Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ifg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N GLU 1.A O no hydrogen 2.933 N/A ALA 6.A N LEU 2.A O no hydrogen 2.883 N/A PHE 7.A N ASP 3.A O no hydrogen 2.919 N/A VAL 8.A N ILE 4.A O no hydrogen 2.953 N/A GLN 9.A N LYS 5.A O no hydrogen 2.965 N/A LYS 10.A N ALA 6.A O no hydrogen 2.879 N/A LYS 10.A NZ LYS 10.A O no hydrogen 3.351 N/A LEU 11.A N PHE 7.A O no hydrogen 2.875 N/A GLY 12.A N VAL 8.A O no hydrogen 2.933 N/A GLN 13.A N GLN 9.A O no hydrogen 2.933 N/A ARG 14.A N LYS 10.A O no hydrogen 2.900 N/A LEU 15.A N LEU 11.A O no hydrogen 2.909 N/A CYS 16.A SG GLN 13.A O no hydrogen 4.023 N/A ARG 18.A N LEU 15.A O no hydrogen 3.319 N/A SER 23.A N PRO 19.A O no hydrogen 2.911 N/A SER 23.A OG TYR 20.A O no hydrogen 3.110 N/A ALA 24.A N TYR 20.A O no hydrogen 2.874 N/A PHE 25.A N VAL 21.A O no hydrogen 2.898 N/A MET 26.A N TYR 22.A O no hydrogen 2.997 N/A ASP 27.A N SER 23.A O no hydrogen 2.875 N/A VAL 28.A N ALA 24.A O no hydrogen 2.924 N/A VAL 29.A N PHE 25.A O no hydrogen 2.999 N/A LYS 30.A N MET 26.A O no hydrogen 2.898 N/A ALA 31.A N ASP 27.A O no hydrogen 2.890 N/A LEU 32.A N VAL 28.A O no hydrogen 2.949 N/A HIS 33.A N VAL 29.A O no hydrogen 2.969 N/A ASN 34.A N LYS 30.A O no hydrogen 2.927 N/A ILE 36.A N ALA 31.A O no hydrogen 2.920 N/A PHE 42.A N PHE 39.A O no hydrogen 3.051 N/A ILE 43.A N PHE 39.A O no hydrogen 2.971 N/A ARG 45.A NE GLY 41.A O no hydrogen 2.605 N/A SER 47.A OG THR 91.A OG1 no hydrogen 3.014 N/A LEU 56.A N ASP 52.A O no hydrogen 2.958 N/A LEU 57.A N TYR 53.A O no hydrogen 2.900 N/A GLU 58.A N PRO 54.A O no hydrogen 2.851 N/A TYR 59.A N ASP 55.A O no hydrogen 2.995 N/A TYR 59.A OH TYR 68.A O no hydrogen 2.557 N/A ASN 61.A N GLU 58.A O no hydrogen 3.270 N/A ASN 61.A ND2 LEU 57.A O no hydrogen 3.409 N/A ILE 62.A N GLU 58.A O no hydrogen 2.959 N/A TYR 68.A OH ILE 43.A O no hydrogen 2.438 N/A TYR 70.A OH ASP 55.A OD2 no hydrogen 2.216 N/A LEU 71.A N PHE 75.A O no hydrogen 3.498 N/A PHE 75.A N LEU 71.A O no hydrogen 3.265 N/A THR 76.A OG1 THR 76.A O no hydrogen 2.450 N/A GLN 78.A N PRO 85.A O no hydrogen 3.085 N/A GLN 78.A NE2 SER 66.A O no hydrogen 3.456 N/A PHE 79.A N SER 67.A O no hydrogen 3.152 N/A THR 80.A OG1 PRO 82.A O no hydrogen 3.115 N/A THR 88.A OG1 SER 90.A O no hydrogen 2.714 N/A THR 91.A OG1 SER 47.A OG no hydrogen 3.014 N/A ALA 94.A N TYR 92.A O no hydrogen 2.771 N/A THR 95.A OG1 GLU 44.A OE2 no hydrogen 3.380 N/A THR 95.A OG1 THR 95.A O no hydrogen 2.565 N/A TYR 96.A N GLY 185.A O no hydrogen 2.918 N/A CYS 101.A SG ASP 98.A OD2 no hydrogen 3.248 N/A TYR 103.A N LEU 99.A O no hydrogen 2.994 N/A HIS 104.A N PRO 100.A O no hydrogen 2.926 N/A ARG 105.A N CYS 101.A O no hydrogen 2.968 N/A ALA 106.A N THR 102.A O no hydrogen 2.925 N/A ILE 107.A N TYR 103.A O no hydrogen 2.936 N/A GLY 108.A N HIS 104.A O no hydrogen 2.952 N/A PHE 109.A N ARG 105.A O no hydrogen 2.929 N/A VAL 110.A N ALA 106.A O no hydrogen 2.935 N/A SER 111.A N ILE 107.A O no hydrogen 2.941 N/A SER 111.A OG ILE 107.A O no hydrogen 3.260 N/A SER 111.A OG GLY 108.A O no hydrogen 2.571 N/A ARG 112.A N GLY 108.A O no hydrogen 2.954 N/A VAL 113.A N PHE 109.A O no hydrogen 2.928 N/A ARG 114.A N VAL 110.A O no hydrogen 2.883 N/A ARG 115.A N SER 111.A O no hydrogen 2.925 N/A ALA 116.A N ARG 112.A O no hydrogen 2.929 N/A ALA 116.A N VAL 113.A O no hydrogen 3.233 N/A LEU 117.A N VAL 113.A O no hydrogen 2.911 N/A ASN 120.A N ASN 120.A OD1 no hydrogen 2.199 N/A PHE 124.A N ASN 120.A O no hydrogen 2.979 N/A PHE 125.A N PRO 121.A O no hydrogen 