Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8sht_Q.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 12.A N GLY 9.A O no hydrogen 3.187 N/A GLN 12.A NE2 LYS 6.A O no hydrogen 3.258 N/A MET 13.A N GLY 9.A O no hydrogen 3.197 N/A LEU 14.A N PHE 10.A O no hydrogen 3.110 N/A ALA 18.A N LYS 15.A O no hydrogen 3.388 N/A LYS 19.A N MET 525.A O no hydrogen 2.970 N/A HIS 20.A NE2 GLN 522.A OE1 no hydrogen 3.143 N/A PHE 21.A N ILE 523.A O no hydrogen 2.822 N/A GLU 25.A N GLU 25.A OE1 no hydrogen 2.797 N/A ALA 27.A N GLY 23.A O no hydrogen 2.940 N/A ALA 27.A N LEU 24.A O no hydrogen 3.236 N/A VAL 28.A N LEU 24.A O no hydrogen 2.919 N/A TYR 29.A N LEU 24.A O no hydrogen 3.194 N/A ASN 31.A N ALA 27.A O no hydrogen 2.941 N/A ILE 32.A N VAL 28.A O no hydrogen 2.913 N/A GLN 33.A N TYR 29.A O no hydrogen 2.882 N/A ALA 34.A N ARG 30.A O no hydrogen 2.933 N/A CYS 35.A N ASN 31.A O no hydrogen 2.953 N/A CYS 35.A SG ASN 31.A O no hydrogen 3.212 N/A LYS 36.A N ILE 32.A O no hydrogen 2.886 N/A GLU 37.A N GLN 33.A O no hydrogen 2.906 N/A LEU 38.A N ALA 34.A O no hydrogen 2.959 N/A ALA 39.A N CYS 35.A O no hydrogen 2.938 N/A GLN 40.A N LYS 36.A O no hydrogen 2.870 N/A THR 41.A N GLU 37.A O no hydrogen 2.913 N/A THR 41.A OG1 LEU 38.A O no hydrogen 2.380 N/A THR 42.A N LEU 38.A O no hydrogen 3.038 N/A THR 42.A OG1 LEU 38.A O no hydrogen 3.423 N/A ARG 43.A N GLN 40.A O no hydrogen 3.424 N/A ARG 43.A NE GLU 453.A OE1 no hydrogen 3.008 N/A ALA 45.A N THR 42.A O no hydrogen 3.468 N/A TYR 46.A N ARG 43.A O no hydrogen 2.957 N/A GLY 50.A N GLY 47.A O no hydrogen 3.026 N/A LYS 53.A N THR 65.A O no hydrogen 2.780 N/A LYS 53.A NZ THR 44.A OG1 no hydrogen 2.353 N/A VAL 55.A N PHE 63.A O no hydrogen 2.674 N/A ASN 57.A N LYS 61.A O no hydrogen 3.342 N/A GLU 60.A N ASN 57.A O no hydrogen 3.112 N/A PHE 63.A N VAL 55.A O no hydrogen 2.912 N/A THR 65.A N LYS 53.A O no hydrogen 3.293 N/A THR 65.A OG1 ASP 386.A OD1 no hydrogen 3.401 N/A ASP 67.A N THR 65.A OG1 no hydrogen 3.069 N/A THR 70.A N ASP 67.A OD1 no hydrogen 2.984 N/A THR 70.A OG1 ASP 67.A OD1 no hydrogen 3.042 N/A ILE 71.A N ASP 67.A O no hydrogen 3.111 N/A LEU 72.A N ALA 68.A O no hydrogen 2.930 N/A ARG 73.A N ALA 69.A O no hydrogen 2.893 N/A ARG 73.A NH1 GLU 93.A OE1 no hydrogen 3.036 N/A ARG 73.A NH2 GLU 93.A OE2 no hydrogen 3.300 N/A GLU 74.A N THR 70.A O no hydrogen 2.923 N/A LEU 75.A N ILE 71.A O no hydrogen 2.861 N/A ALA 81.A N HIS 79.A ND1 