Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6boe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N TRP 10.A O no hydrogen 2.961 N/A SER 4.A OG THR 64.A OG1 no hydrogen 3.366 N/A THR 5.A N HIS 8.A O no hydrogen 2.706 N/A ASN 7.A ND2 GLU 61.A OE2 no hydrogen 2.964 N/A HIS 8.A ND1 GLU 61.A OE1 no hydrogen 3.233 N/A LEU 9.A N ARG 24.A O no hydrogen 2.922 N/A TRP 10.A N GLN 3.A O no hydrogen 2.885 N/A ILE 15.A N SER 13.A O no hydrogen 2.817 N/A LEU 16.A N VAL 20.A O no hydrogen 2.911 N/A ASN 19.A N VAL 36.A O no hydrogen 2.912 N/A VAL 20.A N GLY 17.A O no hydrogen 3.075 N/A PHE 21.A N ILE 34.A O no hydrogen 2.863 N/A ARG 22.A N ASP 14.A O no hydrogen 3.051 N/A GLY 23.A N PHE 32.A O no hydrogen 2.915 N/A ARG 24.A N LEU 9.A O no hydrogen 2.888 N/A HIS 25.A N ASP 30.A O no hydrogen 3.155 N/A LYS 26.A N ASN 7.A O no hydrogen 2.539 N/A LYS 26.A NZ SER 6.A O no hydrogen 3.199 N/A LYS 27.A N HIS 25.A ND1 no hydrogen 2.958 N/A LYS 27.A NZ SER 6.A O no hydrogen 3.487 N/A LYS 27.A NZ ASN 7.A OD1 no hydrogen 2.996 N/A THR 28.A N HIS 25.A ND1 no hydrogen 3.297 N/A THR 28.A OG1 ASP 30.A OD2 no hydrogen 3.371 N/A GLY 29.A N HIS 25.A O no hydrogen 3.269 N/A ASP 30.A N THR 28.A OG1 no hydrogen 3.121 N/A PHE 32.A N GLY 23.A O no hydrogen 2.892 N/A ALA 33.A N MET 73.A O no hydrogen 2.923 N/A ILE 34.A N PHE 21.A O no hydrogen 2.945 N/A LYS 35.A N LEU 71.A O no hydrogen 2.899 N/A VAL 36.A N ASN 19.A O no hydrogen 2.892 N/A PHE 43.A N GLN 39.A O no hydrogen 2.932 N/A VAL 45.A N ARG 41.A O no hydrogen 2.937 N/A LYS 47.A N PHE 43.A O no hydrogen 2.955 N/A LYS 47.A N GLU 44.A O no hydrogen 3.332 N/A HIS 51.A NE2 GLY 108.A O no hydrogen 2.886 N/A ASN 53.A ND2 TYR 140.A O no hydrogen 3.320 N/A VAL 55.A N LEU 142.A O no hydrogen 2.716 N/A LYS 56.A N GLU 74.A OE2 no hydrogen 3.421 N/A ALA 59.A N ILE 72.A O no hydrogen 2.976 N/A GLU 61.A N VAL 70.A O no hydrogen 2.907 N/A GLU 63.A N HIS 68.A O no hydrogen 3.027 N/A THR 64.A N SER 4.A O no hydrogen 3.370 N/A THR 64.A OG1 SER 4.A O no hydrogen 3.253 N/A THR 64.A OG1 SER 4.A OG no hydrogen 3.366 N/A THR 64.A OG1 GLU 63.A OE2 no hydrogen 3.010 N/A THR 65.A N GLU 63.A OE2 no hydrogen 3.245 N/A THR 65.A OG1 GLU 63.A OE1 no hydrogen 2.773 N/A THR 65.A OG1 GLU 63.A OE2 no hydrogen 3.268 N/A THR 66.A N GLU 63.A OE1 no hydrogen 2.775 N/A THR 66.A OG1 GLU 63.A OE1 no hydrogen 2.728 N/A LYS 69.A NZ GLU 62.A OE2 no hydrogen 3.292 N/A VAL 70.A N GLU 61.A O no hydrogen 2.878 N/A LEU 71.A N LYS 35.A O no hydrogen 2.903 N/A ILE 72.A N ALA 59.A O no hydrogen 2.880 N/A MET 73.A N ALA 33.A O no hydrogen 2.915 N/A GLU 74.A N LYS 56.A O no hydrogen 3.286 N/A CYS 76.A SG GLU 74.A O no hydrogen 3.882 N/A GLY 79.A N CYS 76.A O no hydrogen 3.271 N/A LEU 81.A N ILE 128.A O no hydrogen 2.638 N/A TYR 82.A N PRO 125.A O no hydrogen 2.779 N/A VAL 84.A N SER 80.A O no hydrogen 3.235 N/A LEU 85.A N LEU 81.A O no hydrogen 2.900 N/A GLU 86.A N TYR 82.A O no hydrogen 2.924 N/A GLU 86.A N THR 