2.847 N/A LYS 126.A N GLU 122.A O no hydrogen 3.017 N/A LEU 127.A N GLN 123.A O no hydrogen 2.909 N/A GLN 128.A N PHE 124.A O no hydrogen 2.948 N/A ASP 129.A N PHE 125.A O no hydrogen 2.901 N/A SER 130.A N LYS 126.A O no hydrogen 2.997 N/A LEU 131.A N LEU 127.A O no hydrogen 2.944 N/A ARG 132.A N GLN 128.A O no hydrogen 2.894 N/A ARG 132.A NH2 ASP 129.A OD1 no hydrogen 3.109 N/A LYS 133.A N ASP 129.A O no hydrogen 2.972 N/A PHE 134.A N SER 130.A O no hydrogen 2.949 N/A LYS 135.A N LEU 131.A O no hydrogen 2.931 N/A ASN 136.A N LYS 133.A O no hydrogen 3.265 N/A SER 137.A N ARG 132.A O no hydrogen 3.018 N/A SER 137.A OG SER 137.A O no hydrogen 2.426 N/A CYS 139.A SG GLU 138.A OE1 no hydrogen 3.247 N/A CYS 139.A SG SER 142.A OG no hydrogen 2.595 N/A CYS 139.A SG GLU 143.A OE1 no hydrogen 3.176 N/A SER 140.A OG SER 140.A O no hydrogen 2.382 N/A LEU 141.A N CYS 139.A O no hydrogen 2.880 N/A GLN 145.A N LEU 141.A O no hydrogen 2.915 N/A THR 146.A N SER 142.A O no hydrogen 2.959 N/A THR 146.A OG1 SER 142.A O no hydrogen 2.565 N/A ILE 147.A N GLU 143.A O no hydrogen 2.891 N/A VAL 148.A N LEU 144.A O no hydrogen 2.930 N/A THR 149.A N GLN 145.A O no hydrogen 2.932 N/A THR 149.A OG1 GLN 145.A O no hydrogen 3.060 N/A SER 150.A N THR 146.A O no hydrogen 2.916 N/A LEU 151.A N ILE 147.A O no hydrogen 2.913 N/A ALA 159.A N HIS 155.A O no hydrogen 3.008 N/A HIS 160.A N PRO 156.A O no hydrogen 2.891 N/A GLU 161.A N SER 157.A O no hydrogen 2.891 N/A PHE 162.A N LEU 158.A O no hydrogen 2.947 N/A ASN 164.A N GLU 161.A O no hydrogen 3.213 N/A PHE 165.A N PHE 162.A O no hydrogen 3.150 N/A LEU 166.A N HIS 163.A O no hydrogen 3.269 N/A SER 169.A N LEU 166.A O no hydrogen 3.227 N/A SER 174.A N PHE 172.A O no hydrogen 2.896 N/A SER 180.A OG PHE 181.A O no hydrogen 2.833 N/A ARG 184.A NH2 THR 95.A O no hydrogen 3.192 N/A GLY 185.A N TYR 96.A O no hydrogen 2.882 N/A SER 189.A OG ASN 195.A O no hydrogen 2.327 N/A GLN 190.A NE2 SER 188.A OG no hydrogen 3.389 N/A PHE 191.A N SER 189.A O no hydrogen 2.596 N/A THR 192.A OG1 SER 194.A O no hydrogen 3.016 N/A SER 194.A OG SER 194.A O no hydrogen 2.348 N/A SER 197.A N SER 194.A O no hydrogen 3.262 N/A SER 197.A OG SER 194.A O no hydrogen 3.524 N/A SER 197.A OG SER 194.A OG no hydrogen 3.284 N/A GLN 202.A N ASP 198.A O no hydrogen 2.954 N/A GLN 202.A NE2 LYS 256.A O no hydrogen 2.537 N/A SER 203.A OG LEU 199.A O no hydrogen 2.460 N/A SER 211.A OG ASN 208.A O no hydrogen 2.542 N/A ASP 212.A N ASN 208.A O no hydrogen 2.926 N/A PHE 213.A N GLU 209.A O no hydrogen 2.855 N/A PHE 214.A N SER 210.A O no hydrogen 2.946 N/A LYS 215.A N SER 211.A O no hydrogen 2.967 N/A ASN 216.A N ASP 212.A O no hydrogen 2.922 N/A VAL 217.A N PHE 213.A O no hydrogen 2.914 N/A LYS 218.A N PHE 214.A O no hydrogen 2.972 N/A ASN 219.A N LYS 215.A O no hydrogen 2.938 N/A VAL 220.A N ASN 216.A O no hydrogen 2.899 N/A LEU 221.A N VAL 217.A O no hydrogen 2.924 N/A TYR 227.A N ASP 223.A O no hydrogen 3.010 N/A HIS 228.A N VAL 224.A O no hydrogen 2.878 N/A GLU 229.A N GLU 225.A O no hydrogen 2.957 N/A PHE 230.A N THR 226.A O no hydrogen 2.958 N/A LEU 231.A N TYR 227.A O no hydrogen 2.989 N/A LYS 232.A N HIS 228.A O no hydrogen 2.890 N/A LEU 233.A N GLU 229.A O no hydrogen 2.977 N/A LEU 234.A N PHE 230.A O no hydrogen 3.024 N/A ASN 235.A N LEU 231.A O no hydrogen 2.919 N/A LEU 236.A N LYS 232.A O no hydrogen 2.943 N/A TYR 237.A N LEU 233.A O no hydrogen 3.073 N/A VAL 238.A N LEU 234.A O no hydrogen 2.930 N/A GLN 239.A N ASN 235.A O no hydrogen 2.959 N/A GLN 239.A NE2 ASN 235.A OD1 no hydrogen 3.642 