Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ozu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N PHE 18.A O no hydrogen 2.922 N/A ARG 3.A NH1 ASP 29.A OD2 no hydrogen 3.250 N/A ALA 4.A N ASP 29.A OD1 no hydrogen 3.275 N/A PHE 5.A N ALA 16.A O no hydrogen 2.872 N/A ILE 7.A N GLY 14.A O no hydrogen 2.916 N/A ASN 9.A N VAL 12.A O no hydrogen 3.065 N/A LYS 11.A N ASN 9.A OD1 no hydrogen 2.703 N/A LYS 11.A NZ ASN 611.A OD1 no hydrogen 3.201 N/A VAL 12.A N ASN 9.A OD1 no hydrogen 3.424 N/A GLY 14.A N ILE 7.A O no hydrogen 2.875 N/A ALA 16.A N PHE 5.A O no hydrogen 2.929 N/A PHE 18.A N ARG 3.A O no hydrogen 2.883 N/A LYS 20.A N VAL 1.A O no hydrogen 3.510 N/A ARG 21.A NE LEU 22.A O no hydrogen 2.881 N/A ARG 21.A NH2 LEU 22.A O no hydrogen 2.640 N/A MET 27.A N GLN 113.A O no hydrogen 2.772 N/A LEU 30.A N THR 26.A O no hydrogen 3.436 N/A VAL 31.A N MET 27.A O no hydrogen 2.952 N/A TYR 32.A N ALA 28.A O no hydrogen 2.847 N/A ALA 33.A N ASP 29.A O no hydrogen 2.884 N/A LEU 34.A N LEU 30.A O no hydrogen 2.951 N/A ARG 35.A N VAL 31.A O no hydrogen 2.896 N/A ARG 35.A NH1 LEU 143.A O no hydrogen 3.376 N/A ARG 35.A NH1 ASP 363.A OD2 no hydrogen 3.347 N/A ARG 35.A NH2 ASP 363.A OD2 no hydrogen 3.448 N/A ARG 35.A NH2 TYR 686.A OH no hydrogen 3.030 N/A HIS 36.A N TYR 32.A O no hydrogen 2.805 N/A GLU 39.A N GLU 39.A OE1 no hydrogen 2.866 N/A ASN 41.A N ASP 38.A O no hydrogen 3.069 N/A CYS 42.A SG ASP 38.A O no hydrogen 3.117 N/A LYS 46.A N CYS 42.A O no hydrogen 2.949 N/A GLU 47.A N ASP 43.A O no hydrogen 2.950 N/A GLU 47.A N GLU 47.A OE1 no hydrogen 2.917 N/A ILE 48.A N THR 44.A O no hydrogen 2.923 N/A LEU 49.A N LEU 45.A O no hydrogen 2.902 N/A VAL 50.A N LYS 46.A O no hydrogen 2.906 N/A THR 51.A N GLU 47.A O no hydrogen 2.894 N/A THR 51.A OG1 GLU 47.A O no hydrogen 2.379 N/A ASN 53.A N VAL 50.A O no hydrogen 3.257 N/A CYS 54.A N LEU 49.A O no hydrogen 3.038 N/A CYS 54.A SG TYR 52.A O no hydrogen 3.688 N/A CYS 55.A SG ASP 56.A O no hydrogen 3.691 N/A TYR 59.A N ASP 56.A O no hydrogen 3.227 N/A TYR 59.A OH ASP 73.A OD2 no hydrogen 2.923 N/A PHE 60.A N ASP 57.A O no hydrogen 3.313 N/A ASN 61.A N ASP 58.A O no hydrogen 3.312 N/A LYS 62.A N TYR 59.A O no hydrogen 3.213 N/A VAL 69.A N ASP 67.A OD1 no hydrogen 3.074 N/A ASN 71.A N ASP 67.A O no hydrogen 3.129 N/A ASN 71.A ND2 TYR 59.A OH no hydrogen 2.693 N/A ASN 71.A ND2 TRP 65.A O no hydrogen 2.958 N/A ILE 74.A N ASN 71.A O no hydrogen 3.131 N/A LEU 75.A N PRO 72.A O no hydrogen 2.920 N/A ARG 76.A N ASP 73.A O