no hydrogen 3.221 N/A LYS 83.A N HIS 79.A O no hydrogen 2.803 N/A MET 84.A N PRO 80.A O no hydrogen 2.890 N/A ILE 85.A N ALA 81.A O no hydrogen 2.987 N/A VAL 86.A N ALA 82.A O no hydrogen 2.883 N/A MET 87.A N LYS 83.A O no hydrogen 2.870 N/A ALA 88.A N MET 84.A O no hydrogen 2.964 N/A SER 89.A N ILE 85.A O no hydrogen 2.931 N/A HIS 90.A N VAL 86.A O no hydrogen 2.883 N/A MET 91.A N MET 87.A O no hydrogen 2.883 N/A GLN 92.A N ALA 88.A O no hydrogen 2.957 N/A GLN 92.A NE2 ASP 98.A O no hydrogen 2.365 N/A GLU 93.A N SER 89.A O no hydrogen 2.919 N/A GLN 94.A N HIS 90.A O no hydrogen 2.891 N/A GLU 95.A N MET 91.A O no hydrogen 2.908 N/A VAL 96.A N GLN 92.A O no hydrogen 2.972 N/A GLY 97.A N GLN 92.A O no hydrogen 3.444 N/A ASN 101.A ND2 THR 42.A O no hydrogen 3.637 N/A VAL 103.A N GLY 99.A O no hydrogen 3.049 N/A LEU 104.A N THR 100.A O no hydrogen 2.974 N/A VAL 105.A N ASN 101.A O no hydrogen 2.905 N/A PHE 106.A N PHE 102.A O no hydrogen 2.899 N/A ALA 107.A N VAL 103.A O no hydrogen 2.924 N/A GLY 108.A N LEU 104.A O no hydrogen 2.908 N/A ALA 109.A N VAL 105.A O no hydrogen 2.937 N/A LEU 110.A N PHE 106.A O no hydrogen 2.890 N/A LEU 111.A N ALA 107.A O no hydrogen 2.929 N/A GLU 112.A N GLY 108.A O no hydrogen 2.918 N/A LEU 113.A N ALA 109.A O no hydrogen 2.968 N/A ALA 114.A N LEU 110.A O no hydrogen 2.850 N/A GLU 115.A N LEU 111.A O no hydrogen 2.906 N/A GLU 116.A N GLU 112.A O no hydrogen 2.990 N/A LEU 117.A N LEU 113.A O no hydrogen 2.887 N/A LEU 118.A N ALA 114.A O no hydrogen 2.883 N/A ARG 119.A N GLU 115.A O no hydrogen 2.927 N/A ARG 119.A NE GLU 115.A OE2 no hydrogen 3.300 N/A ILE 120.A N GLU 116.A O no hydrogen 2.946 N/A GLY 121.A N LEU 118.A O no hydrogen 3.407 N/A LEU 122.A N LEU 117.A O no hydrogen 3.055 N/A SER 123.A OG SER 125.A OG no hydrogen 3.422 N/A SER 125.A OG SER 123.A OG no hydrogen 3.422 N/A GLU 126.A N SER 123.A OG no hydrogen 3.368 N/A VAL 127.A N SER 123.A O no hydrogen 3.109 N/A ILE 128.A N VAL 124.A O no hydrogen 2.912 N/A GLU 129.A N SER 125.A O no hydrogen 2.891 N/A GLY 130.A N GLU 126.A O no hydrogen 2.928 N/A TYR 131.A N VAL 127.A O no hydrogen 2.890 N/A TYR 131.A OH LEU 110.A O no hydrogen 2.879 N/A GLU 132.A N ILE 128.A O no hydrogen 2.923 N/A ILE 133.A N GLU 129.A O no hydrogen 2.945 N/A ALA 134.A N GLY 130.A O no hydrogen 2.907 N/A CYS 135.A N TYR 131.A O no hydrogen 2.860 N/A CYS 135.A SG THR 511.A OG1 no hydrogen 3.719 N/A ARG 136.A N GLU 132.A