N/A GLY 240.A N LEU 236.A O no hydrogen 2.975 N/A ILE 241.A N LEU 236.A O no hydrogen 3.198 N/A ARG 244.A NH1 THR 269.A O no hydrogen 3.210 N/A ILE 246.A N ASP 243.A OD1 no hydrogen 3.239 N/A LEU 247.A N ASP 243.A O no hydrogen 2.947 N/A VAL 248.A N ARG 244.A O no hydrogen 2.955 N/A SER 249.A N ASN 245.A O no hydrogen 2.933 N/A SER 249.A OG ASN 245.A O no hydrogen 2.551 N/A ARG 250.A N ILE 246.A O no hydrogen 2.920 N/A GLY 251.A N LEU 247.A O no hydrogen 2.875 N/A PHE 252.A N VAL 248.A O no hydrogen 3.017 N/A PHE 254.A N GLY 251.A O no hydrogen 3.036 N/A LEU 255.A N GLY 251.A O no hydrogen 2.973 N/A ASN 258.A N LEU 255.A O no hydrogen 3.403 N/A GLY 260.A N ASN 258.A OD1 no hydrogen 3.127 N/A TRP 262.A N ASN 258.A O no hydrogen 2.990 N/A ARG 263.A N SER 259.A O no hydrogen 2.914 N/A ARG 263.A NH2 ASP 206.A OD2 no hydrogen 2.300 N/A SER 264.A N GLY 260.A O no hydrogen 2.920 N/A PHE 265.A N LEU 261.A O no hydrogen 2.884 N/A LEU 266.A N TRP 262.A O no hydrogen 2.958 N/A SER 267.A N ARG 263.A O no hydrogen 2.929 N/A SER 267.A OG ARG 263.A O no hydrogen 3.403 N/A SER 267.A OG SER 264.A O no hydrogen 2.467 N/A LEU 268.A N SER 264.A O no hydrogen 2.897 N/A THR 269.A N PHE 265.A O no hydrogen 2.919 N/A THR 269.A OG1 PHE 265.A O no hydrogen 3.170 N/A THR 269.A OG1 LEU 266.A O no hydrogen 3.027 N/A LEU 271.A N LEU 266.A O no hydrogen 3.095 N/A GLU 275.A N SER 272.A OG no hydrogen 3.412 N/A PHE 276.A N SER 272.A O no hydrogen 2.932 N/A LEU 277.A N PRO 273.A O no hydrogen 2.935 N/A SER 278.A N GLU 274.A O no hydrogen 2.946 N/A VAL 279.A N GLU 275.A O no hydrogen 2.938 N/A TYR 280.A N PHE 276.A O no hydrogen 2.933 N/A ALA 283.A N VAL 279.A O no hydrogen 3.117 N/A ALA 283.A N TYR 280.A O no hydrogen 3.167 N/A ASP 286.A N ASP 286.A OD1 no hydrogen 2.665 N/A CYS 290.A SG GLY 291.A O no hydrogen 3.393 N/A CYS 290.A SG TYR 294.A O no hydrogen 3.109 N/A GLY 291.A N PRO 288.A O no hydrogen 3.139 N/A ARG 295.A N VAL 322.A O no hydrogen 2.956 N/A GLU 300.A N GLU 300.A OE1 no hydrogen 2.724 N/A ARG 302.A N VAL 299.A O no hydrogen 3.468 N/A ARG 302.A NH2 LEU 297.A O no hydrogen 2.535 N/A CYS 306.A SG SER 305.A O no hydrogen 3.186 N/A ARG 309.A N CYS 306.A O no hydrogen 3.189 N/A ARG 309.A NH1 ASP 319.A OD2 no hydrogen 2.822 N/A ASP 311.A N ASP 311.A OD1 no hydrogen 2.410 N/A ALA 313.A N ASP 310.A OD1 no hydrogen 2.751 N/A TRP 314.A N ASP 310.A O no hydrogen 2.919 N/A GLY 315.A N ASP 311.A O no hydrogen 2.946 N/A ILE 316.A N ALA 313.A O no hydrogen 3.150 N/A LEU 317.A N ALA 313.A O no hydrogen 2.955 N/A ASN 318.A ND2 TRP 321.A O no hydrogen 2.933 N/A ASP 320.A N ASN 318.A OD1 no hydrogen 3.035 N/A TRP 321.A N ASN 318.A OD1 no hydrogen 3.361 N/A VAL 322.A N ARG 295.A O no hydrogen 2.906 N/A HIS 324.A NE2 GLU 330.A O no hydrogen 2.380 N/A SER 332.A OG GLU 331.A O no hydrogen 2.606 N/A GLN 337.A N GLN 337.A OE1 no hydrogen 2.501 N/A ARG 338.A NH1 GLU 344.A OE2 no hydrogen 3.055 N/A GLU 343.A N THR 340.A OG1 no hydrogen 3.309 N/A GLU 344.A N THR 340.A O no hydrogen 2.996 N/A ALA 345.A N PRO 341.A O no hydrogen 2.926 N/A MET 346.A N TYR 342.A O no hydrogen 2.980 N/A THR 347.A N GLU 343.A O no hydrogen 2.943 N/A THR 347.A OG1 GLU 343.A O no hydrogen 3.007 N/A LYS 348.A N GLU 344.A O no hydrogen 2.962 N/A LYS 348.A NZ GLU 344.A O no hydrogen 3.038 N/A LEU 349.A N ALA 345.A O no hydrogen 2.993 N/A GLU 350.A N MET 346.A O no hydrogen 2.985 N/A GLU 351.A N THR 347.A O no hydrogen 2.940 N/A GLU 352.A N LYS 348.A O no hydrogen 3.005 N/A ARG 353.A N LEU 349.A O no hydrogen 3.053 N/A ARG 353.A NH1 GLU 459.A OE2 no