no hydrogen 2.903 N/A ARG 76.A NE ASP 73.A OD1 no hydrogen 2.967 N/A ARG 76.A NH2 ASP 73.A OD2 no hydrogen 2.850 N/A VAL 77.A N ASP 73.A O no hydrogen 3.323 N/A TYR 78.A N ILE 74.A O no hydrogen 2.906 N/A TYR 78.A OH TYR 685.A OH no hydrogen 2.313 N/A ALA 79.A N LEU 75.A O no hydrogen 3.327 N/A ASN 80.A N ARG 76.A O no hydrogen 3.145 N/A ASN 80.A N VAL 77.A O no hydrogen 2.948 N/A LEU 81.A N TYR 78.A O no hydrogen 2.921 N/A GLY 82.A N ALA 79.A O no hydrogen 2.928 N/A ARG 84.A NH1 LEU 115.A O no hydrogen 3.340 N/A ARG 84.A NH1 ASN 116.A OD1 no hydrogen 3.111 N/A VAL 85.A N LEU 81.A O no hydrogen 2.966 N/A ARG 86.A N GLY 82.A O no hydrogen 2.758 N/A ARG 86.A NH1 TYR 189.A OH no hydrogen 2.636 N/A ARG 86.A NH2 GLN 87.A OE1 no hydrogen 3.265 N/A GLN 87.A N GLU 83.A O no hydrogen 2.862 N/A ALA 88.A N ARG 84.A O no hydrogen 3.034 N/A LEU 89.A N VAL 85.A O no hydrogen 3.027 N/A LEU 90.A N ARG 86.A O no hydrogen 3.158 N/A LYS 91.A N GLN 87.A O no hydrogen 2.966 N/A THR 92.A N ALA 88.A O no hydrogen 2.762 N/A THR 92.A OG1 ALA 88.A O no hydrogen 3.269 N/A THR 92.A OG1 TYR 140.A OH no hydrogen 2.635 N/A VAL 93.A N LEU 89.A O no hydrogen 3.050 N/A GLN 94.A N LEU 90.A O no hydrogen 3.041 N/A PHE 95.A N LYS 91.A O no hydrogen 2.778 N/A CYS 96.A N THR 92.A O no hydrogen 2.823 N/A CYS 96.A SG THR 92.A O no hydrogen 3.725 N/A ASP 97.A N VAL 93.A O no hydrogen 2.833 N/A ALA 98.A N GLN 94.A O no hydrogen 2.809 N/A MET 99.A N PHE 95.A O no hydrogen 2.873 N/A ARG 100.A N CYS 96.A O no hydrogen 2.776 N/A ARG 100.A NE TYR 192.A OH no hydrogen 2.324 N/A ASN 101.A N ASP 97.A O no hydrogen 2.784 N/A ALA 102.A N MET 99.A O no hydrogen 2.937 N/A ILE 104.A N MET 99.A O no hydrogen 3.190 N/A VAL 105.A N ILE 126.A O no hydrogen 3.061 N/A LEU 108.A N VAL 136.A O no hydrogen 2.997 N/A THR 109.A OG1 ASP 111.A OD1 no hydrogen 3.397 N/A THR 109.A OG1 ASN 112.A OD1 no hydrogen 2.234 N/A GLN 113.A N LEU 110.A O no hydrogen 3.316 N/A GLN 113.A NE2 ALA 88.A O no hydrogen 3.400 N/A GLN 113.A NE2 GLY 117.A O no hydrogen 2.806 N/A ASP 114.A N ASN 118.A O no hydrogen 3.200 N/A GLY 117.A N ASP 114.A O no hydrogen 2.784 N/A TYR 120.A N ASN 112.A O no hydrogen 3.360 N/A GLY 123.A N ASP 121.A OD1 no hydrogen 2.859 N/A ILE 126.A N VAL 105.A O no hydrogen 3.355 N/A GLN 127.A NE2 ALA 102.A O no hydrogen 3.499 N/A THR 128.A OG1 GLY 103.A O no hydrogen 3.385 N/A THR 128.A OG1 ILE 126.A O no hydrogen 3.436 N/A SER 132.A N THR 129.A O no hydrogen 3.164 N/A SER 132.A OG THR 129.A O no hydrogen 2.466 N/A VAL 