83.A O no hydrogen 3.268 N/A GLU 87.A N VAL 84.A O no hydrogen 3.269 N/A SER 89.A OG ASN 90.A OD1 no hydrogen 3.539 N/A ASN 90.A N GLU 87.A O no hydrogen 3.107 N/A ASN 90.A ND2 VAL 84.A O no hydrogen 2.951 N/A ALA 91.A N PRO 88.A O no hydrogen 3.156 N/A GLY 93.A N ASN 90.A O no hydrogen 3.404 N/A LEU 94.A N ALA 169.A O no hydrogen 2.740 N/A PHE 99.A N PRO 95.A O no hydrogen 2.914 N/A LEU 100.A N GLU 96.A O no hydrogen 2.934 N/A ILE 101.A N SER 97.A O no hydrogen 2.916 N/A VAL 102.A N GLU 98.A O no hydrogen 2.912 N/A LEU 103.A N PHE 99.A O no hydrogen 2.923 N/A ARG 104.A N LEU 100.A O no hydrogen 2.912 N/A ASP 105.A N ILE 101.A O no hydrogen 2.915 N/A VAL 106.A N VAL 102.A O no hydrogen 2.904 N/A VAL 107.A N LEU 103.A O no hydrogen 2.931 N/A GLY 108.A N ARG 104.A O no hydrogen 2.907 N/A GLY 109.A N ASP 105.A O no hydrogen 2.900 N/A MET 110.A N VAL 106.A O no hydrogen 2.922 N/A ASN 111.A N VAL 107.A O no hydrogen 2.926 N/A LEU 113.A N GLY 109.A O no hydrogen 2.927 N/A ARG 114.A N MET 110.A O no hydrogen 2.897 N/A GLU 115.A N ASN 111.A O no hydrogen 2.899 N/A ASN 116.A N HIS 112.A O no hydrogen 2.935 N/A ILE 118.A N LEU 113.A O no hydrogen 2.788 N/A ARG 121.A N ASP 158.A OD2 no hydrogen 3.431 N/A ASP 122.A N HIS 120.A O no hydrogen 2.433 N/A ASN 127.A N LYS 124.A O no hydrogen 2.834 N/A ASN 127.A ND2 ASP 144.A O no hydrogen 2.984 N/A ASN 127.A ND2 ASP 144.A OD2 no hydrogen 3.549 N/A MET 129.A N LYS 141.A O no hydrogen 2.892 N/A ARG 130.A N GLY 79.A O no hydrogen 2.728 N/A ARG 130.A NE SER 138.A OG no hydrogen 2.658 N/A ARG 130.A NH2 SER 138.A OG no hydrogen 3.303 N/A VAL 131.A N VAL 139.A O no hydrogen 2.895 N/A GLY 133.A N GLN 137.A O no hydrogen 3.098 N/A GLY 136.A N GLY 133.A O no hydrogen 3.313 N/A GLN 137.A N ASP 135.A OD1 no hydrogen 3.252 N/A SER 138.A OG GLU 98.A OE1 no hydrogen 3.204 N/A VAL 139.A N VAL 131.A O no hydrogen 2.901 N/A TYR 140.A N ASP 105.A OD2 no hydrogen 2.455 N/A TYR 140.A OH GLU 98.A OE1 no hydrogen 2.599 N/A LYS 141.A N MET 129.A O no hydrogen 2.903 N/A LYS 141.A NZ LYS 52.A O no hydrogen 2.536 N/A LEU 142.A N ASN 53.A O no hydrogen 2.915 N/A THR 147.A OG1 ASP 122.A OD1 no hydrogen 2.481 N/A TYR 150.A N THR 147.A O no hydrogen 3.056 N/A TYR 150.A OH HIS 168.A ND1 no hydrogen 3.082 N/A ASP 154.A N HIS 152.A ND1 no hydrogen 3.147 N/A TYR 156.A N HIS 152.A O no hydrogen 2.598 N/A SER 161.A OG ARG 121.A O no hydrogen 2.654 N/A VAL 164.A N TRP 160.A O no hydrogen 2.946 N/A THR 165.A N SER 161.A O no hydrogen 2.900 N/A THR 165.A OG1 ILE 123.A O no hydrogen 3.186 N/A THR 165.A OG1 SER 161.A O no hydrogen 2.663 N/A PHE 166.A N ILE 162.A O no hydrogen 2.906 N/A TYR 167.A N GLY 163.A O no hydrogen 2.920 N/A TYR 167.A OH SER 202.A OG no hydrogen 2.514 N/A HIS 168.A N VAL 164.A O no hydrogen 2.909 N/A HIS 168.A ND1 TYR 150.A OH no hydrogen 3.082 N/A ALA 169.A N THR 165.A O no hydrogen 2.901 N/A ALA 170.A N PHE 166.A O no hydrogen 2.903 N/A THR 171.A N TYR 167.A O no hydrogen 