hydrogen 3.317 N/A TYR 354.A N GLU 350.A O no hydrogen 2.923 N/A GLU 355.A N GLU 351.A O no hydrogen 2.970 N/A PHE 356.A N GLU 352.A O no hydrogen 3.160 N/A ASP 357.A N ARG 353.A O no hydrogen 2.951 N/A ARG 358.A N TYR 354.A O no hydrogen 2.843 N/A ARG 358.A NH2 GLU 355.A OE2 no hydrogen 2.384 N/A HIS 359.A N GLU 355.A O no hydrogen 3.130 N/A ILE 360.A N PHE 356.A O no hydrogen 3.029 N/A GLU 361.A N ASP 357.A O no hydrogen 2.909 N/A ALA 362.A N ARG 358.A O no hydrogen 2.966 N/A THR 363.A N HIS 359.A O no hydrogen 3.047 N/A THR 363.A OG1 HIS 359.A O no hydrogen 3.113 N/A SER 364.A N ILE 360.A O no hydrogen 2.938 N/A TRP 365.A N GLU 361.A O no hydrogen 2.871 N/A THR 366.A N ALA 362.A O no hydrogen 3.037 N/A THR 366.A OG1 ALA 362.A O no hydrogen 3.377 N/A ILE 367.A N THR 363.A O no hydrogen 2.935 N/A LYS 368.A N SER 364.A O no hydrogen 2.936 N/A SER 369.A N TRP 365.A O no hydrogen 2.946 N/A LEU 370.A N THR 366.A O no hydrogen 2.918 N/A LYS 371.A N ILE 367.A O no hydrogen 2.883 N/A LYS 372.A N LYS 368.A O no hydrogen 2.941 N/A ILE 373.A N SER 369.A O no hydrogen 2.998 N/A GLN 374.A N LEU 370.A O no hydrogen 2.872 N/A ASN 375.A N LYS 371.A O no hydrogen 2.854 N/A ARG 376.A N LYS 372.A O no hydrogen 2.961 N/A ILE 377.A N ILE 373.A O no hydrogen 2.946 N/A ASN 378.A N GLN 374.A O no hydrogen 2.868 N/A GLU 379.A N ASN 375.A O no hydrogen 2.894 N/A LEU 380.A N ARG 376.A O no hydrogen 2.985 N/A GLU 382.A N GLU 382.A OE2 no hydrogen 2.598 N/A GLU 383.A N GLU 383.A OE2 no hydrogen 2.486 N/A GLU 384.A N GLU 384.A OE1 no hydrogen 2.593 N/A ARG 385.A N PRO 381.A O no hydrogen 2.825 N/A ARG 385.A NE LEU 380.A O no hydrogen 2.440 N/A ARG 385.A NH2 LEU 380.A O no hydrogen 3.379 N/A GLU 386.A N GLU 382.A O no hydrogen 2.924 N/A GLU 386.A N GLU 383.A O no hydrogen 3.088 N/A THR 387.A N GLU 383.A O no hydrogen 2.994 N/A THR 387.A OG1 THR 387.A O no hydrogen 2.486 N/A THR 389.A OG1 TYR 388.A O no hydrogen 2.587 N/A LEU 394.A N GLU 391.A O no hydrogen 2.678 N/A LEU 396.A N GLY 393.A O no hydrogen 3.167 N/A LYS 399.A NZ GLU 392.A OE1 no hydrogen 3.413 N/A LYS 403.A N LYS 399.A O no hydrogen 2.964 N/A LYS 403.A NZ GLU 392.A OE2 no hydrogen 3.056 N/A LYS 404.A N SER 400.A O no hydrogen 2.898 N/A THR 405.A N ILE 401.A O no hydrogen 2.901 N/A ILE 406.A N TYR 402.A O no hydrogen 3.013 N/A LYS 407.A N LYS 403.A O no hydrogen 2.989 N/A LEU 408.A N LYS 404.A O no hydrogen 2.930 N/A VAL 409.A N THR 405.A O no hydrogen 2.891 N/A TYR 410.A N ILE 406.A O no hydrogen 2.988 N/A THR 411.A OG1 GLU 413.A OE2 no hydrogen 3.292 N/A HIS 414.A N THR 411.A OG1 no hydrogen 3.217 N/A MET 418.A N HIS 414.A O no hydrogen 2.949 N/A PHE 419.A N ALA 415.A O no hydrogen 2.857 N/A LYS 420.A N GLU 416.A O no hydrogen 2.940 N/A ALA 421.A N GLU 417.A O no hydrogen 2.931 N/A LEU 422.A N MET 418.A O no hydrogen 2.920 N/A GLU 423.A N PHE 419.A O no hydrogen 2.889 N/A ARG 424.A N LYS 420.A O no hydrogen 2.897 N/A MET 425.A N ALA 421.A O no hydrogen 2.904 N/A CYS 427.A SG ARG 385.A O no hydrogen 3.229 N/A THR 429.A OG1 MET 425.A O no hydrogen 2.356 N/A LEU 430.A N PRO 426.A O no hydrogen 2.939 N/A VAL 433.A N THR 429.A O no hydrogen 3.367 N/A ILE 434.A N LEU 430.A O no hydrogen 2.950 N/A SER 435.A N PRO 431.A O no hydrogen 2.935 N/A SER 435.A OG PRO 431.A O no hydrogen 3.339 N/A SER 435.A OG LEU 432.A O no hydrogen 2.444 N/A ARG 436.A N LEU 432.A O no hydrogen 2.964 N/A LEU 437.A N VAL 433.A O no hydrogen 2.950 N/A GLU 438.A N ILE 434.A O no hydrogen 2.928 N/A GLU 439.A N SER 435.A O no hydrogen 2.960 N/A LYS 440.A N ARG 436.A O no hydrogen 3.033 