136.A N GLY 106.A O no hydrogen 2.942 N/A TYR 140.A OH GLN 113.A OE1 no hydrogen 2.570 N/A TYR 141.A N VAL 137.A O no hydrogen 3.326 N/A SER 142.A N ASP 138.A O no hydrogen 2.928 N/A SER 142.A OG ASP 138.A O no hydrogen 2.525 N/A SER 142.A OG ASP 138.A OD1 no hydrogen 3.035 N/A LEU 143.A N SER 139.A O no hydrogen 2.905 N/A LEU 144.A N TYR 140.A O no hydrogen 2.948 N/A MET 145.A N TYR 141.A O no hydrogen 2.915 N/A ILE 147.A N LEU 144.A O no hydrogen 3.029 N/A LEU 148.A N MET 145.A O no hydrogen 2.918 N/A THR 149.A OG1 PRO 146.A O no hydrogen 3.557 N/A THR 149.A OG1 PRO 359.A O no hydrogen 3.377 N/A LEU 150.A N PRO 146.A O no hydrogen 2.937 N/A THR 151.A N ILE 147.A O no hydrogen 3.120 N/A THR 151.A OG1 ILE 147.A O no hydrogen 2.567 N/A ALA 153.A N LEU 148.A O no hydrogen 2.878 N/A GLU 157.A N LEU 154.A O no hydrogen 2.917 N/A SER 158.A N THR 155.A O no hydrogen 2.928 N/A SER 158.A OG THR 155.A O no hydrogen 3.165 N/A HIS 159.A ND1 ASP 163.A O no hydrogen 3.026 N/A VAL 160.A N PRO 167.A O no hydrogen 3.250 N/A THR 162.A N HIS 159.A O no hydrogen 3.093 N/A THR 162.A OG1 ASP 161.A O no hydrogen 2.511 N/A THR 165.A OG1 ASP 163.A OD2 no hydrogen 2.218 N/A LYS 166.A N ASP 163.A OD2 no hydrogen 2.735 N/A LYS 166.A NZ ASP 161.A OD2 no hydrogen 2.499 N/A ILE 169.A N SER 158.A O no hydrogen 3.002 N/A LYS 175.A N ASP 172.A O no hydrogen 3.187 N/A LYS 175.A NZ ASP 177.A O no hydrogen 3.301 N/A THR 179.A OG1 ASP 177.A OD1 no hydrogen 3.524 N/A THR 179.A OG1 ASN 200.A OD1 no hydrogen 3.159 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.841 N/A ARG 182.A N PHE 178.A O no hydrogen 3.031 N/A ARG 182.A NH1 SER 221.A OG no hydrogen 2.895 N/A ARG 182.A NH1 ARG 252.A O no hydrogen 3.292 N/A LEU 183.A N THR 179.A O no hydrogen 2.923 N/A LYS 184.A N GLU 180.A O no hydrogen 2.944 N/A LEU 185.A N GLU 181.A O no hydrogen 2.878 N/A PHE 186.A N ARG 182.A O no hydrogen 2.918 N/A ASP 187.A N LEU 183.A O no hydrogen 2.884 N/A ARG 188.A N LYS 184.A O no hydrogen 2.955 N/A TYR 189.A N LEU 185.A O no hydrogen 3.221 N/A TYR 189.A OH GLU 157.A OE2 no hydrogen 2.469 N/A LYS 191.A NZ ASP 97.A OD1 no hydrogen 3.172 N/A LYS 191.A NZ ASP 97.A OD2 no hydrogen 3.397 N/A TYR 192.A OH ASP 97.A OD1 no hydrogen 2.395 N/A TRP 193.A NE1 HIS 212.A NE2 no hydrogen 2.856 N/A TYR 197.A OH ASN 217.A OD1 no hydrogen 2.306 N/A CYS 201.A N LEU 254.A O no hydrogen 3.213 N/A CYS 201.A SG ILE 210.A O no hydrogen 3.998 N/A CYS 201.A SG GLU 253.A O no hydrogen 3.845 N/A ASN 203.A N ASN 200.A O no hydrogen 3.103 