Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ag8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N GLU 8.A OE2 no hydrogen 3.289 N/A GLU 8.A N TYR 5.A O no hydrogen 3.057 N/A GLY 9.A N PRO 6.A O no hydrogen 3.409 N/A GLY 10.A N TYR 5.A O no hydrogen 2.820 N/A ASP 14.A N GLY 11.A O no hydrogen 3.358 N/A TRP 15.A N ASN 12.A O no hydrogen 3.157 N/A TRP 16.A N ASN 12.A O no hydrogen 3.182 N/A ASN 18.A ND2 PRO 17.A O no hydrogen 2.664 N/A LEU 25.A N LEU 22.A O no hydrogen 3.049 N/A GLN 27.A NE2 PRO 170.A O no hydrogen 3.247 N/A ASN 28.A N GLU 169.A OE2 no hydrogen 2.409 N/A ALA 32.A N PRO 29.A O no hydrogen 3.307 N/A ASP 33.A N ALA 30.A O no hydrogen 3.227 N/A MET 35.A N ASP 33.A OD1 no hydrogen 2.906 N/A TYR 41.A OH ASP 140.A OD2 no hydrogen 2.352 N/A ALA 43.A N ASP 40.A O no hydrogen 3.118 N/A GLU 44.A N TYR 41.A O no hydrogen 2.981 N/A VAL 45.A N TYR 41.A O no hydrogen 3.041 N/A THR 47.A N GLU 44.A O no hydrogen 3.121 N/A THR 47.A OG1 GLU 44.A O no hydrogen 2.763 N/A ILE 48.A N VAL 45.A O no hydrogen 3.239 N/A LEU 53.A N ASP 49.A O no hydrogen 2.880 N/A THR 54.A N VAL 50.A O no hydrogen 2.836 N/A THR 54.A OG1 VAL 50.A O no hydrogen 3.344 N/A THR 54.A OG1 ASP 51.A O no hydrogen 3.047 N/A ARG 55.A N ASP 51.A O no hydrogen 3.282 N/A ASP 56.A N ALA 52.A O no hydrogen 3.298 N/A ILE 57.A N LEU 53.A O no hydrogen 3.176 N/A GLU 58.A N THR 54.A O no hydrogen 2.953 N/A GLU 59.A N ARG 55.A O no hydrogen 3.477 N/A VAL 60.A N ASP 56.A O no hydrogen 2.932 N/A MET 61.A N ILE 57.A O no hydrogen 2.875 N/A THR 62.A N GLU 58.A O no hydrogen 2.955 N/A THR 62.A OG1 GLU 58.A O no hydrogen 2.706 N/A THR 63.A N VAL 60.A O no hydrogen 3.424 N/A THR 63.A OG1 GLU 59.A O no hydrogen 2.634 N/A GLN 65.A N TYR 75.A OH no hydrogen 2.923 N/A GLN 65.A NE2 THR 63.A O no hydrogen 3.689 N/A TYR 72.A N PRO 329.A O no hydrogen 3.091 N/A TYR 72.A OH PRO 327.A O no hydrogen 2.428 N/A TYR 75.A N MET 61.A O no hydrogen 2.973 N/A TYR 75.A OH TRP 68.A O no hydrogen 2.467 N/A PHE 79.A N TYR 75.A O no hydrogen 3.210 N/A ILE 80.A N GLY 76.A O no hydrogen 2.908 N/A ARG 81.A N PRO 77.A O no hydrogen 2.932 N/A ARG 81.A NE HIS 85.A NE2 no hydrogen 3.450 N/A ARG 81.A NH1 ALA 116.A O no hydrogen 3.151 N/A ARG 81.A NH2 ALA 116.A O no hydrogen 2.972 N/A MET 82.A N LEU 78.A O no hydrogen 2.904 N/A ALA 83.A N PHE 79.A O no hydrogen 2.860 N/A TRP 84.A N ILE 80.A O no hydrogen 3.087 N/A HIS 85.A N ARG 81.A O no hydrogen 2.901 N/A ALA 86.A N MET 82.A O no hydrogen 2.916 N/A ALA 87.A N ALA 83.A O no hydrogen 3.275 N/A TYR 90.A OH ASP 449.A OD2 no hydrogen 2.659 N/A ARG 91.A N ARG 96.A O no hydrogen 3.060 N/A ARG 91.A NE ASP 94.A OD1 no hydrogen 3.348 N/A ARG 91.A NH1 TYR 174.A O no hydrogen 2.367 N/A ARG 91.A NH2 ASP 94.A OD2 no hydrogen 2.339 N/A ILE 92.A N ARG 216.A O no hydrogen 3.384 N/A GLY 95.A N ARG 91.A O no hydrogen 2.705 N/A GLY 98.A N THR 89.A OG1 no hydrogen 2.983 N/A GLN 104.A NE2 MET 82.A O no hydrogen 3.257 N/A ARG 105.A NH2 GLN 167.A O no hydrogen 3.244 N/A PHE 106.A N MET 103.A O no hydrogen 3.045 N/A ASN 110.A N PHE 106.A O no hydrogen 2.868 N/A