2.905 N/A THR 171.A OG1 TYR 167.A O no hydrogen 2.901 N/A GLY 172.A N HIS 168.A O no hydrogen 2.953 N/A SER 173.A N THR 171.A OG1 no hydrogen 3.213 N/A ARG 177.A N GLY 203.A O no hydrogen 3.392 N/A ARG 177.A NH1 LEU 174.A O no hydrogen 3.407 N/A PHE 179.A N GLN 205.A OE1 no hydrogen 2.829 N/A ARG 183.A N GLY 181.A O no hydrogen 2.565 N/A LYS 186.A N ARG 183.A O no hydrogen 3.316 N/A LYS 186.A NZ PRO 182.A O no hydrogen 2.624 N/A GLU 187.A N GLU 187.A OE1 no hydrogen 2.685 N/A MET 189.A N ASN 185.A O no hydrogen 3.127 N/A TYR 190.A N LYS 186.A O no hydrogen 3.143 N/A LYS 191.A N GLU 187.A O no hydrogen 2.896 N/A ILE 192.A N VAL 188.A O no hydrogen 2.586 N/A ILE 193.A N MET 189.A O no hydrogen 2.973 N/A THR 194.A N TYR 190.A O no hydrogen 2.823 N/A THR 194.A OG1 TYR 190.A O no hydrogen 2.761 N/A LYS 196.A N ILE 193.A O no hydrogen 3.325 N/A SER 198.A OG GLU 241.A OE1 no hydrogen 3.365 N/A ALA 200.A N PRO 197.A O no hydrogen 3.507 N/A ILE 201.A N SER 215.A O no hydrogen 2.778 N/A SER 202.A N SER 215.A O no hydrogen 2.903 N/A SER 202.A OG TYR 167.A OH no hydrogen 2.514 N/A GLY 203.A N PRO 175.A O no hydrogen 3.066 N/A VAL 204.A N ASP 213.A O no hydrogen 2.910 N/A GLN 205.A N ARG 177.A O no hydrogen 3.188 N/A GLN 205.A NE2 GLY 210.A O no hydrogen 3.375 N/A GLY 210.A N ALA 207.A O no hydrogen 2.943 N/A ASP 213.A N VAL 204.A O no hydrogen 2.893 N/A SER 215.A N SER 202.A O no hydrogen 2.920 N/A SER 215.A OG ASP 217.A O no hydrogen 3.194 N/A MET 218.A N ASP 217.A OD1 no hydrogen 2.442 N/A CYS 222.A N PRO 219.A O no hydrogen 3.184 N/A CYS 222.A SG ALA 170.A O no hydrogen 3.391 N/A SER 225.A N GLU 96.A OE2 no hydrogen 2.873 N/A SER 225.A OG GLU 96.A OE1 no hydrogen 2.700 N/A ARG 226.A NH1 ASP 217.A OD2 no hydrogen 3.104 N/A LEU 228.A N SER 225.A OG no hydrogen 3.364 N/A GLN 229.A N SER 225.A O no hydrogen 2.994 N/A GLN 229.A NE2 LEU 224.A O no hydrogen 3.021 N/A VAL 230.A N ARG 226.A O no hydrogen 2.909 N/A LEU 231.A N GLY 227.A O no hydrogen 2.943 N/A LEU 232.A N GLN 229.A O no hydrogen 3.222 N/A THR 233.A N GLN 229.A O no hydrogen 2.906 N/A THR 233.A OG1 GLN 229.A O no hydrogen 2.934 N/A LEU 236.A N LEU 232.A O no hydrogen 3.313 N/A ALA 237.A N THR 233.A O no hydrogen 2.892 N/A ASN 238.A N PRO 234.A O no hydrogen 2.921 N/A ASN 238.A ND2 PRO 234.A O no hydrogen 3.641 N/A ILE 239.A N LEU 236.A O no hydrogen 3.254 N/A LYS 246.A N ASP 243.A O no hydrogen 3.123 N/A PHE 253.A N GLY 249.A O no hydrogen 2.918 N/A PHE 254.A N PHE 250.A O no hydrogen 2.866 N/A ALA 255.A N ASP 251.A O no hydrogen 2.920 N/A GLU 256.A N GLN 252.A O no hydrogen 2.925 N/A THR 257.A N PHE 253.A O no hydrogen 2.910 N/A THR 257.A OG1 PHE 253.A O no hydrogen 2.776 N/A THR 257.A OG1 PHE 254.A O no hydrogen 3.041 N/A SER 258.A N PHE 254.A O no hydrogen 2.906 N/A SER 258.A OG HIS 262.A NE2 no hydrogen 2.840 N/A ASP 259.A N ALA 255.A O no hydrogen 2.915 N/A ILE 260.A N GLU 256.A O no hydrogen 2.931 N/A LEU 261.A N THR 257.A O no hydrogen 