N/A ASN 441.A N LEU 437.A O no hydrogen 2.936 N/A GLU 442.A N GLU 438.A O no hydrogen 2.956 N/A GLU 443.A N GLU 439.A O no hydrogen 3.018 N/A TRP 444.A N LYS 440.A O no hydrogen 3.014 N/A LYS 445.A N ASN 441.A O no hydrogen 2.926 N/A SER 446.A N GLU 442.A O no hydrogen 2.965 N/A SER 446.A OG GLU 443.A O no hydrogen 2.838 N/A VAL 447.A N GLU 443.A O no hydrogen 3.053 N/A LYS 448.A N TRP 444.A O no hydrogen 2.956 N/A ARG 449.A N LYS 445.A O no hydrogen 2.961 N/A SER 450.A N SER 446.A O no hydrogen 2.953 N/A LEU 451.A N VAL 447.A O no hydrogen 2.951 N/A LEU 451.A N LYS 448.A O no hydrogen 3.114 N/A ARG 456.A N GLN 452.A O no hydrogen 3.031 N/A SER 457.A N PRO 453.A O no hydrogen 2.945 N/A ILE 458.A N GLY 454.A O no hydrogen 2.965 N/A GLU 459.A N TRP 455.A O no hydrogen 2.941 N/A PHE 460.A N ARG 456.A O no hydrogen 2.923 N/A LYS 461.A N SER 457.A O no hydrogen 2.950 N/A ASN 462.A N ILE 458.A O no hydrogen 2.981 N/A ASN 462.A ND2 ILE 458.A O no hydrogen 3.639 N/A SER 466.A N TYR 463.A O no hydrogen 2.867 N/A SER 466.A OG TYR 463.A O no hydrogen 2.567 N/A LEU 467.A N ASP 464.A O no hydrogen 3.098 N/A ASP 468.A N ASP 464.A O no hydrogen 2.982 N/A SER 469.A N LEU 467.A O no hydrogen 2.676 N/A CYS 471.A N ASP 468.A OD1 no hydrogen 2.998 N/A CYS 471.A SG GLU 700.A OE1 no hydrogen 3.898 N/A CYS 471.A SG GLU 700.A OE2 no hydrogen 3.389 N/A VAL 472.A N SER 469.A O no hydrogen 3.418 N/A ARG 477.A N PHE 474.A O no hydrogen 3.267 N/A ASP 478.A N PHE 474.A O no hydrogen 2.895 N/A ASP 478.A N LYS 475.A O no hydrogen 3.253 N/A LYS 479.A N LYS 475.A O no hydrogen 3.025 N/A VAL 482.A N ASP 478.A O no hydrogen 2.968 N/A SER 483.A N LYS 479.A O no hydrogen 2.957 N/A SER 483.A N LYS 480.A O no hydrogen 3.241 N/A LEU 488.A N SER 484.A O no hydrogen 3.020 N/A ALA 489.A N LYS 485.A O no hydrogen 2.942 N/A GLU 490.A N PHE 486.A O no hydrogen 2.902 N/A ALA 491.A N LEU 487.A O no hydrogen 2.996 N/A ASP 492.A N LEU 488.A O no hydrogen 3.028 N/A ILE 493.A N ALA 489.A O no hydrogen 2.932 N/A LEU 494.A N GLU 490.A O no hydrogen 2.958 N/A ARG 495.A N ALA 491.A O no hydrogen 3.021 N/A ARG 495.A NH1 GLU 812.A OE2 no hydrogen 3.378 N/A SER 496.A N ASP 492.A O no hydrogen 2.998 N/A GLN 497.A N ILE 493.A O no hydrogen 2.930 N/A GLN 497.A NE2 TYR 20.A OH no hydrogen 2.615 N/A ALA 498.A N LEU 494.A O no hydrogen 2.958 N/A LYS 499.A N ARG 495.A O no hydrogen 2.981 N/A LEU 500.A N SER 496.A O no hydrogen 2.964 N/A HIS 501.A N GLN 497.A O no hydrogen 2.925 N/A PHE 502.A N ALA 498.A O no hydrogen 2.936 N/A SER 506.A OG PHE 502.A O no hydrogen 3.174 N/A SER 506.A OG ARG 505.A O no hydrogen 2.641 N/A SER 508.A OG CYS 16.A O no hydrogen 3.462 N/A PHE 510.A N HIS 17.A O no hydrogen 3.226 N/A PHE 512.A N ILE 777.A O no hydrogen 3.080 N/A SER 513.A OG SER 513.A O no hydrogen 2.376 N/A PHE 514.A N PHE 775.A O no hydrogen 2.870 N/A TYR 516.A N LYS 773.A O no hydrogen 2.960 N/A ASN 518.A N TYR 630.A OH no hydrogen 3.076 N/A GLU 519.A N GLU 519.A OE1 no hydrogen 2.457 N/A LEU 522.A N ASN 518.A O no hydrogen 2.958 N/A PHE 523.A N GLU 519.A O no hydrogen 2.922 N/A ASP 524.A N ILE 520.A O no hydrogen 2.905 N/A THR 525.A N VAL 521.A O no hydrogen 2.925 N/A THR 525.A OG1 VAL 521.A O no hydrogen 2.715 N/A CYS 526.A N LEU 522.A O no hydrogen 3.035 N/A TYR 527.A N PHE 523.A O no hydrogen 2.850 N/A MET 528.A N ASP 524.A O no hydrogen 2.887 N/A VAL 529.A N THR 525.A O no hydrogen 3.070 N/A CYS 530.A N CYS 526.A O no hydrogen 2.988 N/A CYS 530.A SG CYS 526.A O no hydrogen 3.604 N/A CYS 530.A SG TYR 527.A O no hydrogen 3.125 N/A THR 531.A N