O no hydrogen 2.951 N/A LYS 137.A N ILE 133.A O no hydrogen 2.937 N/A LYS 137.A NZ GLU 140.A OE1 no hydrogen 3.295 N/A ALA 138.A N ALA 134.A O no hydrogen 2.850 N/A HIS 139.A N CYS 135.A O no hydrogen 2.921 N/A GLU 140.A N ARG 136.A O no hydrogen 2.931 N/A ILE 141.A N LYS 137.A O no hydrogen 2.889 N/A LEU 142.A N ALA 138.A O no hydrogen 2.904 N/A ASN 144.A N ILE 141.A O no hydrogen 2.896 N/A LEU 145.A N LEU 142.A O no hydrogen 3.003 N/A VAL 146.A N PRO 143.A O no hydrogen 3.445 N/A CYS 147.A N LEU 407.A O no hydrogen 3.085 N/A CYS 147.A SG LEU 407.A O no hydrogen 3.639 N/A ALA 150.A N LYS 405.A O no hydrogen 3.100 N/A LYS 151.A NZ SER 149.A O no hydrogen 3.228 N/A ARG 154.A N ASN 152.A OD1 no hydrogen 3.267 N/A VAL 159.A N ASP 155.A O no hydrogen 3.175 N/A SER 160.A N ILE 156.A O no hydrogen 2.922 N/A SER 160.A OG ILE 156.A O no hydrogen 3.239 N/A SER 160.A OG ASP 157.A O no hydrogen 2.497 N/A SER 161.A N ASP 157.A O no hydrogen 2.922 N/A SER 161.A OG ASP 157.A O no hydrogen 3.274 N/A SER 161.A OG GLU 158.A O no hydrogen 2.502 N/A LEU 162.A N GLU 158.A O no hydrogen 2.912 N/A LEU 163.A N VAL 159.A O no hydrogen 2.909 N/A ARG 164.A N SER 160.A O no hydrogen 2.919 N/A SER 166.A OG THR 397.A OG1 no hydrogen 2.405 N/A ILE 167.A N LEU 163.A O no hydrogen 2.978 N/A MET 168.A N THR 165.A O no hydrogen 3.445 N/A LYS 170.A NZ ASP 393.A OD2 no hydrogen 3.023 N/A GLU 175.A N GLU 175.A OE1 no hydrogen 2.497 N/A ALA 179.A N GLU 175.A O no hydrogen 2.840 N/A LYS 180.A N VAL 176.A O no hydrogen 2.907 N/A LYS 180.A NZ ASP 157.A OD1 no hydrogen 3.244 N/A LEU 181.A N PHE 177.A O no hydrogen 2.959 N/A ILE 182.A N LEU 178.A O no hydrogen 2.916 N/A ALA 183.A N ALA 179.A O no hydrogen 2.873 N/A GLN 184.A N LYS 180.A O no hydrogen 2.946 N/A ALA 185.A N LEU 181.A O no hydrogen 2.968 N/A CYS 186.A N ILE 182.A O no hydrogen 2.877 N/A CYS 186.A SG ILE 182.A O no hydrogen 3.255 N/A VAL 187.A N ALA 183.A O no hydrogen 2.889 N/A SER 188.A N GLN 184.A O no hydrogen 2.988 N/A SER 188.A OG GLN 184.A O no hydrogen 2.989 N/A SER 188.A OG HIS 218.A NE2 no hydrogen 3.071 N/A ILE 189.A N ALA 185.A O no hydrogen 3.507 N/A ASP 199.A N ASN 197.A OD1 no hydrogen 3.379 N/A ASN 200.A N ASN 197.A O no hydrogen 3.377 N/A ILE 201.A N VAL 198.A O no hydrogen 3.221 N/A ARG 202.A N SER 372.A O no hydrogen 2.783 N/A ARG 202.A NE ASP 199.A O no hydrogen 3.324 N/A ARG 202.A NH2 ASP 199.A O no hydrogen 3.203 N/A CYS 204.A N