2.909 N/A HIS 262.A N SER 258.A O no hydrogen 3.183 N/A ARG 263.A N ILE 260.A O no hydrogen 3.349 N/A ARG 263.A NH1 TYR 280.A O no hydrogen 2.697 N/A ILE 266.A N ILE 279.A O no hydrogen 2.923 N/A HIS 267.A N THR 328.A OG1 no hydrogen 3.204 N/A HIS 267.A ND1 THR 328.A O no hydrogen 3.089 N/A VAL 268.A N HIS 277.A O no hydrogen 2.920 N/A PHE 269.A N ILE 334.A O no hydrogen 3.343 N/A SER 270.A N THR 275.A O no hydrogen 2.857 N/A LEU 271.A N VAL 336.A O no hydrogen 3.393 N/A GLN 272.A NE2 SER 338.A O no hydrogen 2.629 N/A MET 274.A N LEU 271.A O no hydrogen 3.301 N/A THR 275.A N SER 270.A O no hydrogen 2.959 N/A THR 275.A OG1 HIS 277.A NE2 no hydrogen 2.788 N/A ALA 276.A N TYR 390.A OH no hydrogen 3.303 N/A HIS 277.A N VAL 268.A O no hydrogen 2.882 N/A HIS 277.A NE2 THR 275.A OG1 no hydrogen 2.788 N/A ILE 279.A N ILE 266.A O no hydrogen 2.899 N/A TYR 280.A OH GLU 96.A OE1 no hydrogen 2.210 N/A ILE 281.A N MET 264.A O no hydrogen 2.933 N/A HIS 282.A N ASN 285.A OD1 no hydrogen 3.171 N/A HIS 282.A NE2 ASP 259.A OD1 no hydrogen 2.550 N/A ASN 285.A N HIS 282.A O no hydrogen 3.470 N/A THR 288.A OG1 PRO 318.A O no hydrogen 3.077 N/A PHE 290.A N THR 286.A O no hydrogen 3.387 N/A HIS 291.A N ALA 287.A O no hydrogen 2.915 N/A HIS 291.A ND1 GLN 305.A OE1 no hydrogen 2.390 N/A GLU 292.A N THR 288.A O no hydrogen 2.909 N/A LEU 293.A N ILE 289.A O no hydrogen 2.909 N/A VAL 294.A N PHE 290.A O no hydrogen 2.925 N/A TYR 295.A N HIS 291.A O no hydrogen 2.904 N/A LYS 296.A N GLU 292.A O no hydrogen 2.895 N/A GLN 297.A N LEU 293.A O no hydrogen 2.937 N/A THR 298.A N VAL 294.A O no hydrogen 2.889 N/A THR 298.A N TYR 295.A O no hydrogen 3.292 N/A THR 298.A OG1 VAL 294.A O no hydrogen 2.270 N/A LYS 299.A N TYR 295.A O no hydrogen 2.624 N/A ASN 304.A N ILE 301.A O no hydrogen 3.006 N/A GLN 305.A N SER 302.A O no hydrogen 3.185 N/A GLN 305.A NE2 HIS 291.A O no hydrogen 2.948 N/A GLN 305.A NE2 ILE 300.A O no hydrogen 3.337 N/A GLU 306.A N VAL 337.A O no hydrogen 2.900 N/A ILE 308.A N PHE 335.A O no hydrogen 2.867 N/A TYR 309.A N ARG 312.A O no hydrogen 2.889 N/A TYR 309.A OH LYS 327.A O no hydrogen 2.991 N/A ARG 312.A N TYR 309.A O no hydrogen 2.925 N/A LEU 314.A N LEU 307.A O no hydrogen 2.895 N/A ARG 320.A N GLU 317.A O no hydrogen 2.965 N/A ALA 322.A N ASN 285.A O no hydrogen 2.970 N/A GLN 323.A N SER 283.A O no hydrogen 3.314 N/A HIS 324.A N LEU 321.A O no hydrogen 3.364 N/A PHE 325.A N ALA 322.A O no hydrogen 3.109 N/A THR 329.A N ASN 332.A O no hydrogen 3.400 N/A GLU 331.A N THR 329.A OG1 no hydrogen 3.248 N/A ASN 332.A N THR 329.A O no hydrogen 3.359 N/A ASN 332.A ND2 GLU 310.A OE1 no hydrogen 3.500 N/A ILE 334.A N HIS 267.A O no hydrogen 2.917 N/A PHE 335.A N ILE 308.A O no hydrogen 2.916 N/A VAL 336.A N PHE 269.A O no hydrogen 3.321 N/A VAL 337.A N GLU 306.A O no hydrogen 2.890 N/A SER 338.A OG ASN 304.A O no hydrogen 3.382 N/A GLY 346.A N GLN 273.A O no hydrogen 3.166 N/A LEU 347.A N TYR 552.A OH no