TYR 527.A O no hydrogen 2.854 N/A THR 531.A OG1 TYR 527.A O no hydrogen 3.074 N/A TYR 532.A N MET 528.A O no hydrogen 2.939 N/A ILE 533.A N VAL 529.A O no hydrogen 3.004 N/A VAL 534.A N CYS 530.A O no hydrogen 2.924 N/A CYS 535.A N THR 531.A O no hydrogen 2.916 N/A ASN 536.A N TYR 532.A O no hydrogen 2.946 N/A SER 537.A N ILE 533.A O no hydrogen 3.049 N/A SER 537.A OG ILE 533.A O no hydrogen 2.378 N/A VAL 544.A N GLY 540.A O no hydrogen 2.918 N/A GLU 545.A N LEU 541.A O no hydrogen 2.926 N/A HIS 546.A N LYS 542.A O no hydrogen 2.940 N/A HIS 546.A ND1 ASN 550.A OD1 no hydrogen 2.739 N/A PHE 547.A N LYS 543.A O no hydrogen 2.916 N/A PHE 548.A N VAL 544.A O no hydrogen 2.941 N/A LYS 549.A N GLU 545.A O no hydrogen 2.881 N/A ASN 550.A N HIS 546.A O no hydrogen 2.934 N/A ASN 550.A N PHE 547.A O no hydrogen 3.169 N/A ILE 551.A N PHE 547.A O no hydrogen 2.899 N/A LEU 552.A N PHE 547.A O no hydrogen 3.440 N/A HIS 555.A N LEU 552.A O no hydrogen 3.046 N/A HIS 555.A ND1 ILE 551.A O no hydrogen 2.802 N/A PHE 556.A N LEU 552.A O no hydrogen 2.933 N/A GLY 557.A N PRO 553.A O no hydrogen 2.906 N/A LYS 560.A NZ GLU 593.A OE1 no hydrogen 2.589 N/A LYS 562.A N ASP 561.A OD1 no hydrogen 2.886 N/A LYS 562.A NZ ASP 589.A O no hydrogen 3.557 N/A PHE 563.A N GLU 559.A O no hydrogen 2.916 N/A SER 564.A N LYS 560.A O no hydrogen 2.892 N/A ILE 565.A N ASP 561.A O no hydrogen 2.930 N/A PHE 566.A N LYS 562.A O no hydrogen 2.955 N/A LEU 567.A N PHE 563.A O no hydrogen 2.902 N/A ASP 568.A N SER 564.A O no hydrogen 2.901 N/A GLN 569.A N ILE 565.A O no hydrogen 2.958 N/A VAL 570.A N LEU 567.A O no hydrogen 3.062 N/A PHE 571.A N LEU 567.A O no hydrogen 2.911 N/A LYS 579.A N ALA 575.A O no hydrogen 2.904 N/A ALA 580.A N ALA 576.A O no hydrogen 2.890 N/A SER 581.A N ALA 577.A O no hydrogen 2.917 N/A SER 581.A OG ALA 577.A O no hydrogen 2.842 N/A SER 581.A OG ILE 578.A O no hydrogen 3.343 N/A LEU 582.A N ILE 578.A O no hydrogen 2.922 N/A LYS 583.A NZ SER 581.A O no hydrogen 3.429 N/A TYR 584.A OH HIS 587.A NE2 no hydrogen 3.248 N/A HIS 597.A N GLN 595.A O no hydrogen 2.631 N/A ASN 603.A N GLU 602.A OE1 no hydrogen 3.044 N/A GLU 604.A N THR 601.A O no hydrogen 3.454 N/A HIS 606.A N GLU 604.A O no hydrogen 2.801 N/A ASP 610.A N TRP 768.A O no hydrogen 2.953 N/A GLN 613.A N PHE 766.A O no hydrogen 2.907 N/A GLY 615.A N PHE 764.A O no hydrogen 2.922 N/A TYR 616.A OH ILE 753.A O no hydrogen 3.353 N/A MET 619.A N TYR 616.A O no hydrogen 3.126 N/A TYR 620.A N TYR 616.A O no hydrogen 2.976 N/A VAL 621.A N SER 617.A O no hydrogen 3.015 N/A PHE 623.A N MET 619.A O no hydrogen 3.006 N/A ARG 624.A N TYR 620.A O no hydrogen 3.022 N/A LEU 625.A N VAL 621.A O no hydrogen 2.958 N/A PHE 626.A N PHE 622.A O no hydrogen 2.892 N/A ASN 627.A N PHE 623.A O no hydrogen 2.947 N/A LEU 628.A N ARG 624.A O no hydrogen 2.969 N/A LEU 629.A N LEU 625.A O no hydrogen 2.968 N/A TYR 630.A N PHE 626.A O no hydrogen 2.929 N/A GLU 631.A N ASN 627.A O no hydrogen 2.880 N/A ARG 632.A N LEU 628.A O no hydrogen 2.972 N/A ARG 632.A NH1 ASP 478.A OD1 no hydrogen 3.467 N/A ARG 632.A NH2 ASP 478.A OD1 no hydrogen 2.711 N/A LEU 633.A N LEU 629.A O no hydrogen 2.970 N/A TYR 634.A N TYR 630.A O no hydrogen 2.937 N/A GLU 635.A N GLU 631.A O no hydrogen 2.901 N/A LEU 636.A N ARG 632.A O no hydrogen 2.905 N/A GLN 637.A N LEU 633.A O no hydrogen 2.942 N/A ARG 638.A N TYR 634.A O no hydrogen 2.957 N/A LEU 639.A N LEU 636.A O no hydrogen 3.335 N/A VAL 643.A N LEU 639.A O no hydrogen 2.995 N/A ILE 645.A N ASP 641.A O no hydrogen 3.011 N/A ILE 646.A N GLN 642.A O no