ASN 110.A ND2 ARG 105.A O no hydrogen 3.650 N/A SER 111.A OG ASN 110.A OD1 no hydrogen 2.843 N/A TRP 112.A N LEU 109.A O no hydrogen 3.092 N/A ASN 115.A N TRP 112.A O no hydrogen 3.105 N/A ALA 116.A N PRO 113.A O no hydrogen 3.384 N/A SER 117.A OG THR 276.A OG1 no hydrogen 2.552 N/A LEU 118.A N ASN 115.A O no hydrogen 3.307 N/A LYS 120.A N ASP 119.A OD1 no hydrogen 2.781 N/A LYS 120.A NZ ASP 119.A OD1 no hydrogen 3.431 N/A ARG 122.A N LEU 118.A O no hydrogen 3.074 N/A ARG 122.A NH1 GLN 104.A OE1 no hydrogen 3.306 N/A ARG 123.A N LYS 120.A O no hydrogen 3.219 N/A ARG 123.A NH1 MET 258.A O no hydrogen 2.295 N/A LEU 124.A N LYS 120.A O no hydrogen 3.154 N/A TRP 126.A N ARG 123.A O no hydrogen 3.166 N/A LYS 129.A N LEU 125.A O no hydrogen 3.041 N/A LYS 129.A NZ GLY 133.A O no hydrogen 3.041 N/A LYS 130.A N TRP 126.A O no hydrogen 2.718 N/A LYS 131.A N VAL 128.A O no hydrogen 3.260 N/A LYS 131.A NZ ASP 56.A OD2 no hydrogen 3.218 N/A TYR 132.A OH ASP 56.A OD2 no hydrogen 3.130 N/A GLY 133.A N LYS 129.A O no hydrogen 2.837 N/A LYS 135.A N TYR 132.A O no hydrogen 3.206 N/A LYS 135.A NZ GLU 44.A OE1 no hydrogen 3.495 N/A LEU 136.A N GLY 133.A O no hydrogen 3.336 N/A SER 137.A N TYR 41.A OH no hydrogen 3.284 N/A SER 137.A OG TYR 41.A OH no hydrogen 3.070 N/A SER 137.A OG ARG 164.A O no hydrogen 2.536 N/A TRP 138.A N ASP 166.A OD2 no hydrogen 2.677 N/A ALA 139.A N ASP 166.A OD1 no hydrogen 3.042 N/A ASP 140.A N SER 137.A OG no hydrogen 3.238 N/A LEU 141.A N SER 137.A O no hydrogen 2.968 N/A ILE 142.A N TRP 138.A O no hydrogen 2.903 N/A PHE 144.A N ASP 140.A O no hydrogen 2.925 N/A ALA 145.A N LEU 141.A O no hydrogen 2.882 N/A ASN 147.A N VAL 143.A O no hydrogen 2.972 N/A ASN 147.A ND2 GLY 159.A O no hydrogen 3.551 N/A CYS 148.A N PHE 144.A O no hydrogen 2.859 N/A ALA 149.A N ALA 145.A O no hydrogen 2.871 N/A LEU 150.A N GLY 146.A O no hydrogen 2.938 N/A GLU 151.A N ASN 147.A O no hydrogen 2.954 N/A SER 152.A N CYS 148.A O no hydrogen 2.868 N/A MET 153.A N ALA 149.A O no hydrogen 3.299 N/A GLY 154.A N GLU 151.A O no hydrogen 3.378 N/A PHE 155.A N LEU 150.A O no hydrogen 3.163 N/A THR 157.A N GLU 151.A OE2 no hydrogen 2.689 N/A THR 157.A OG1 ASN 147.A OD1 no hydrogen 3.155 N/A THR 157.A OG1 GLU 151.A OE2 no hydrogen 2.432 N/A PHE 160.A N LEU 392.A O no hydrogen 3.041 N/A GLY 161.A N HIS 379.A NE2 no hydrogen 3.149 N/A PHE 162.A N LEU 389.A O no hydrogen 2.894 N/A GLY 163.A N ASP 140.A OD2 no hydrogen 2.938 N/A ARG 164.A N ASP 140.A OD1 no hydrogen 3.156 N/A ARG 164.A N ASP 140.A OD2 no hydrogen 3.229 N/A ARG 164.A NH1 ASP 140.A OD1 no hydrogen 2.683 N/A ARG 164.A NH1 GLY 161.A O no hydrogen 2.974 N/A ARG 164.A NH2 ILE 378.A O no hydrogen 2.747 N/A TRP 168.A N ASN 28.A OD1 no hydrogen 3.327 N/A ILE 190.A N ASP 114.A OD2 no hydrogen 2.673 N/A ASN 193.A ND2 GLY 196.A O no hydrogen 3.432 N/A GLY 196.A N ASN 193.A O no hydrogen 2.909 N/A GLY 199.A N GLY 196.A O no hydrogen 3.272 N/A ASN 200.A N PRO 197.A O no hydrogen 2.852 N/A ALA 205.A N ASP 202.A OD2 no hydrogen 2.939 N/A ALA 206.A N ASP 202.A O no hydrogen 3.251 N/A ALA 207.A