hydrogen 2.782 N/A GLU 350.A N TYR 379.A OH no hydrogen 3.308 N/A ASP 366.A N ASP 362.A O no hydrogen 2.770 N/A SER 368.A N ASP 364.A O no hydrogen 2.946 N/A SER 368.A OG ASP 364.A O no hydrogen 3.490 N/A MET 369.A N GLY 365.A O no hydrogen 2.894 N/A ALA 370.A N ASP 366.A O no hydrogen 2.907 N/A LYS 371.A N ALA 367.A O no hydrogen 2.920 N/A LYS 371.A NZ GLU 86.A OE1 no hydrogen 2.605 N/A LYS 371.A NZ GLU 86.A OE2 no hydrogen 3.272 N/A ALA 372.A N SER 368.A O no hydrogen 2.945 N/A ILE 373.A N MET 369.A O no hydrogen 2.917 N/A THR 374.A N ALA 370.A O no hydrogen 2.927 N/A THR 374.A OG1 ALA 370.A O no hydrogen 2.517 N/A GLY 375.A N LYS 371.A O no hydrogen 2.942 N/A VAL 376.A N ALA 372.A O no hydrogen 2.928 N/A VAL 377.A N ILE 373.A O no hydrogen 2.942 N/A CYS 378.A N THR 374.A O no hydrogen 2.914 N/A TYR 379.A N GLY 375.A O no hydrogen 2.936 N/A ALA 380.A N VAL 376.A O no hydrogen 2.922 N/A CYS 381.A N VAL 377.A O no hydrogen 2.897 N/A CYS 381.A SG VAL 492.A O no hydrogen 4.001 N/A ARG 382.A N CYS 378.A O no hydrogen 2.920 N/A ARG 382.A NH2 SER 89.A O no hydrogen 3.282 N/A ILE 383.A N TYR 379.A O no hydrogen 2.933 N/A ALA 384.A N ALA 380.A O no hydrogen 2.934 N/A SER 385.A N CYS 381.A O no hydrogen 2.947 N/A SER 385.A OG CYS 381.A O no hydrogen 3.450 N/A SER 385.A OG ARG 382.A O no hydrogen 2.934 N/A THR 386.A N ARG 382.A O no hydrogen 2.923 N/A THR 386.A OG1 ARG 382.A O no hydrogen 2.588 N/A LEU 387.A N ILE 383.A O no hydrogen 2.885 N/A LEU 388.A N ALA 384.A O no hydrogen 2.958 N/A LEU 389.A N SER 385.A O no hydrogen 2.913 N/A TYR 390.A N THR 386.A O no hydrogen 2.902 N/A GLN 391.A N LEU 387.A O no hydrogen 2.938 N/A GLU 392.A N LEU 388.A O no hydrogen 2.950 N/A LEU 393.A N LEU 389.A O no hydrogen 2.901 N/A MET 394.A N TYR 390.A O no hydrogen 2.902 N/A ARG 395.A N GLN 391.A O no hydrogen 2.931 N/A ARG 395.A NE ALA 480.A O no hydrogen 2.966 N/A ARG 395.A NH2 GLN 391.A OE1 no hydrogen 3.430 N/A ARG 395.A NH2 THR 485.A O no hydrogen 2.400 N/A LYS 396.A N GLU 392.A O no hydrogen 2.953 N/A GLY 397.A N LEU 393.A O no hydrogen 2.900 N/A ILE 398.A N MET 394.A O no hydrogen 2.916 N/A ARG 399.A N ARG 395.A O no hydrogen 2.924 N/A TRP 400.A N LYS 396.A O no hydrogen 2.926 N/A LEU 401.A N GLY 397.A O no hydrogen 2.900 N/A ILE 402.A N ILE 398.A O no hydrogen 2.967 N/A LEU 404.A N TRP 400.A O no hydrogen 2.940 N/A ILE 405.A N LEU 401.A O no hydrogen 2.933 N/A LYS 406.A N ILE 402.A O no hydrogen 2.931 N/A ASP 407.A N GLU 403.A O no hydrogen 2.909 N/A ASP 408.A N LEU 404.A O no hydrogen 2.976 N/A TYR 409.A N ILE 405.A O no hydrogen 2.901 N/A TYR 409.A OH LEU 462.A O no hydrogen 3.368 N/A ASN 410.A N LYS 406.A O no hydrogen 2.918 N/A GLU 411.A N ASP 407.A O no hydrogen 2.954 N/A THR 412.A N ASP 408.A O no hydrogen 2.939 N/A THR 412.A OG1 ASP 408.A O no hydrogen 2.984 N/A THR 412.A OG1 THR 577.A OG1 no hydrogen 2.905 N/A VAL 413.A N TYR 409.A O no hydrogen 2.911 N/A HIS 414.A N ASN 410.A O no hydrogen 2.937 N/A