.A OD1 no hydrogen 3.284 N/A LEU 565.A N LYS 561.A O no hydrogen 3.161 N/A LEU 566.A N LEU 562.A O no hydrogen 2.914 N/A CYS 567.A N ILE 563.A O no hydrogen 2.931 N/A CYS 567.A SG ILE 563.A O no hydrogen 3.480 N/A ILE 568.A N PRO 564.A O no hydrogen 2.857 N/A VAL 569.A N LEU 565.A O no hydrogen 2.943 N/A CYS 570.A N LEU 566.A O no hydrogen 2.946 N/A CYS 570.A SG LEU 566.A O no hydrogen 3.265 N/A THR 571.A N CYS 567.A O no hydrogen 2.847 N/A THR 571.A OG1 CYS 567.A O no hydrogen 2.565 N/A SER 572.A N ILE 568.A O no hydrogen 2.913 N/A SER 572.A OG ILE 568.A O no hydrogen 3.023 N/A VAL 573.A N VAL 569.A O no hydrogen 2.951 N/A VAL 574.A N CYS 570.A O no hydrogen 2.866 N/A TRP 575.A N THR 571.A O no hydrogen 2.656 N/A TRP 575.A NE1 SER 626.A OG no hydrogen 3.209 N/A GLY 576.A N SER 572.A O no hydrogen 2.815 N/A PHE 577.A N VAL 573.A O no hydrogen 2.977 N/A ALA 578.A N VAL 574.A O no hydrogen 2.805 N/A LEU 579.A N TRP 575.A O no hydrogen 2.835 N/A PHE 580.A N GLY 576.A O no hydrogen 3.002 N/A PHE 581.A N PHE 577.A O no hydrogen 3.114 N/A PHE 582.A N ALA 578.A O no hydrogen 2.810 N/A PHE 583.A N LEU 579.A O no hydrogen 2.801 N/A GLN 584.A N PHE 580.A O no hydrogen 3.035 N/A GLY 585.A N PHE 581.A O no hydrogen 3.261 N/A SER 587.A OG LEU 586.A O no hydrogen 2.594 N/A THR 588.A OG1 SER 587.A O no hydrogen 2.561 N/A TRP 589.A NE1 ASP 529.A OD2 no hydrogen 2.796 N/A LYS 591.A NZ HIS 599.A NE2 no hydrogen 3.242 N/A THR 592.A OG1 CYS 232.A O no hydrogen 2.967 N/A THR 592.A OG1 GLU 595.A OE1 no hydrogen 3.066 N/A SER 596.A N THR 592.A O no hydrogen 2.646 N/A ARG 597.A N PRO 593.A O no hydrogen 2.922 N/A ARG 597.A NH2 ASP 326.A OD2 no hydrogen 2.526 N/A GLU 598.A N GLU 595.A O no hydrogen 3.405 N/A HIS 599.A N SER 596.A O no hydrogen 3.356 N/A ASN 600.A N ARG 597.A O no hydrogen 3.332 N/A CYS 603.A SG HIS 336.A NE2 no hydrogen 3.423 N/A CYS 603.A SG ASP 607.A O no hydrogen 4.025 N/A ILE 604.A N PHE 609.A O no hydrogen 3.218 N/A LEU 605.A N PHE 609.A O no hydrogen 3.239 N/A PHE 608.A N LEU 605.A O no hydrogen 3.000 N/A PHE 609.A N LEU 605.A O no hydrogen 3.017 N/A ASP 611.A N ASP 610.A OD1 no hydrogen 2.048 N/A ILE 614.A N ASP 610.A O no hydrogen 3.133 N/A TRP 615.A N ASP 611.A O no hydrogen 2.950 N/A HIS 616.A N HIS 612.A O no hydrogen 2.963 N/A HIS 616.A ND1 SER 349.A OG no hydrogen 3.008 N/A PHE 617.A N ASP 613.A O no hydrogen 3.056 N/A LEU 618.A N ILE 614.A O no hydrogen 2.869 N/A SER 619.A N TRP 615.A O no hydrogen 2.712 N/A SER 619.A OG TYR 353.A OH no hydrogen 3.362 N/A SER 620.A N HIS 616.A O no hydrogen 3.448 N/A SER 620.A OG HIS 616.A O no hydrogen 3.240 N/A SER 620.A OG PHE 617.A O no hydrogen 2.790 N/A ILE 621.A N PHE 617.A O no hydrogen 3.233 N/A ALA 622.A N LEU 618.A O no hydrogen 2.817 N/A MET 623.A N SER 619.A O no hydrogen 2.760 N/A PHE 624.A N SER 620.A O no hydrogen 2.874 N/A GLY 625.A N ILE 621.A O no hydrogen 2.954 N/A SER 626.A N ALA 622.A O no hydrogen 2.815 N/A SER 626.A OG ALA 622.A O no hydrogen 3.157 N/A PHE 627.A N MET 623.A O no hydrogen 2.969 N/A LEU 628.A N PHE 624.A O no hydrogen 2.951 N/A VAL 629.A N GLY 625.A O no hydrogen 2.867 N/A LEU 630.A N SER 626.A O no hydrogen 3.007 N/A LEU 631.A N PHE 627.A O no hydrogen 2.871 N/A THR 632.A N LEU 628.A O no hydrogen 2.909 N/A THR 632.A OG1 LEU 628.A O no hydrogen 2.891 N/A ASP 635.A N THR 632.A O no hydrogen 3.438 N/A ASP 638.A N ASP 634.A O no hydrogen 3.087 N/A THR 639.A N ASP 635.A O no hydrogen 3.328 N/A THR 639.A OG1 ASP 636.A O no hydrogen 2.883 N/A VAL 640.A N LEU 637.A O no hydrogen 3.225 N/A ARG 642.A NE GLY 386.A O no hydrogen 2.886 N/A