N/A CYS 204.A SG HIS 198.A ND1 no hydrogen 3.668 N/A ARG 208.A NH1 GLU 372.A OE2 no hydrogen 2.964 N/A ARG 208.A NH2 ARG 633.A O no hydrogen 3.418 N/A CYS 209.A N ASP 206.A OD1 no hydrogen 3.365 N/A ILE 210.A N ASP 206.A O no hydrogen 2.950 N/A LEU 211.A N ASP 207.A O no hydrogen 2.904 N/A HIS 212.A N ARG 208.A O no hydrogen 2.952 N/A CYS 213.A N CYS 209.A O no hydrogen 2.915 N/A CYS 213.A SG HIS 198.A ND1 no hydrogen 3.663 N/A CYS 213.A SG CYS 209.A O no hydrogen 3.129 N/A CYS 213.A SG HIS 212.A ND1 no hydrogen 3.797 N/A ALA 214.A N ILE 210.A O no hydrogen 2.876 N/A ASN 215.A N LEU 211.A O no hydrogen 2.888 N/A ASN 215.A ND2 CYS 362.A O no hydrogen 2.849 N/A PHE 216.A N HIS 212.A O no hydrogen 3.061 N/A ASN 217.A N CYS 213.A O no hydrogen 2.897 N/A ASN 217.A ND2 PRO 199.A O no hydrogen 2.632 N/A ASN 217.A ND2 GLU 253.A O no hydrogen 2.735 N/A VAL 218.A N ALA 214.A O no hydrogen 2.917 N/A PHE 220.A N PHE 216.A O no hydrogen 2.978 N/A SER 221.A OG ASN 217.A O no hydrogen 2.850 N/A SER 221.A OG ARG 252.A O no hydrogen 2.241 N/A THR 222.A N LEU 219.A O no hydrogen 3.483 N/A THR 222.A OG1 LEU 219.A O no hydrogen 3.081 N/A SER 228.A OG PRO 225.A O no hydrogen 2.979 N/A GLY 230.A N HIS 250.A O no hydrogen 3.268 N/A ARG 234.A N VAL 245.A O no hydrogen 2.855 N/A ILE 236.A N PHE 243.A O no hydrogen 2.894 N/A VAL 238.A N VAL 241.A O no hydrogen 2.923 N/A VAL 241.A N VAL 238.A O no hydrogen 2.915 N/A PHE 243.A N ILE 236.A O no hydrogen 2.854 N/A VAL 245.A N ARG 234.A O no hydrogen 2.961 N/A SER 246.A N ASP 275.A OD2 no hydrogen 3.283 N/A SER 246.A OG ASP 275.A OD1 no hydrogen 3.237 N/A SER 246.A OG ASP 275.A OD2 no hydrogen 2.226 N/A THR 247.A N LEU 232.A O no hydrogen 2.672 N/A TYR 249.A N VAL 257.A O no hydrogen 2.896 N/A HIS 250.A N GLY 230.A O no hydrogen 3.170 N/A PHE 251.A N GLY 255.A O no hydrogen 2.879 N/A GLY 255.A N PHE 251.A O no hydrogen 2.937 N/A VAL 257.A N TYR 249.A O no hydrogen 2.911 N/A ASN 259.A ND2 VAL 433.A O no hydrogen 3.675 N/A GLN 260.A N ASN 432.A OD1 no hydrogen 3.062 N/A ASP 261.A N ASN 432.A OD1 no hydrogen 3.168 N/A LEU 269.A N SER 265.A O no hydrogen 2.883 N/A LEU 270.A N PHE 266.A O no hydrogen 2.970 N/A VAL 271.A N LYS 267.A O no hydrogen 2.916 N/A TYR 272.A N GLU 268.A O no hydrogen 2.893 N/A ALA 273.A N LEU 269.A O no hydrogen 2.883 N/A ALA 274.A N LEU 270.A O no hydrogen 2.914 N/A ASP 275.A N TYR 272.A O no hydrogen 3.211 N/A ALA 277.A N ASP 275.A OD1 no hydrogen 3.024 N/A HIS 279.A NE2 ALA 273.A O no hydrogen 3.028 N/A ALA 