LYS 415.A N GLU 411.A O no hydrogen 2.973 N/A LYS 415.A NZ GLU 418.A OE1 no hydrogen 2.970 N/A LYS 415.A NZ GLU 584.A OE2 no hydrogen 3.046 N/A LYS 416.A N THR 412.A O no hydrogen 2.892 N/A THR 417.A N VAL 413.A O no hydrogen 2.915 N/A THR 417.A OG1 VAL 413.A O no hydrogen 3.287 N/A THR 417.A OG1 HIS 414.A O no hydrogen 2.483 N/A GLU 418.A N HIS 414.A O no hydrogen 2.970 N/A VAL 419.A N LYS 415.A O no hydrogen 2.932 N/A VAL 420.A N LYS 416.A O no hydrogen 2.880 N/A ILE 421.A N THR 417.A O no hydrogen 2.959 N/A THR 422.A OG1 GLU 418.A O no hydrogen 3.208 N/A LEU 423.A N VAL 419.A O no hydrogen 2.891 N/A ASP 424.A N VAL 420.A O no hydrogen 2.922 N/A PHE 425.A N ILE 421.A O no hydrogen 2.924 N/A CYS 426.A SG THR 422.A O no hydrogen 3.159 N/A ILE 427.A N LEU 423.A O no hydrogen 2.883 N/A ARG 428.A N ASP 424.A O no hydrogen 2.943 N/A LYS 432.A N ARG 428.A O no hydrogen 2.912 N/A THR 433.A N ILE 430.A O no hydrogen 2.843 N/A THR 433.A OG1 ILE 430.A O no hydrogen 2.582 N/A VAL 434.A N ILE 430.A O no hydrogen 2.913 N/A LYS 435.A N GLU 431.A O no hydrogen 3.341 N/A ILE 441.A N LEU 438.A O no hydrogen 3.315 N/A SER 442.A N LEU 438.A O no hydrogen 2.790 N/A SER 442.A OG LEU 438.A O no hydrogen 3.125 N/A SER 442.A OG GLY 439.A O no hydrogen 3.230 N/A ASP 443.A N GLY 439.A O no hydrogen 2.929 N/A HIS 445.A N ILE 441.A O no hydrogen 2.923 N/A THR 446.A N SER 442.A O no hydrogen 2.907 N/A THR 446.A OG1 SER 442.A O no hydrogen 3.041 N/A THR 446.A OG1 ASP 443.A O no hydrogen 2.697 N/A LYS 447.A N ASP 443.A O no hydrogen 2.961 N/A LYS 447.A N ILE 444.A O no hydrogen 3.212 N/A LEU 448.A N ILE 444.A O no hydrogen 2.836 N/A LEU 449.A N HIS 445.A O no hydrogen 2.930 N/A ARG 450.A NE THR 446.A O no hydrogen 3.303 N/A LEU 451.A N LYS 447.A O no hydrogen 2.936 N/A SER 452.A N LEU 448.A O no hydrogen 2.891 N/A SER 452.A OG LEU 449.A O no hydrogen 3.015 N/A SER 453.A N LEU 449.A O no hydrogen 2.919 N/A SER 453.A OG LEU 449.A O no hydrogen 3.283 N/A SER 453.A OG ARG 450.A O no hydrogen 2.518 N/A SER 454.A N ARG 450.A O no hydrogen 2.932 N/A SER 454.A OG ARG 450.A O no hydrogen 3.076 N/A SER 454.A OG LEU 451.A O no hydrogen 3.152 N/A GLN 455.A N LEU 451.A O no hydrogen 2.895 N/A GLY 456.A N SER 452.A O no hydrogen 2.905 N/A THR 457.A N SER 453.A O no hydrogen 2.943 N/A THR 457.A OG1 SER 454.A O no hydrogen 2.309 N/A ILE 458.A N SER 454.A O no hydrogen 2.919 N/A GLU 459.A N GLN 455.A O no hydrogen 2.907 N/A THR 460.A N GLY 456.A O no hydrogen 2.926 N/A THR 460.A OG1 GLY 456.A O no hydrogen 3.403 N/A THR 460.A OG1 THR 457.A O no hydrogen 2.680 N/A SER 461.A N THR 457.A O no hydrogen 2.919 N/A SER 461.A OG THR 457.A O no hydrogen 2.849 N/A SER 461.A OG ILE 458.A O no hydrogen 3.033 N/A LEU 462.A N ILE 458.A O no hydrogen 2.884 N/A LEU 462.A N GLU 459.A O no hydrogen 3.132 N/A GLN 463.A N GLU 459.A O no hydrogen 2.912 N/A GLN 463.A NE2 GLU 459.A OE2 no hydrogen 2.541 N/A ASP 464.A N THR 460.A O no hydrogen 2.933 N/A ASP 