N PRO 203.A O no hydrogen 2.930 N/A ILE 210.A N ALA 206.A O no hydrogen 2.942 N/A ARG 211.A N ALA 207.A O no hydrogen 2.898 N/A ARG 211.A NH1 ASP 221.A OD1 no hydrogen 3.171 N/A ARG 211.A NH2 ASP 349.A OD2 no hydrogen 3.082 N/A GLU 212.A N VAL 208.A O no hydrogen 2.928 N/A THR 213.A N ASP 209.A O no hydrogen 2.923 N/A THR 213.A OG1 ASP 209.A O no hydrogen 2.726 N/A THR 213.A OG1 ILE 210.A O no hydrogen 3.118 N/A PHE 214.A N ILE 210.A O no hydrogen 2.929 N/A ARG 215.A N ARG 211.A O no hydrogen 2.872 N/A ARG 215.A NE GLU 212.A OE1 no hydrogen 3.101 N/A ARG 215.A NE GLU 212.A OE2 no hydrogen 3.293 N/A ARG 215.A NH1 GLU 212.A OE1 no hydrogen 3.085 N/A ARG 216.A N GLU 212.A O no hydrogen 2.948 N/A ARG 216.A NE GLU 212.A OE1 no hydrogen 2.876 N/A MET 217.A N PHE 214.A O no hydrogen 3.005 N/A ALA 218.A N ARG 215.A O no hydrogen 3.232 N/A MET 219.A N PHE 214.A O no hydrogen 3.182 N/A ASN 220.A N ASN 220.A OD1 no hydrogen 2.600 N/A THR 224.A N ASN 220.A O no hydrogen 2.880 N/A THR 224.A OG1 ASN 220.A O no hydrogen 2.680 N/A ALA 225.A N ASP 221.A O no hydrogen 3.016 N/A ALA 226.A N VAL 222.A O no hydrogen 3.102 N/A LEU 227.A N GLU 223.A O no hydrogen 3.132 N/A ILE 228.A N THR 224.A O no hydrogen 3.188 N/A VAL 229.A N ALA 225.A O no hydrogen 2.915 N/A GLY 230.A N ALA 226.A O no hydrogen 2.897 N/A GLY 231.A N LEU 227.A O no hydrogen 2.884 N/A HIS 232.A N ILE 228.A O no hydrogen 3.124 N/A THR 233.A N GLY 230.A O no hydrogen 3.275 N/A THR 233.A OG1 VAL 229.A O no hydrogen 2.342 N/A THR 233.A OG1 GLY 230.A O no hydrogen 3.212 N/A GLY 235.A N PRO 287.A O no hydrogen 2.789 N/A LYS 236.A NZ THR 237.A O no hydrogen 2.540 N/A LYS 236.A NZ GLU 280.A OE1 no hydrogen 2.956 N/A LYS 236.A NZ GLU 280.A OE2 no hydrogen 3.499 N/A THR 237.A N VAL 281.A O no hydrogen 2.544 N/A HIS 238.A NE2 ASP 71.A OD1 no hydrogen 3.150 N/A GLY 239.A N GLU 280.A OE2 no hydrogen 2.798 N/A ALA 240.A N ALA 274.A O no hydrogen 3.332 N/A VAL 246.A N ALA 243.A O no hydrogen 3.381 N/A GLY 247.A N LYS 263.A O no hydrogen 2.680 N/A GLU 251.A N SER 111.A OG no hydrogen 3.271 N/A ALA 252.A N GLU 249.A O no hydrogen 2.893 N/A ALA 253.A N PRO 250.A O no hydrogen 3.370 N/A GLU 256.A N GLU 256.A OE1 no hydrogen 2.709 N/A MET 258.A N LEU 255.A O no hydrogen 3.322 N/A LEU 260.A N GLN 257.A O no hydrogen 3.175 N/A GLY 261.A N ASP 119.A OD2 no hydrogen 2.724 N/A TRP 262.A N PRO 248.A O no hydrogen 2.578 N/A SER 265.A N LEU 245.A O no hydrogen 2.897 N/A SER 265.A OG LEU 245.A O no hydrogen 3.081 N/A TYR 266.A N SER 264.A OG no hydrogen 3.315 N/A THR 268.A N ASP 273.A OD2 no hydrogen 3.102 N/A THR 268.A OG1 THR 270.A O no hydrogen 2.945 N/A THR 268.A OG1 ASP 273.A OD2 no hydrogen 3.239 N/A GLY 269.A N TYR 266.A O no hydrogen 2.910 N/A ALA 274.A N GLY 271.A O no hydrogen 3.198 N/A THR 276.A N HIS 238.A O no hydrogen 2.924 N/A THR 276.A OG1 SER 117.A OG no hydrogen 2.552 N/A SER 277.A N HIS 238.A O no hydrogen 3.323 N/A GLY 278.A N HIS 238.A O no hydrogen 3.291 N/A THR 284.A OG1 THR 233.A O no hydrogen 3.056 N/A THR 286.A OG1 ASP 291.A OD1 no hydrogen 3.228 N/A THR 286.A OG1 