ILE 374.A O no hydrogen 2.845 N/A LYS 205.A NZ GLU 388.A OE1 no hydrogen 2.386 N/A ILE 206.A N LEU 376.A O no hydrogen 2.893 N/A GLY 208.A N GLY 378.A O no hydrogen 2.537 N/A SER 209.A OG SER 209.A O no hydrogen 2.596 N/A SER 209.A OG SER 213.A OG no hydrogen 3.023 N/A SER 213.A N GLY 210.A O no hydrogen 3.093 N/A SER 213.A OG SER 209.A O no hydrogen 3.463 N/A SER 213.A OG SER 209.A OG no hydrogen 3.023 N/A SER 214.A N ILE 211.A O no hydrogen 3.253 N/A SER 214.A OG ILE 211.A O no hydrogen 2.931 N/A SER 215.A N VAL 375.A O no hydrogen 3.260 N/A SER 215.A OG VAL 216.A O no hydrogen 3.497 N/A LEU 217.A N THR 373.A O no hydrogen 2.617 N/A GLY 219.A N LEU 217.A O no hydrogen 2.931 N/A MET 220.A N PHE 362.A O no hydrogen 3.130 N/A PHE 222.A N VAL 360.A O no hydrogen 2.955 N/A LYS 223.A NZ LYS 205.A O no hydrogen 2.696 N/A LYS 224.A N PHE 222.A O no hydrogen 2.909 N/A GLU 227.A N LEU 311.A O no hydrogen 3.219 N/A ASP 229.A N ASN 305.A OD1 no hydrogen 2.825 N/A VAL 233.A N VAL 349.A O no hydrogen 2.630 N/A LYS 237.A N ASN 288.A OD1 no hydrogen 2.580 N/A ALA 239.A N VAL 289.A O no hydrogen 2.975 N/A TYR 241.A N VAL 291.A O no hydrogen 2.916 N/A SER 242.A N LEU 332.A O no hydrogen 3.203 N/A CYS 243.A SG PRO 244.A O no hydrogen 3.751 N/A PHE 245.A N LYS 295.A O no hydrogen 2.977 N/A ASP 246.A N PRO 244.A O no hydrogen 2.725 N/A GLY 247.A N ASP 246.A OD1 no hydrogen 2.462 N/A THR 250.A OG1 LYS 253.A O no hydrogen 3.278 N/A LYS 259.A N GLU 263.A OE1 no hydrogen 3.430 N/A LEU 264.A N THR 260.A O no hydrogen 3.288 N/A MET 265.A N ALA 261.A O no hydrogen 2.922 N/A ASN 266.A N GLU 262.A O no hydrogen 2.910 N/A ASN 266.A N GLU 263.A O no hydrogen 3.223 N/A PHE 267.A N GLU 263.A O no hydrogen 2.923 N/A GLY 270.A N ASN 266.A O no hydrogen 2.921 N/A GLU 271.A N PHE 267.A O no hydrogen 2.921 N/A GLU 272.A N SER 268.A O no hydrogen 2.945 N/A ASN 273.A N LYS 269.A O no hydrogen 2.913 N/A LEU 274.A N GLY 270.A O no hydrogen 2.901 N/A MET 275.A N GLU 271.A O no hydrogen 2.966 N/A ASP 276.A N GLU 272.A O no hydrogen 2.908 N/A ALA 277.A N ASN 273.A O no hydrogen 2.893 N/A GLN 278.A N LEU 274.A O no hydrogen 2.928 N/A VAL 279.A N MET 275.A O no hydrogen 2.965 N/A LYS 280.A N ASP 276.A O no hydrogen 2.877 N/A LYS 280.A NZ ASP 284.A OD1 no hydrogen 3.561 N/A ALA 281.A N ALA 277.A O no hydrogen 2.887 N/A ILE 282.A N GLN 278.A O no hydrogen 2.964 N/A ALA 283.A N VAL 279.A O no hydrogen 2.891 N/A ASP 284.A N