466.A N LEU 462.A O no hydrogen 2.904 N/A SER 467.A N GLN 463.A O no hydrogen 3.042 N/A ARG 468.A N ASP 464.A O no hydrogen 2.938 N/A LEU 469.A N ILE 465.A O no hydrogen 2.774 N/A SER 470.A OG SER 467.A O no hydrogen 2.714 N/A GLY 473.A N SER 470.A O no hydrogen 3.069 N/A SER 474.A OG GLY 473.A O no hydrogen 2.520 N/A ASP 477.A N ASP 477.A OD1 no hydrogen 2.525 N/A GLN 482.A N TRP 479.A O no hydrogen 2.880 N/A THR 485.A OG1 GLN 391.A OE1 no hydrogen 2.871 N/A HIS 486.A N ASP 489.A OD1 no hydrogen 3.297 N/A ASP 489.A N HIS 486.A O no hydrogen 3.115 N/A GLU 493.A N GLU 493.A OE1 no hydrogen 2.527 N/A LYS 494.A N ARG 490.A O no hydrogen 2.966 N/A LYS 494.A NZ ASP 489.A O no hydrogen 3.143 N/A LEU 495.A N ASN 491.A O no hydrogen 2.923 N/A GLN 496.A N VAL 492.A O no hydrogen 2.911 N/A VAL 497.A N GLU 493.A O no hydrogen 2.925 N/A LEU 499.A N LEU 495.A O no hydrogen 2.913 N/A ASN 500.A N GLN 496.A O no hydrogen 2.897 N/A CYS 501.A N VAL 497.A O no hydrogen 2.963 N/A CYS 501.A SG VAL 497.A O no hydrogen 3.596 N/A MET 502.A N LEU 498.A O no hydrogen 2.906 N/A THR 503.A N LEU 499.A O no hydrogen 2.884 N/A THR 503.A OG1 LEU 499.A O no hydrogen 2.616 N/A GLU 504.A N ASN 500.A O no hydrogen 2.915 N/A ILE 505.A N CYS 501.A O no hydrogen 2.949 N/A TYR 506.A N MET 502.A O no hydrogen 2.900 N/A TYR 507.A N THR 503.A O no hydrogen 2.894 N/A GLN 508.A N GLU 504.A O no hydrogen 2.932 N/A GLN 508.A NE2 ASP 512.A OD1 no hydrogen 3.036 N/A PHE 509.A N ILE 505.A O no hydrogen 2.920 N/A LYS 510.A N TYR 506.A O no hydrogen 2.871 N/A LYS 511.A N TYR 507.A O no hydrogen 2.925 N/A ASP 512.A N GLN 508.A O no hydrogen 2.894 N/A LYS 513.A N PHE 509.A O no hydrogen 2.906 N/A GLU 522.A N GLU 522.A OE1 no hydrogen 2.579 N/A GLU 523.A N ALA 519.A O no hydrogen 2.755 N/A GLN 524.A N TYR 520.A O no hydrogen 2.952 N/A GLN 524.A NE2 TYR 520.A O no hydrogen 3.208 N/A ILE 525.A N ASN 521.A O no hydrogen 2.942 N/A HIS 526.A N GLU 522.A O no hydrogen 2.911 N/A HIS 526.A ND1 ASP 512.A OD2 no hydrogen 3.112 N/A HIS 526.A NE2 ASP 366.A OD2 no hydrogen 2.853 N/A LYS 527.A N GLU 523.A O no hydrogen 2.944 N/A LYS 527.A NZ GLU 523.A OE2 no hydrogen 3.221 N/A PHE 528.A N GLN 524.A O no hydrogen 2.916 N/A ASP 529.A N ILE 525.A O no hydrogen 2.939 N/A LYS 530.A N HIS 526.A O no hydrogen 2.918 N/A LYS 530.A NZ HIS 358.A O no hydrogen 2.954 N/A LYS 530.A NZ ASP 366.A OD1 no hydrogen 2.802 N/A LYS 530.A NZ ASP 366.A OD2 no hydrogen 3.135 N/A GLN 531.A N LYS 527.A O no hydrogen 2.970 N/A GLN 531.A NE2 TYR 535.A OH no hydrogen 3.401 N/A LYS 532.A N PHE 528.A O no hydrogen 2.946 N/A LYS 532.A NZ ASP 529.A OD1 no hydrogen 3.498 N/A LEU 533.A N ASP 529.A O no hydrogen 2.917 N/A TYR 535.A N GLN 531.A O no hydrogen 3.009 N/A HIS 536.A N LYS 532.A O no hydrogen 2.910 N/A ALA 537.A N LEU 533.A O no hydrogen 2.943 N/A THR 538.A N TYR 534.A O no hydrogen 2.901 N/A THR 538.A OG1 TYR 534.A O no hydrogen 2.849 N/A LYS 539.A N TYR 535.A O no hydrogen 2.945 