ASP 291.A OD2 no hydrogen 2.724 N/A LYS 289.A N THR 286.A O no hydrogen 3.434 N/A TRP 290.A N MET 153.A O no hydrogen 2.910 N/A SER 293.A OG ASP 291.A OD1 no hydrogen 3.499 N/A SER 293.A OG ASP 291.A OD2 no hydrogen 3.542 N/A ILE 297.A N SER 293.A O no hydrogen 3.140 N/A LEU 298.A N PHE 294.A O no hydrogen 2.909 N/A TYR 299.A N LEU 295.A O no hydrogen 2.995 N/A TYR 299.A OH THR 356.A OG1 no hydrogen 2.227 N/A GLY 300.A N ILE 297.A O no hydrogen 3.153 N/A TRP 303.A NE1 LEU 298.A O no hydrogen 3.139 N/A THR 306.A N GLN 314.A O no hydrogen 2.789 N/A THR 306.A OG1 GLN 314.A O no hydrogen 3.540 N/A SER 308.A N ALA 312.A O no hydrogen 3.054 N/A SER 308.A OG GLY 278.A O no hydrogen 2.435 N/A GLY 311.A N SER 308.A O no hydrogen 2.828 N/A GLY 311.A N SER 308.A OG no hydrogen 3.103 N/A TRP 313.A N GLU 195.A OE2 no hydrogen 2.519 N/A GLN 314.A N THR 306.A O no hydrogen 3.187 N/A TYR 315.A N MET 339.A O no hydrogen 3.035 N/A TYR 315.A OH PRO 201.A O no hydrogen 2.663 N/A THR 316.A N GLU 304.A O no hydrogen 2.860 N/A THR 316.A OG1 SER 336.A OG no hydrogen 3.295 N/A THR 316.A OG1 PRO 337.A O no hydrogen 3.056 N/A ALA 317.A N PRO 337.A O no hydrogen 3.331 N/A LYS 318.A N GLU 302.A O no hydrogen 2.565 N/A ALA 321.A N ASP 319.A O no hydrogen 3.037 N/A THR 325.A OG1 GLY 322.A O no hydrogen 3.090 N/A ILE 326.A N ARG 335.A O no hydrogen 3.093 N/A ASP 328.A N ASP 328.A OD1 no hydrogen 2.413 N/A ARG 335.A N ILE 326.A O no hydrogen 2.795 N/A ARG 335.A NH1 GLU 280.A OE1 no hydrogen 2.344 N/A SER 336.A OG THR 316.A OG1 no hydrogen 3.295 N/A THR 338.A OG1 SER 336.A O no hydrogen 3.076 N/A MET 339.A N TYR 315.A O no hydrogen 2.821 N/A ASP 343.A N LEU 340.A O no hydrogen 3.253 N/A SER 345.A OG PRO 203.A O no hydrogen 2.948 N/A SER 345.A OG THR 342.A O no hydrogen 3.307 N/A LEU 346.A N ASP 343.A O no hydrogen 3.350 N/A ARG 347.A N LEU 344.A O no hydrogen 2.892 N/A ARG 347.A NH1 TYR 301.A O no hydrogen 2.573 N/A ARG 347.A NH2 GLU 302.A OE2 no hydrogen 3.078 N/A VAL 348.A N LEU 344.A O no hydrogen 2.870 N/A ILE 351.A N ASP 349.A OD2 no hydrogen 3.210 N/A TYR 352.A N ASP 349.A OD2 no hydrogen 3.117 N/A GLU 353.A N ASP 349.A O no hydrogen 2.858 N/A THR 356.A N TYR 352.A O no hydrogen 2.943 N/A THR 356.A OG1 TYR 299.A OH no hydrogen 2.227 N/A THR 356.A OG1 LEU 346.A O no hydrogen 3.029 N/A THR 356.A OG1 TYR 352.A O no hydrogen 3.004 N/A THR 356.A OG1 GLU 353.A O no hydrogen 2.957 N/A ARG 357.A N GLU 353.A O no hydrogen 2.865 N/A ARG 357.A NH1 GLU 353.A OE2 no hydrogen 3.209 N/A ARG 358.A N ARG 354.A O no hydrogen 2.917 N/A ARG 358.A NE GLU 365.A OE1 no hydrogen 3.235 N/A ARG 358.A NH2 GLU 365.A OE2 no hydrogen 2.853 N/A TRP 359.A N ILE 355.A O no hydrogen 2.948 N/A LEU 360.A N THR 356.A O no hydrogen 2.892 N/A LEU 360.A N ARG 357.A O no hydrogen 3.224 N/A GLU 361.A N ARG 358.A O no hydrogen 3.374 N/A HIS 362.A N ARG 358.A O no hydrogen 3.328 N/A GLU 364.A N GLU 364.A OE1 no hydrogen 3.091 N/A GLU 365.A N HIS 362.A O no hydrogen 3.167 N/A ALA 367.A N PRO 363.A O no hydrogen 2.900 N/A ASP 368.A N GLU 364.A O no hydrogen 2.942 N/A GLU 369.A N GLU 