hydrogen 2.913 N/A GLN 647.A N VAL 643.A O no hydrogen 2.938 N/A GLN 648.A N SER 644.A O no hydrogen 2.920 N/A ARG 649.A N ILE 645.A O no hydrogen 2.921 N/A ILE 650.A N ILE 646.A O no hydrogen 2.975 N/A VAL 655.A N ASN 653.A OD1 no hydrogen 3.385 N/A GLN 657.A N ASN 653.A O no hydrogen 2.938 N/A LYS 658.A N PRO 654.A O no hydrogen 2.914 N/A GLN 659.A N VAL 655.A O no hydrogen 2.899 N/A LYS 660.A N GLN 657.A O no hydrogen 3.098 N/A ILE 661.A N SER 656.A O no hydrogen 3.285 N/A ARG 665.A NH1 ASP 464.A OD2 no hydrogen 2.851 N/A TRP 666.A N ASP 664.A OD1 no hydrogen 2.516 N/A ASP 668.A N ARG 665.A O no hydrogen 3.385 N/A GLU 675.A N ASN 681.A OD1 no hydrogen 2.993 N/A THR 677.A N GLU 680.A OE2 no hydrogen 2.564 N/A HIS 678.A N GLU 640.A OE2 no hydrogen 3.173 N/A ASN 681.A N THR 677.A O no hydrogen 2.973 N/A THR 682.A N HIS 678.A O no hydrogen 2.921 N/A THR 682.A OG1 HIS 678.A O no hydrogen 2.982 N/A THR 682.A OG1 TYR 707.A OH no hydrogen 2.393 N/A TYR 683.A N TYR 679.A O no hydrogen 2.870 N/A TYR 683.A OH ASP 524.A O no hydrogen 2.702 N/A VAL 684.A N GLU 680.A O no hydrogen 2.920 N/A MET 685.A N ASN 681.A O no hydrogen 2.982 N/A ILE 686.A N THR 682.A O no hydrogen 2.903 N/A LEU 687.A N TYR 683.A O no hydrogen 2.938 N/A ARG 688.A N VAL 684.A O no hydrogen 2.909 N/A ARG 688.A NH1 ASP 671.A O no hydrogen 2.664 N/A ARG 688.A NH2 ASP 671.A O no hydrogen 3.495 N/A ARG 688.A NH2 ASP 671.A OD2 no hydrogen 3.437 N/A LEU 689.A N MET 685.A O no hydrogen 2.967 N/A ILE 690.A N ILE 686.A O no hydrogen 2.915 N/A TYR 691.A N LEU 687.A O no hydrogen 2.915 N/A GLY 692.A N ARG 688.A O no hydrogen 2.915 N/A ILE 693.A N ARG 688.A O no hydrogen 3.009 N/A GLN 696.A N ASP 695.A OD1 no hydrogen 2.777 N/A GLN 696.A NE2 TYR 715.A O no hydrogen 2.842 N/A PHE 699.A N ASP 695.A O no hydrogen 3.007 N/A GLU 700.A N GLN 696.A O no hydrogen 2.914 N/A ASP 701.A N SER 697.A O no hydrogen 2.889 N/A TYR 702.A N ALA 698.A O no hydrogen 2.967 N/A LEU 703.A N PHE 699.A O no hydrogen 2.983 N/A ARG 704.A N GLU 700.A O no hydrogen 2.889 N/A ARG 704.A NE ASP 468.A OD2 no hydrogen 2.607 N/A PHE 705.A N ASP 701.A O no hydrogen 2.918 N/A TYR 706.A N TYR 702.A O no hydrogen 3.038 N/A TYR 707.A N LEU 703.A O no hydrogen 2.871 N/A TYR 707.A OH THR 682.A OG1 no hydrogen 2.393 N/A LYS 710.A N TYR 707.A O no hydrogen 3.131 N/A LYS 710.A NZ GLN 642.A OE1 no hydrogen 3.489 N/A ILE 714.A N ALA 711.A O no hydrogen 3.401 N/A TYR 715.A OH ASP 468.A OD2 no hydrogen 2.628 N/A THR 716.A OG1 ASP 478.A OD2 no hydrogen 3.084 N/A ILE 717.A N ILE 714.A O no hydrogen 3.008 N/A LEU 720.A N THR 716.A O no hydrogen 3.030 N/A VAL 721.A N ILE 717.A O no hydrogen 2.934 N/A TRP 722.A N ASP 718.A O no hydrogen 2.938 N/A SER 723.A N LYS 719.A O no hydrogen 2.938 N/A SER 723.A OG LYS 719.A O no hydrogen 3.333 N/A ALA 724.A N LEU 720.A O no hydrogen 3.016 N/A ALA 725.A N VAL 721.A O no hydrogen 2.935 N/A LYS 726.A N TRP 722.A O no hydrogen 2.907 N/A GLN 727.A N SER 723.A O no hydrogen 2.964 N/A VAL 728.A N ALA 724.A O no hydrogen 2.944 N/A HIS 729.A N ALA 725.A O no hydrogen 2.945 N/A HIS 730.A N LYS 726.A O no hydrogen 2.921 N/A ILE 731.A N GLN 727.A O no hydrogen 2.862 N/A VAL 732.A N VAL 728.A O no hydrogen 2.964 N/A SER 733.A N HIS 729.A O no hydrogen 2.907 N/A SER 733.A OG HIS 729.A O no hydrogen 3.089 N/A LYS 736.A NZ LEU 757.A O no hydrogen 2.516 N/A TYR 737.A N ASP 734.A O no hydrogen 3.281 N/A VAL 740.A N LYS 736.A O no hydrogen 2.916 N/A THR 741.A N TYR 737.A O no hydrogen 2.932 N/A THR 741.A OG1 TYR 737.A O no hydrogen 2.423 N/A THR 741.A OG1 LYS 738.A