LYS 280.A O no hydrogen 2.880 N/A THR 285.A N ILE 282.A O no hydrogen 3.380 N/A THR 285.A OG1 ILE 282.A O no hydrogen 2.719 N/A GLY 286.A N ALA 283.A O no hydrogen 3.097 N/A ASN 288.A ND2 ASP 235.A O no hydrogen 3.496 N/A VAL 290.A N MET 310.A O no hydrogen 2.768 N/A VAL 291.A N ALA 239.A O no hydrogen 3.003 N/A THR 292.A N VAL 312.A O no hydrogen 3.002 N/A THR 292.A OG1 CYS 243.A O no hydrogen 2.758 N/A GLY 293.A N TYR 241.A O no hydrogen 3.126 N/A ALA 297.A N PHE 245.A O no hydrogen 3.052 N/A LEU 301.A N ALA 297.A O no hydrogen 2.813 N/A HIS 302.A N ASP 298.A O no hydrogen 2.899 N/A TYR 303.A N MET 299.A O no hydrogen 2.942 N/A ALA 304.A N ALA 300.A O no hydrogen 2.882 N/A ASN 305.A N LEU 301.A O no hydrogen 2.906 N/A LYS 306.A N HIS 302.A O no hydrogen 2.922 N/A TYR 307.A N TYR 303.A O no hydrogen 3.273 N/A TYR 307.A N ALA 304.A O no hydrogen 3.271 N/A TYR 307.A OH ASP 276.A OD1 no hydrogen 2.736 N/A ASN 308.A N ASN 305.A O no hydrogen 3.292 N/A ILE 309.A N ALA 304.A O no hydrogen 3.074 N/A MET 310.A N ASN 288.A O no hydrogen 3.033 N/A VAL 312.A N VAL 290.A O no hydrogen 3.049 N/A ARG 313.A NE GLY 294.A O no hydrogen 2.969 N/A LEU 314.A N THR 292.A O no hydrogen 2.858 N/A ASP 319.A N SER 316.A OG no hydrogen 3.218 N/A LEU 320.A N SER 316.A O no hydrogen 3.148 N/A ARG 321.A N LYS 317.A O no hydrogen 2.918 N/A ARG 322.A N TRP 318.A O no hydrogen 2.924 N/A LEU 323.A N ASP 319.A O no hydrogen 2.878 N/A CYS 324.A N LEU 320.A O no hydrogen 2.915 N/A CYS 324.A SG LEU 320.A O no hydrogen 3.227 N/A LYS 325.A N ARG 321.A O no hydrogen 2.938 N/A LYS 325.A NZ ASN 200.A OD1 no hydrogen 3.460 N/A THR 326.A N ARG 322.A O no hydrogen 2.891 N/A THR 326.A OG1 ARG 322.A O no hydrogen 2.731 N/A VAL 327.A N LEU 323.A O no hydrogen 2.901 N/A GLY 328.A N CYS 324.A O no hydrogen 3.059 N/A ALA 329.A N CYS 324.A O no hydrogen 3.232 N/A LEU 332.A N VAL 240.A O no hydrogen 3.039 N/A VAL 339.A N GLU 342.A OE1 no hydrogen 3.318 N/A GLU 341.A N GLU 341.A OE1 no hydrogen 2.524 N/A MET 343.A N VAL 339.A O no hydrogen 3.156 N/A CYS 346.A N ALA 236.A O no hydrogen 3.379 N/A CYS 346.A SG SER 348.A O no hydrogen 3.371 N/A CYS 346.A SG LYS 363.A O no hydrogen 3.185 N/A VAL 349.A N VAL 233.A O no hydrogen 3.082 N/A TYR 350.A N VAL 361.A O no hydrogen 3.295 N/A LEU 351.A N THR 231.A O no hydrogen 2.753 N/A SER 352.A N VAL 359.A O no hydrogen 2.922 N/A VAL 354.A N THR 357.A O no hydrogen 2.983 N/A THR 357.A N VAL 