365.A O no hydrogen 2.896 N/A PHE 370.A N LEU 366.A O no hydrogen 2.865 N/A ALA 371.A N ALA 367.A O no hydrogen 2.917 N/A LYS 372.A N ASP 368.A O no hydrogen 2.991 N/A LYS 372.A NZ GLU 369.A OE2 no hydrogen 3.032 N/A ALA 373.A N GLU 369.A O no hydrogen 2.874 N/A TRP 374.A N PHE 370.A O no hydrogen 2.849 N/A TYR 375.A N ALA 371.A O no hydrogen 2.963 N/A LYS 376.A N LYS 372.A O no hydrogen 2.941 N/A LYS 376.A NZ ALA 218.A O no hydrogen 2.822 N/A LYS 376.A NZ GLU 223.A OE2 no hydrogen 3.445 N/A LEU 377.A N ALA 373.A O no hydrogen 2.830 N/A ILE 378.A N TRP 374.A O no hydrogen 2.986 N/A HIS 379.A N LYS 376.A O no hydrogen 3.450 N/A HIS 379.A ND1 TYR 375.A O no hydrogen 2.883 N/A ARG 380.A NH1.A ARG 380.A O no hydrogen 2.573 N/A ARG 380.A NH2.B TYR 191.A OH no hydrogen 3.413 N/A ARG 387.A N PRO 384.A O no hydrogen 3.032 N/A ARG 387.A NH1 MET 382.A O no hydrogen 2.399 N/A TYR 388.A N VAL 385.A O no hydrogen 3.278 N/A LEU 389.A N PHE 162.A O no hydrogen 3.128 N/A LEU 398.A N GLN 401.A OE1 no hydrogen 3.111 N/A GLN 401.A N LEU 398.A O no hydrogen 3.240 N/A GLN 401.A NE2 TYR 388.A OH no hydrogen 3.074 N/A ASP 402.A N LEU 399.A O no hydrogen 3.180 N/A SER 408.A OG ALA 406.A O no hydrogen 3.484 N/A ASP 410.A N ASN 497.A O no hydrogen 3.348 N/A SER 419.A N ALA 415.A O no hydrogen 3.442 N/A SER 419.A OG GLU 416.A O no hydrogen 2.876 N/A LEU 420.A N GLU 416.A O no hydrogen 2.665 N/A LYS 421.A N ILE 417.A O no hydrogen 2.862 N/A LYS 421.A NZ GLU 515.A OE1 no hydrogen 2.496 N/A SER 422.A N ALA 418.A O no hydrogen 3.155 N/A SER 422.A N SER 419.A O no hydrogen 3.122 N/A SER 422.A OG ALA 418.A O no hydrogen 2.863 N/A GLN 423.A N SER 419.A O no hydrogen 3.317 N/A GLN 423.A N LEU 420.A O no hydrogen 3.298 N/A GLN 423.A NE2 SER 419.A O no hydrogen 3.089 N/A ILE 424.A N LEU 420.A O no hydrogen 3.053 N/A ARG 425.A N LYS 421.A O no hydrogen 3.273 N/A ARG 425.A NE ALA 512.A O no hydrogen 3.378 N/A SER 427.A N ILE 424.A O no hydrogen 3.372 N/A SER 427.A OG ILE 424.A O no hydrogen 2.520 N/A THR 430.A N GLN 433.A OE1 no hydrogen 3.456 N/A THR 430.A OG1 SER 432.A OG no hydrogen 3.049 N/A SER 432.A OG THR 430.A OG1 no hydrogen 3.049 N/A GLN 433.A N THR 430.A OG1 no hydrogen 3.343 N/A LEU 434.A N THR 430.A O no hydrogen 3.166 N/A VAL 435.A N VAL 431.A O no hydrogen 2.925 N/A SER 436.A N SER 432.A O no hydrogen 2.875 N/A THR 437.A N GLN 433.A O no hydrogen 2.931 N/A THR 437.A OG1 GLN 433.A O no hydrogen 2.815 N/A ALA 438.A N LEU 434.A O no hydrogen 2.919 N/A TRP 439.A N VAL 435.A O no hydrogen 2.901 N/A ALA 440.A N SER 436.A O no hydrogen 2.873 N/A ALA 441.A N THR 437.A O no hydrogen 2.938 N/A ALA 442.A N ALA 438.A O no hydrogen 3.195 N/A SER 443.A N TRP 439.A O no hydrogen 2.783 N/A SER 443.A OG TRP 439.A O no hydrogen 3.052 N/A SER 444.A OG ALA 441.A O no hydrogen 3.175 N/A ARG 446.A N ARG 451.A O no hydrogen 3.162 N/A ARG 446.A NE ASP 449.A OD1 no hydrogen 2.835 N/A ARG 446.A NE ASP 449.A OD2 no hydrogen 3.271 N/A ARG 446.A NH1 ILE 92.A O no hydrogen 2.922 N/A ARG 446.A NH2 ILE 92.A O no hydrogen 2.791 N/A ARG 446.A NH2 ASP 449.A OD2 no hydrogen 