O no hydrogen 2.979 N/A SER 742.A N LYS 738.A O no hydrogen 2.873 N/A SER 742.A OG PHE 739.A O no hydrogen 2.981 N/A LEU 743.A N PHE 739.A O no hydrogen 2.938 N/A VAL 744.A N VAL 740.A O no hydrogen 2.927 N/A GLU 745.A N THR 741.A O no hydrogen 2.894 N/A GLN 746.A N SER 742.A O no hydrogen 2.908 N/A GLN 746.A NE2 LEU 743.A O no hydrogen 2.511 N/A GLN 746.A NE2 VAL 744.A O no hydrogen 3.560 N/A TYR 749.A OH GLN 746.A OE1 no hydrogen 2.562 N/A ILE 753.A N ARG 750.A O no hydrogen 3.176 N/A GLU 754.A N ARG 750.A O no hydrogen 2.960 N/A LYS 755.A NZ LEU 751.A O no hydrogen 2.196 N/A ASP 760.A N ASN 758.A O no hydrogen 2.601 N/A PHE 764.A N GLY 615.A O no hydrogen 2.901 N/A ARG 765.A N LYS 778.A O no hydrogen 2.894 N/A ARG 765.A NE GLU 612.A OE2 no hydrogen 2.247 N/A PHE 766.A N GLN 613.A O no hydrogen 2.915 N/A CYS 767.A N GLY 776.A O no hydrogen 2.941 N/A CYS 767.A SG GLU 612.A OE2 no hydrogen 3.863 N/A TRP 768.A N LYS 611.A O no hydrogen 2.966 N/A ILE 769.A N SER 774.A O no hydrogen 2.925 N/A LYS 771.A NZ ASP 600.A OD1 no hydrogen 2.589 N/A LYS 771.A NZ HIS 606.A ND1 no hydrogen 3.125 N/A LYS 771.A NZ HIS 606.A O no hydrogen 2.601 N/A LYS 773.A N ASN 770.A O no hydrogen 3.298 N/A SER 774.A N ILE 769.A O no hydrogen 2.961 N/A PHE 775.A N PHE 514.A O no hydrogen 2.904 N/A GLY 776.A N CYS 767.A O no hydrogen 2.879 N/A ILE 777.A N PHE 512.A O no hydrogen 2.885 N/A LYS 778.A N ARG 765.A O no hydrogen 2.989 N/A LYS 778.A NZ ARG 507.A O no hydrogen 2.860 N/A MET 780.A N LEU 763.A O no hydrogen 2.915 N/A ARG 782.A N GLU 812.A OE1 no hydrogen 3.092 N/A ALA 783.A N GLU 761.A O no hydrogen 3.180 N/A SER 790.A N ASP 788.A OD1 no hydrogen 2.776 N/A SER 790.A OG THR 793.A OG1 no hydrogen 2.889 N/A THR 793.A N SER 790.A O no hydrogen 3.104 N/A THR 793.A OG1 SER 790.A O no hydrogen 2.787 N/A THR 793.A OG1 SER 790.A OG no hydrogen 2.889 N/A GLN 794.A N SER 790.A O no hydrogen 2.902 N/A ARG 795.A N LEU 791.A O no hydrogen 2.878 N/A ARG 796.A NE ARG 796.A O no hydrogen 3.091 N/A VAL 797.A N GLN 794.A O no hydrogen 3.105 N/A TRP 798.A N GLN 794.A O no hydrogen 2.910 N/A VAL 802.A N TRP 798.A O no hydrogen 3.246 N/A GLN 803.A N LYS 799.A O no hydrogen 2.926 N/A ASN 804.A N LYS 800.A O no hydrogen 2.912 N/A TYR 805.A N TYR 801.A O no hydrogen 2.919 N/A ARG 806.A N VAL 802.A O no hydrogen 2.896 N/A SER 815.A N ASN 784.A OD1 no hydrogen 2.367 N/A SER 815.A OG ASN 784.A OD1 no hydrogen 2.702 N/A CYS 821.A SG CYS 821.A O no hydrogen 3.014 N/A CYS 821.A SG PHE 823.A O no hydrogen 3.754 N/A CYS 825.A SG GLU 752.A OE1 no hydrogen 3.723 N/A ARG 832.A N GLU 831.A OE2 no hydrogen 3.054 N/A GLN 836.A N THR 833.A O no hydrogen 2.650 N/A GLN 836.A NE2 ARG 832.A O no hydrogen 2.521 N/A GLN 836.A NE2 THR 833.A O no hydrogen 3.663 N/A LEU 837.A N VAL 834.A O no hydrogen 3.129 N/A ARG 840.A N GLN 836.A O no hydrogen 2.942 N/A ARG 840.A NH2 GLN 836.A OE1 no hydrogen 3.506 N/A LEU 841.A N LEU 837.A O no hydrogen 2.946 N/A GLN 842.A N VAL 838.A O no hydrogen 2.879 N/A THR 843.A N SER 839.A O no hydrogen 2.928 N/A THR 843.A OG1 SER 839.A O no hydrogen 2.884 N/A THR 843.A OG1 ARG 840.A O no hydrogen 2.544 N/A LYS 844.A N ARG 840.A O no hydrogen 2.951 N/A LEU 845.A N LEU 841.A O no hydrogen 2.866 N/A LEU 846.A N GLN 842.A O no hydrogen 2.973 N/A VAL 852.A N SER 875.A OG no hydrogen 2.393 N/A CYS 860.A SG LEU 859.A O no hydrogen 3.245 N/A SER 863.A OG ASP 862.A O no hydrogen 2.484 N/A PHE 864.A N ASP 862.A OD1 no hydrogen 2.908 N/A THR 872.A OG1 LEU 855.A O no hydrogen 2.174 N/A THR 872.A OG1 ARG 871.A O no hydrogen 2.308 N/A