354.A O no hydrogen 3.116 N/A THR 357.A OG1 VAL 354.A O no hydrogen 2.917 N/A VAL 359.A N SER 352.A O no hydrogen 2.651 N/A VAL 360.A N PHE 222.A O no hydrogen 2.776 N/A VAL 361.A N TYR 350.A O no hydrogen 3.107 N/A PHE 362.A N MET 220.A O no hydrogen 3.013 N/A LYS 363.A N SER 348.A O no hydrogen 2.888 N/A LYS 363.A NZ TYR 350.A OH no hydrogen 3.372 N/A HIS 364.A N HIS 218.A O no hydrogen 2.896 N/A LYS 366.A NZ HIS 364.A ND1 no hydrogen 3.435 N/A GLU 367.A N GLU 367.A OE1 no hydrogen 2.480 N/A SER 372.A N ASN 200.A O no hydrogen 3.396 N/A SER 372.A OG LEU 217.A O no hydrogen 3.513 N/A THR 373.A N LEU 217.A O no hydrogen 2.895 N/A THR 373.A OG1 GLY 219.A O no hydrogen 2.243 N/A ILE 374.A N ARG 202.A O no hydrogen 2.709 N/A VAL 375.A N SER 215.A O no hydrogen 2.990 N/A LEU 376.A N CYS 204.A O no hydrogen 2.605 N/A ARG 377.A N SER 214.A OG no hydrogen 2.974 N/A ARG 377.A NE ILE 206.A O no hydrogen 3.103 N/A ARG 377.A NH2 LEU 207.A O no hydrogen 3.039 N/A MET 384.A N THR 380.A O no hydrogen 3.204 N/A ASP 385.A N ASP 381.A O no hydrogen 2.913 N/A ASP 386.A N ASN 382.A O no hydrogen 2.948 N/A ILE 387.A N LEU 383.A O no hydrogen 2.929 N/A GLU 388.A N MET 384.A O no hydrogen 2.839 N/A ARG 389.A N ASP 385.A O no hydrogen 2.933 N/A ALA 390.A N ASP 386.A O no hydrogen 2.944 N/A VAL 391.A N ILE 387.A O no hydrogen 2.867 N/A ASP 392.A N GLU 388.A O no hydrogen 2.892 N/A ASP 393.A N ARG 389.A O no hydrogen 2.940 N/A GLY 394.A N ALA 390.A O no hydrogen 2.920 N/A VAL 395.A N VAL 391.A O no hydrogen 2.908 N/A ASN 396.A N ASP 392.A O no hydrogen 2.906 N/A ASN 396.A ND2 ASP 392.A O no hydrogen 2.623 N/A THR 397.A N ASP 393.A O no hydrogen 2.911 N/A THR 397.A OG1 SER 166.A OG no hydrogen 2.405 N/A THR 397.A OG1 ASP 393.A O no hydrogen 3.148 N/A PHE 398.A N GLY 394.A O no hydrogen 2.937 N/A LYS 399.A N VAL 395.A O no hydrogen 2.905 N/A LYS 399.A NZ PHE 196.A O no hydrogen 2.906 N/A VAL 400.A N ASN 396.A O no hydrogen 2.907 N/A LEU 401.A N THR 397.A O no hydrogen 2.894 N/A THR 402.A N PHE 398.A O no hydrogen 2.921 N/A THR 402.A OG1 PHE 398.A O no hydrogen 3.468 N/A THR 402.A OG1 LYS 399.A O no hydrogen 2.246 N/A ARG 403.A N LYS 399.A O no hydrogen 2.941 N/A ARG 403.A NH1 GLU 95.A O no hydrogen 3.235 N/A ARG 403.A NH2 GLU 95.A OE2 no hydrogen 3.532 N/A ASP 404.A N VAL 400.A O no hydrogen 2.703 N/A ARG 406.A N ASP 404.A OD1 no hydrogen 3.281 N/A ARG 406.A NE ASP 404.A OD1 no hydrogen 3.357 N/A ARG 