2.994 N/A GLY 447.A N LEU 578.A O no hydrogen 2.539 N/A SER 448.A OG ASP 94.A O no hydrogen 2.773 N/A SER 448.A OG ASP 449.A OD1 no hydrogen 3.352 N/A LYS 450.A NZ GLY 447.A O no hydrogen 3.446 N/A ARG 451.A NE ASP 402.A OD2 no hydrogen 3.436 N/A ARG 451.A NH1 SER 545.A O no hydrogen 3.257 N/A ARG 451.A NH2 SER 545.A O no hydrogen 2.916 N/A GLY 453.A N SER 444.A OG no hydrogen 3.330 N/A ASN 455.A N ASP 697.A OD2 no hydrogen 2.762 N/A GLY 456.A N ASN 455.A OD1 no hydrogen 2.729 N/A GLY 457.A N ALA 454.A O no hydrogen 3.442 N/A ARG 458.A NE THR 541.A OG1 no hydrogen 2.999 N/A ARG 458.A NH2 PRO 403.A O no hydrogen 2.964 N/A ARG 458.A NH2 GLN 540.A O no hydrogen 3.545 N/A ARG 460.A NH1 GLU 484.A OE1 no hydrogen 2.817 N/A LEU 461.A N ARG 458.A O no hydrogen 3.174 N/A GLN 462.A N GLN 538.A OE1 no hydrogen 2.806 N/A VAL 465.A N LEU 461.A O no hydrogen 2.948 N/A TRP 467.A N GLN 464.A O no hydrogen 3.263 N/A ASN 470.A N TRP 467.A O no hydrogen 3.164 N/A ASN 470.A ND2 GLN 464.A O no hydrogen 2.578 N/A ASP 471.A N TRP 467.A O no hydrogen 3.373 N/A VAL 479.A N ASP 475.A O no hydrogen 2.819 N/A ILE 480.A N LEU 476.A O no hydrogen 2.918 N/A ARG 481.A N ARG 477.A O no hydrogen 2.898 N/A THR 482.A N LYS 478.A O no hydrogen 2.934 N/A THR 482.A OG1 LYS 478.A O no hydrogen 3.071 N/A LEU 483.A N VAL 479.A O no hydrogen 2.910 N/A GLU 484.A N ILE 480.A O no hydrogen 2.913 N/A GLU 485.A N ARG 481.A O no hydrogen 2.906 N/A ILE 486.A N THR 482.A O no hydrogen 2.942 N/A GLN 487.A N LEU 483.A O no hydrogen 2.872 N/A GLN 487.A NE2 VAL 500.A O no hydrogen 3.131 N/A GLU 488.A N GLU 484.A O no hydrogen 2.954 N/A SER 489.A N GLU 485.A O no hydrogen 2.911 N/A PHE 490.A N ILE 486.A O no hydrogen 2.891 N/A ASN 491.A N GLN 487.A O no hydrogen 2.896 N/A ASN 491.A ND2 VAL 500.A O no hydrogen 3.535 N/A SER 492.A OG SER 489.A O no hydrogen 3.266 N/A LYS 499.A N ASP 410.A O no hydrogen 3.289 N/A VAL 500.A N ASN 491.A OD1 no hydrogen 3.189 N/A SER 501.A OG ASP 504.A OD2 no hydrogen 3.444 N/A SER 501.A OG ARG 533.A O no hydrogen 2.519 N/A PHE 502.A N ASP 535.A OD2 no hydrogen 3.030 N/A ALA 503.A N ASP 535.A OD1 no hydrogen 3.202 N/A LEU 505.A N SER 501.A O no hydrogen 3.042 N/A VAL 506.A N PHE 502.A O no hydrogen 2.912 N/A VAL 507.A N ALA 503.A O no hydrogen 3.018 N/A LEU 508.A N ASP 504.A O no hydrogen 2.836 N/A GLY 509.A N LEU 505.A O no hydrogen 2.807 N/A GLY 510.A N VAL 506.A O no hydrogen 3.020 N/A CYS 511.A N VAL 507.A O no hydrogen 2.949 N/A CYS 511.A SG VAL 507.A O no hydrogen 3.214 N/A ALA 512.A N LEU 508.A O no hydrogen 2.849 N/A ALA 513.A N GLY 509.A O no hydrogen 2.909 N/A ILE 514.A N GLY 510.A O no hydrogen 2.963 N/A GLU 515.A N CYS 511.A O no hydrogen 2.924 N/A LYS 516.A N ALA 512.A O no hydrogen 2.898 N/A ALA 517.A N ALA 513.A O no hydrogen 2.918 N/A ALA 518.A N ILE 514.A O no hydrogen 2.918 N/A LYS 519.A N GLU 515.A O no hydrogen 2.905 N/A ALA 520.A N LYS 516.A O no hydrogen 2.925 N/A ALA 521.A N ALA 517.A O no hydrogen 2.913 N/A GLY 522.A N LYS 519.A O no hydrogen 3.184 N/A HIS 523.A N ALA 518.A O no hydrogen 2.884 N/A VAL 527.A N GLU 