N/A ALA 540.A N HIS 536.A O no hydrogen 2.908 N/A MET 541.A N ALA 537.A O no hydrogen 2.926 N/A THR 542.A N THR 538.A O no hydrogen 2.925 N/A THR 542.A OG1 THR 538.A O no hydrogen 2.887 N/A HIS 543.A N LYS 539.A O no hydrogen 2.933 N/A PHE 544.A N ALA 540.A O no hydrogen 2.898 N/A PHE 544.A N MET 541.A O no hydrogen 3.113 N/A THR 545.A N MET 541.A O no hydrogen 2.929 N/A THR 545.A OG1 MET 541.A O no hydrogen 2.939 N/A THR 545.A OG1 ASP 546.A OD1 no hydrogen 2.780 N/A ASP 546.A N THR 542.A O no hydrogen 3.158 N/A CYS 548.A N PHE 544.A O no hydrogen 3.075 N/A CYS 548.A SG HIS 543.A O no hydrogen 4.043 N/A VAL 549.A N PHE 544.A O no hydrogen 3.091 N/A LYS 551.A N GLU 547.A O no hydrogen 3.339 N/A LYS 551.A NZ GLU 547.A OE2 no hydrogen 2.672 N/A TYR 552.A N CYS 548.A O no hydrogen 2.926 N/A GLU 553.A N VAL 549.A O no hydrogen 2.896 N/A ALA 554.A N LYS 550.A O no hydrogen 2.937 N/A PHE 555.A N LYS 551.A O no hydrogen 2.925 N/A LEU 556.A N TYR 552.A O no hydrogen 2.883 N/A ASN 557.A N GLU 553.A O no hydrogen 2.925 N/A LYS 558.A N ALA 554.A O no hydrogen 2.959 N/A SER 559.A N PHE 555.A O no hydrogen 2.906 N/A SER 559.A OG PHE 555.A O no hydrogen 2.569 N/A GLU 560.A N LEU 556.A O no hydrogen 2.898 N/A GLU 561.A N ASN 557.A O no hydrogen 3.016 N/A TRP 562.A N LYS 558.A O no hydrogen 2.941 N/A ILE 563.A N SER 559.A O no hydrogen 2.900 N/A LYS 565.A N GLU 561.A O no hydrogen 3.043 N/A MET 566.A N TRP 562.A O no hydrogen 2.896 N/A LEU 567.A N ILE 563.A O no hydrogen 2.897 N/A HIS 568.A N ARG 564.A O no hydrogen 2.969 N/A LEU 569.A N LYS 565.A O no hydrogen 2.973 N/A ARG 570.A N MET 566.A O no hydrogen 2.888 N/A ARG 570.A NH2 GLU 306.A OE1 no hydrogen 3.006 N/A LYS 571.A N LEU 567.A O no hydrogen 2.955 N/A GLN 572.A N HIS 568.A O no hydrogen 2.973 N/A LEU 573.A N LEU 569.A O no hydrogen 2.905 N/A LEU 574.A N ARG 570.A O no hydrogen 2.927 N/A SER 575.A N LYS 571.A O no hydrogen 2.948 N/A LEU 576.A N GLN 572.A O no hydrogen 2.907 N/A THR 577.A N LEU 573.A O no hydrogen 2.930 N/A THR 577.A OG1 THR 412.A OG1 no hydrogen 2.905 N/A THR 577.A OG1 LEU 573.A O no hydrogen 2.887 N/A ASN 578.A N LEU 574.A O no hydrogen 2.914 N/A GLN 579.A N SER 575.A O no hydrogen 2.906 N/A CYS 580.A N THR 577.A O no hydrogen 2.840 N/A CYS 580.A SG LEU 576.A O no hydrogen 3.307 N/A PHE 581.A N THR 577.A O no hydrogen 2.939 N/A PHE 581.A N ASN 578.A O no hydrogen 3.281 N/A ASP 582.A N ASN 578.A O no hydrogen 3.204 N/A GLU 585.A N PHE 581.A O no hydrogen 3.242 N/A GLU 586.A N ASP 582.A O no hydrogen 3.179 N/A VAL 587.A N ILE 583.A O no hydrogen 3.060 N/A SER 588.A N GLU 585.A O no hydrogen 3.258 N/A SER 588.A OG GLU 585.A O no hydrogen 2.360 N/A LYS 589.A NZ GLU 586.A OE2 no hydrogen 3.527 N/A TYR 590.A N VAL 587.A O no hydrogen 3.422 N/A GLN 591.A N VAL 587.A O no hydrogen 2.993 N/A THR 594.A OG1 GLU 440.A OE2 no hydrogen 3.332 N/A ASN 595.A ND2 ASN 429.A OD1 no hydrogen 2.411 N/A GLU 599.A N GLN 598.A OE1 no hydrogen 3.180 N/A