406.A NH2 ASP 404.A OD2 no hydrogen 3.071 N/A LEU 407.A N CYS 148.A O no hydrogen 3.096 N/A VAL 408.A N ASP 498.A O no hydrogen 2.699 N/A GLY 410.A N ILE 496.A O no hydrogen 3.151 N/A ALA 413.A N GLY 410.A O no hydrogen 3.338 N/A THR 414.A OG1 PRO 409.A O no hydrogen 2.289 N/A ILE 416.A N GLY 412.A O no hydrogen 2.853 N/A GLU 417.A N ALA 413.A O no hydrogen 2.939 N/A LEU 418.A N THR 414.A O no hydrogen 2.881 N/A ALA 419.A N GLU 415.A O no hydrogen 2.887 N/A LYS 420.A N ILE 416.A O no hydrogen 2.912 N/A GLN 421.A N GLU 417.A O no hydrogen 2.936 N/A GLN 421.A NE2 GLU 417.A OE2 no hydrogen 3.208 N/A ILE 422.A N LEU 418.A O no hydrogen 2.898 N/A THR 423.A N ALA 419.A O no hydrogen 2.895 N/A THR 423.A OG1 ALA 419.A O no hydrogen 2.939 N/A SER 424.A N LYS 420.A O no hydrogen 2.924 N/A SER 424.A OG LYS 420.A O no hydrogen 2.976 N/A TYR 425.A N GLN 421.A O no hydrogen 2.914 N/A GLY 426.A N ILE 422.A O no hydrogen 2.879 N/A GLU 427.A N THR 423.A O no hydrogen 3.344 N/A THR 428.A N TYR 425.A O no hydrogen 3.140 N/A THR 428.A OG1 TYR 425.A O no hydrogen 2.697 N/A CYS 429.A N GLY 426.A O no hydrogen 3.223 N/A CYS 429.A SG PRO 430.A O no hydrogen 3.679 N/A GLN 434.A NE2 GLY 431.A O no hydrogen 2.914 N/A ILE 437.A N GLU 433.A O no hydrogen 2.927 N/A LYS 438.A N GLN 434.A O no hydrogen 2.894 N/A LYS 439.A N TYR 435.A O no hydrogen 2.921 N/A LYS 439.A NZ GLU 442.A OE1 no hydrogen 3.561 N/A PHE 440.A N ALA 436.A O no hydrogen 2.883 N/A ALA 441.A N ILE 437.A O no hydrogen 2.936 N/A GLU 442.A N LYS 438.A O no hydrogen 2.887 N/A ALA 443.A N LYS 439.A O no hydrogen 2.903 N/A PHE 444.A N ALA 441.A O no hydrogen 3.163 N/A GLU 445.A N GLU 442.A O no hydrogen 2.861 N/A ALA 446.A N ALA 443.A O no hydrogen 3.329 N/A ILE 447.A N PHE 444.A O no hydrogen 3.399 N/A ARG 449.A N GLU 445.A O no hydrogen 2.952 N/A ARG 449.A NH1 ASN 460.A OD1 no hydrogen 2.963 N/A ALA 450.A N ALA 446.A O no hydrogen 2.946 N/A LEU 451.A N ILE 447.A O no hydrogen 2.949 N/A ALA 452.A N PRO 448.A O no hydrogen 2.883 N/A GLU 453.A N ARG 449.A O no hydrogen 2.901 N/A ASN 454.A N ALA 450.A O no hydrogen 2.922 N/A SER 455.A N LEU 451.A O no hydrogen 2.914 N/A SER 455.A OG LEU 451.A O no hydrogen 2.984 N/A SER 455.A OG ALA 452.A O no hydrogen 2.832 N/A GLY 456.A N GLU 453.A O no hydrogen 3.248 N/A VAL 457.A N ALA 452.A O no hydrogen 3.119 N/A GLU 461.A N GLU 461.A OE1 no hydrogen 2.684 N/A ILE 463.A N ALA 459.A O no hydrogen 2.916 N/A