280.A N PRO 276.A O no hydrogen 2.905 N/A ALA 281.A N ALA 277.A O no hydrogen 2.898 N/A SER 282.A OG MET 278.A O no hydrogen 3.501 N/A GLY 283.A N ALA 280.A O no hydrogen 3.378 N/A ASN 284.A N ALA 298.A O no hydrogen 3.284 N/A ARG 290.A NE ASP 288.A OD1 no hydrogen 3.192 N/A ARG 290.A NE ASP 288.A OD2 no hydrogen 3.337 N/A ARG 290.A NH2 ASP 288.A OD1 no hydrogen 2.969 N/A CYS 293.A SG PHE 294.A O no hydrogen 3.357 N/A CYS 293.A SG TYR 351.A OH no hydrogen 3.039 N/A CYS 293.A SG VAL 573.A O no hydrogen 3.099 N/A VAL 296.A N LEU 571.A O no hydrogen 2.896 N/A ALA 298.A N ASN 284.A O no hydrogen 2.764 N/A LEU 299.A N GLY 569.A O no hydrogen 3.381 N/A THR 300.A OG1 ASN 302.A O no hydrogen 2.842 N/A ALA 304.A N GLY 568.A O no hydrogen 3.340 N/A VAL 308.A N GLN 342.A O no hydrogen 3.184 N/A ASN 312.A N VAL 742.A O no hydrogen 3.302 N/A ASN 314.A N CYS 740.A O no hydrogen 2.858 N/A LYS 315.A NZ ASP 319.A OD1 no hydrogen 3.467 N/A PHE 317.A N ASN 314.A OD1 no hydrogen 3.329 N/A TYR 318.A N ASN 314.A O no hydrogen 3.193 N/A ASP 319.A N LYS 315.A O no hydrogen 2.873 N/A PHE 320.A N ASP 316.A O no hydrogen 2.925 N/A ALA 321.A N PHE 317.A O no hydrogen 2.880 N/A VAL 322.A N TYR 318.A O no hydrogen 2.915 N/A SER 323.A N ASP 319.A O no hydrogen 2.908 N/A SER 323.A OG ASP 319.A O no hydrogen 3.486 N/A SER 323.A OG PHE 320.A O no hydrogen 2.662 N/A LYS 324.A N PHE 320.A O no hydrogen 3.122 N/A LYS 324.A N ALA 321.A O no hydrogen 3.157 N/A LYS 324.A NZ GLN 784.A OE1 no hydrogen 2.220 N/A GLY 325.A N VAL 322.A O no hydrogen 3.128 N/A PHE 326.A N ALA 321.A O no hydrogen 2.931 N/A SER 331.A N LYS 328.A O no hydrogen 3.101 N/A SER 331.A OG VAL 333.A O no hydrogen 3.380 N/A VAL 333.A N SER 331.A OG no hydrogen 3.288 N/A HIS 337.A ND1 SER 733.A OG no hydrogen 3.069 N/A PHE 338.A N SER 447.A O no hydrogen 3.233 N/A GLN 342.A N VAL 308.A O no hydrogen 3.320 N/A GLN 342.A NE2 ASN 450.A O no hydrogen 2.515 N/A ASP 343.A N ASP 343.A OD1 no hydrogen 2.476 N/A SER 349.A N ASN 345.A O no hydrogen 3.356 N/A ASP 350.A N ALA 346.A O no hydrogen 2.889 N/A TYR 351.A N ALA 347.A O no hydrogen 2.922 N/A ASP 352.A N ILE 348.A O no hydrogen 2.900 N/A TYR 353.A N ASP 350.A O no hydrogen 3.061 N/A TYR 354.A N TYR 351.A O no hydrogen 3.221 N/A ARG 355.A N ASP 352.A O no hydrogen 3.268 N/A ARG 355.A NH1 ASP 352.A O no hydrogen 2.618 N/A TYR 356.A N TYR 353.A O no hydrogen 3.264 N/A ASN 357.A N TYR 354.A O no hydrogen 3.092 N/A ASN 357.A ND2 MET 524.A O no hydrogen 3.594 N/A THR 360.A OG1 LEU 358.A O