515.A OE1 no hydrogen 3.114 N/A GLY 532.A N ASP 504.A OD2 no hydrogen 3.284 N/A ARG 533.A NH1 ASP 504.A OD1 no hydrogen 3.020 N/A ARG 533.A NH2 MET 694.A O no hydrogen 3.378 N/A THR 534.A N ASN 455.A OD1 no hydrogen 3.293 N/A THR 534.A OG1 PRO 405.A O no hydrogen 2.889 N/A ALA 536.A N GLY 456.A O no hydrogen 2.564 N/A GLN 538.A NE2 GLN 538.A O no hydrogen 3.031 N/A GLU 539.A N GLU 539.A OE1 no hydrogen 2.878 N/A GLN 540.A NE2 SER 537.A OG no hydrogen 3.234 N/A THR 541.A N GLN 538.A O no hydrogen 3.190 N/A THR 541.A OG1 SER 537.A O no hydrogen 3.197 N/A SER 545.A OG ASP 542.A O no hydrogen 3.338 N/A PHE 546.A N ASP 542.A O no hydrogen 3.262 N/A ALA 547.A N GLU 544.A O no hydrogen 3.346 N/A LEU 549.A N PHE 546.A O no hydrogen 3.048 N/A GLU 550.A N ALA 547.A O no hydrogen 3.478 N/A ASP 554.A N TYR 559.A O no hydrogen 2.844 N/A ARG 557.A NE ASP 554.A OD2 no hydrogen 2.749 N/A ARG 557.A NH1 ASN 470.A OD1 no hydrogen 3.169 N/A ARG 557.A NH2 ASP 554.A OD2 no hydrogen 2.821 N/A ASN 558.A N GLY 555.A O no hydrogen 3.335 N/A ASN 558.A ND2 ASN 599.A OD1 no hydrogen 3.471 N/A ASN 558.A ND2 LEU 605.A O no hydrogen 2.690 N/A TYR 559.A N ASP 554.A O no hydrogen 2.878 N/A GLY 561.A N LYS 552.A O no hydrogen 2.836 N/A GLU 569.A N GLU 569.A OE1 no hydrogen 2.756 N/A TYR 570.A N PRO 567.A O no hydrogen 3.203 N/A TYR 570.A OH ASN 18.A O no hydrogen 2.743 N/A MET 571.A N PRO 567.A O no hydrogen 3.388 N/A LEU 572.A N ALA 568.A O no hydrogen 3.386 N/A LEU 573.A N GLU 569.A O no hydrogen 3.479 N/A ASP 574.A N TYR 570.A O no hydrogen 2.957 N/A LYS 575.A N MET 571.A O no hydrogen 2.925 N/A LYS 575.A NZ SER 443.A O no hydrogen 3.185 N/A ALA 576.A N LEU 572.A O no hydrogen 2.916 N/A ASN 577.A N LEU 573.A O no hydrogen 2.881 N/A LEU 578.A N ASP 574.A O no hydrogen 2.921 N/A LEU 579.A N LYS 575.A O no hydrogen 2.801 N/A THR 580.A N ASN 577.A O no hydrogen 3.105 N/A THR 580.A OG1 LEU 579.A O no hydrogen 2.453 N/A LEU 581.A N ALA 576.A O no hydrogen 2.936 N/A SER 582.A N GLU 585.A OE1 no hydrogen 2.932 N/A MET 586.A N SER 582.A O no hydrogen 2.858 N/A THR 587.A N ALA 583.A O no hydrogen 2.912 N/A THR 587.A OG1 ALA 583.A O no hydrogen 2.940 N/A VAL 588.A N PRO 584.A O no hydrogen 2.929 N/A LEU 589.A N GLU 585.A O no hydrogen 2.949 N/A VAL 590.A N MET 586.A O no hydrogen 2.925 N/A GLY 591.A N THR 587.A O no hydrogen 2.917 N/A GLY 592.A N VAL 588.A O no hydrogen 2.891 N/A LEU 593.A N LEU 589.A O no hydrogen 2.923 N/A ARG 594.A N VAL 590.A O no hydrogen 3.388 N/A ARG 594.A NE ASP 657.A OD1 no hydrogen 2.582 N/A ARG 594.A NH1 GLY 555.A O no hydrogen 3.492 N/A ARG 594.A NH2 GLY 555.A O no hydrogen 2.886 N/A ARG 594.A NH2 ASP 657.A OD1 no hydrogen 2.697 N/A LEU 596.A N GLY 592.A O no hydrogen 3.116 N/A GLY 597.A N ARG 594.A O no hydrogen 3.384 N/A ALA 598.A N LEU 593.A O no hydrogen 3.183 N/A TYR 600.A N ARG 557.A O no hydrogen 2.698 N/A TYR 600.A OH GLU 468.A OE2 no hydrogen 2.511 N/A ARG 602.A N ASN 599.A O no hydrogen 3.043 N/A LEU 603.A N TYR 600.A O no hydrogen 3.286 N/A GLY 606.A N THR 652.A O no hydrogen 2.903 N/A VAL 607.A N PRO 604.A O no