SER 464.A N ASN 460.A O no hydrogen 2.910 N/A SER 464.A OG ASN 460.A O no hydrogen 2.982 N/A SER 464.A OG GLU 461.A O no hydrogen 2.710 N/A LYS 465.A N GLU 461.A O no hydrogen 2.903 N/A LYS 465.A NZ PRO 486.A O no hydrogen 2.851 N/A LEU 466.A N VAL 462.A O no hydrogen 2.903 N/A TYR 467.A N ILE 463.A O no hydrogen 2.914 N/A TYR 467.A OH GLU 445.A OE2 no hydrogen 2.314 N/A ALA 468.A N SER 464.A O no hydrogen 2.906 N/A VAL 469.A N LYS 465.A O no hydrogen 2.922 N/A HIS 470.A N LEU 466.A O no hydrogen 2.914 N/A HIS 470.A ND1 GLU 417.A OE1 no hydrogen 2.743 N/A HIS 470.A NE2 VAL 477.A O no hydrogen 2.942 N/A GLN 471.A N TYR 467.A O no hydrogen 2.856 N/A GLU 472.A N ALA 468.A O no hydrogen 2.946 N/A GLY 473.A N VAL 469.A O no hydrogen 3.160 N/A ASN 474.A N VAL 469.A O no hydrogen 3.340 N/A GLY 478.A N LYS 489.A O no hydrogen 3.080 N/A LEU 479.A N GLY 411.A O no hydrogen 3.111 N/A ASP 480.A N ALA 487.A O no hydrogen 3.321 N/A GLU 482.A N ASP 480.A OD1 no hydrogen 3.193 N/A LYS 489.A N GLY 478.A O no hydrogen 3.102 N/A MET 491.A N ASN 476.A O no hydrogen 2.790 N/A LEU 492.A N ASP 490.A OD1 no hydrogen 2.787 N/A GLY 495.A N LEU 492.A O no hydrogen 3.312 N/A ILE 496.A N MET 491.A O no hydrogen 3.323 N/A LEU 497.A N THR 165.A OG1 no hydrogen 3.338 N/A ASP 498.A N VAL 408.A O no hydrogen 2.702 N/A TYR 500.A N ARG 406.A O no hydrogen 3.054 N/A LYS 503.A N THR 499.A O no hydrogen 3.289 N/A LYS 503.A NZ ASP 498.A OD1 no hydrogen 2.690 N/A TYR 504.A N TYR 500.A O no hydrogen 2.928 N/A TRP 505.A N LEU 501.A O no hydrogen 2.913 N/A ALA 506.A N GLY 502.A O no hydrogen 2.892 N/A ILE 507.A N LYS 503.A O no hydrogen 2.906 N/A LYS 508.A N TYR 504.A O no hydrogen 2.979 N/A LYS 508.A NZ TYR 504.A OH no hydrogen 3.066 N/A LEU 509.A N TRP 505.A O no hydrogen 2.897 N/A ALA 510.A N ALA 506.A O no hydrogen 2.897 N/A THR 511.A N ILE 507.A O no hydrogen 2.943 N/A THR 511.A OG1 ILE 507.A O no hydrogen 2.838 N/A ASN 512.A N LYS 508.A O no hydrogen 2.936 N/A ALA 513.A N LEU 509.A O no hydrogen 2.897 N/A ALA 514.A N ALA 510.A O no hydrogen 2.934 N/A VAL 515.A N THR 511.A O no hydrogen 2.922 N/A THR 516.A N ASN 512.A O no hydrogen 2.897 N/A THR 516.A OG1 ASN 512.A O no hydrogen 2.436 N/A VAL 517.A N ALA 513.A O no hydrogen 2.920 N/A LEU 518.A N ALA 514.A O no hydrogen 2.928 N/A ARG 519.A N VAL 515.A O no hydrogen 2.908 N/A ILE 523.A N PHE 21.A O no hydrogen 2.808 N/A MET 525.A N LYS 19.A O no hydrogen 2.807 N/A