hydrogen 3.305 N/A THR 609.A OG1 ASP 618.A OD2 no hydrogen 2.921 N/A LEU 615.A N ALA 517.A O no hydrogen 3.329 N/A THR 616.A N SER 614.A O no hydrogen 2.961 N/A ASN 617.A ND2 TYR 673.A O no hydrogen 2.614 N/A PHE 620.A N ASN 617.A O no hydrogen 3.097 N/A VAL 621.A N ASN 617.A O no hydrogen 3.226 N/A ASN 622.A N ASP 618.A O no hydrogen 2.927 N/A LEU 623.A N PHE 619.A O no hydrogen 2.909 N/A LEU 624.A N PHE 620.A O no hydrogen 3.312 N/A GLY 627.A N ASP 625.A OD1 no hydrogen 2.839 N/A THR 629.A N LYS 643.A O no hydrogen 3.145 N/A GLU 631.A N GLN 641.A O no hydrogen 3.163 N/A SER 633.A N THR 639.A O no hydrogen 2.903 N/A SER 633.A OG THR 639.A O no hydrogen 2.816 N/A SER 633.A OG THR 639.A OG1 no hydrogen 2.714 N/A ASP 637.A N ALA 635.A O no hydrogen 2.621 N/A THR 639.A OG1 SER 633.A OG no hydrogen 2.714 N/A TYR 640.A N GLY 653.A O no hydrogen 2.790 N/A GLN 641.A N GLU 631.A O no hydrogen 3.031 N/A GLN 641.A NE2 GLU 631.A OE2 no hydrogen 2.735 N/A GLY 642.A N TRP 651.A O no hydrogen 2.888 N/A LYS 643.A N THR 629.A O no hydrogen 3.027 N/A ASP 644.A N LYS 648.A O no hydrogen 2.745 N/A GLY 645.A N ASP 644.A OD1 no hydrogen 2.341 N/A LYS 650.A N GLY 642.A O no hydrogen 3.051 N/A TRP 651.A N GLY 642.A O no hydrogen 3.286 N/A GLY 653.A N TYR 640.A O no hydrogen 2.748 N/A SER 654.A OG ASN 558.A OD1 no hydrogen 3.122 N/A SER 654.A OG ASP 657.A OD2 no hydrogen 3.471 N/A ARG 655.A NE GLU 569.A OE1 no hydrogen 3.359 N/A ARG 655.A NE GLU 569.A OE2 no hydrogen 2.399 N/A LEU 658.A N SER 654.A O no hydrogen 2.894 N/A VAL 659.A N ARG 655.A O no hydrogen 2.985 N/A SER 662.A N VAL 659.A O no hydrogen 3.251 N/A ASN 663.A N VAL 659.A O no hydrogen 2.822 N/A ARG 667.A N ASN 663.A O no hydrogen 2.718 N/A ARG 667.A NH1 GLY 661.A O no hydrogen 2.490 N/A VAL 670.A N LEU 666.A O no hydrogen 3.072 N/A GLU 671.A N ARG 667.A O no hydrogen 3.037 N/A VAL 672.A N LEU 669.A O no hydrogen 3.075 N/A TYR 673.A OH ASP 685.A OD2 no hydrogen 3.193 N/A GLY 674.A N VAL 670.A O no hydrogen 2.838 N/A GLN 679.A NE2 HIS 523.A NE2 no hydrogen 2.978 N/A PHE 682.A N ALA 678.A O no hydrogen 3.167 N/A VAL 683.A N GLN 679.A O no hydrogen 2.897 N/A GLN 684.A N PRO 680.A O no hydrogen 2.954 N/A ASP 685.A N LYS 681.A O no hydrogen 2.891 N/A PHE 686.A N PHE 682.A O no hydrogen 2.870 N/A VAL 687.A N VAL 683.A O no hydrogen 2.943 N/A ALA 688.A N GLN 684.A O no hydrogen 2.931 N/A ALA 689.A N ASP 685.A O no hydrogen 2.911 N/A TRP 690.A N PHE 686.A O no hydrogen 2.853 N/A ASP 691.A N VAL 687.A O no hydrogen 2.909 N/A LYS 692.A N ALA 688.A O no hydrogen 2.908 N/A VAL 693.A N ALA 689.A O no hydrogen 2.917 N/A MET 694.A N TRP 690.A O no hydrogen 2.921 N/A ASN 695.A N ASP 691.A O no hydrogen 3.198 N/A LEU 696.A N VAL 693.A O no hydrogen 3.379 N/A ARG 698.A NE ASP 700.A OD1 no hydrogen 3.162 N/A ARG 698.A NH1 THR 530.A O no hydrogen 2.671 N/A ARG 698.A NH2 PRO 531.A O no hydrogen 3.452 N/A ARG 698.A NH2 ASP 700.A OD1 no hydrogen 3.286 N/A ARG 698.A NH2 ASP 700.A OD2 no hydrogen 3.554 N/A PHE 699.A N ASP 697.A O no hydrogen 2.786 N/A ARG 702.A NH2 LEU 696.A O no hydrogen 3.272 N/A