no hydrogen 3.424 N/A THR 360.A OG1 ASN 689.A OD1 no hydrogen 2.573 N/A MET 361.A N THR 149.A OG1 no hydrogen 3.051 N/A ARG 365.A NE ASP 138.A OD1 no hydrogen 2.957 N/A ARG 365.A NE ASP 138.A OD2 no hydrogen 3.165 N/A ARG 365.A NH1 GLN 195.A OE1 no hydrogen 3.056 N/A ARG 365.A NH2 GLN 195.A OE1 no hydrogen 2.620 N/A GLN 366.A NE2 TYR 686.A OH no hydrogen 2.607 N/A LEU 367.A N ASP 363.A O no hydrogen 2.849 N/A LEU 368.A N ILE 364.A O no hydrogen 2.889 N/A PHE 369.A N ARG 365.A O no hydrogen 2.999 N/A VAL 370.A N GLN 366.A O no hydrogen 2.879 N/A VAL 371.A N LEU 367.A O no hydrogen 2.873 N/A GLU 372.A N LEU 368.A O no hydrogen 2.994 N/A VAL 373.A N PHE 369.A O no hydrogen 2.939 N/A VAL 374.A N VAL 370.A O no hydrogen 2.842 N/A ASP 375.A N VAL 371.A O no hydrogen 2.930 N/A LYS 376.A N VAL 373.A O no hydrogen 3.039 N/A LYS 376.A NZ ASN 641.A OD1 no hydrogen 2.548 N/A TYR 377.A N VAL 374.A O no hydrogen 2.961 N/A PHE 378.A N ASP 375.A O no hydrogen 3.188 N/A ASP 379.A N LYS 376.A O no hydrogen 3.452 N/A ASP 382.A N SER 476.A OG no hydrogen 3.231 N/A CYS 385.A SG HIS 540.A ND1 no hydrogen 3.464 N/A ILE 386.A N GLN 468.A O no hydrogen 3.420 N/A ASN 387.A ND2 GLN 390.A OE1 no hydrogen 3.594 N/A ALA 388.A N ASP 423.A OD1 no hydrogen 3.086 N/A GLN 390.A N ASN 387.A O no hydrogen 3.263 N/A ILE 392.A N GLN 471.A OE1 no hydrogen 3.097 N/A LYS 406.A N PRO 403.A O no hydrogen 3.228 N/A TRP 407.A N PHE 404.A O no hydrogen 3.517 N/A ALA 410.A N LYS 398.A O no hydrogen 3.343 N/A TYR 413.A OH PHE 404.A O no hydrogen 3.314 N/A TYR 414.A N ALA 410.A O no hydrogen 2.928 N/A ASP 415.A N ARG 411.A O no hydrogen 2.900 N/A SER 416.A N LEU 412.A O no hydrogen 2.899 N/A SER 416.A OG LEU 412.A O no hydrogen 3.199 N/A SER 416.A OG TYR 413.A O no hydrogen 2.990 N/A MET 417.A N TYR 413.A O no hydrogen 2.876 N/A SER 418.A OG ASP 421.A OD2 no hydrogen 3.247 N/A GLN 422.A N SER 418.A O no hydrogen 2.830 N/A GLN 422.A NE2 MET 417.A O no hydrogen 2.862 N/A ASP 423.A N TYR 419.A O no hydrogen 2.927 N/A ALA 424.A N GLU 420.A O no hydrogen 2.877 N/A LEU 425.A N ASP 421.A O no hydrogen 2.907 N/A PHE 426.A N GLN 422.A O no hydrogen 2.918 N/A ALA 427.A N ASP 423.A O no hydrogen 2.900 N/A TYR 428.A N ALA 424.A O no hydrogen 2.864 N/A THR 429.A N LEU 425.A O no hydrogen 2.952 N/A THR 429.A OG1 LEU 425.A O no hydrogen 3.512 N/A THR 429.A OG1 PHE 426.A O no hydrogen 2.567 N/A ARG 431.A N TYR 428.A O no hydrogen 2.966 N/A ARG 431.A NE ASP 261.A OD1 no hydrogen 3.130 N/A ARG 431.A NE ASP 261.A OD2 no hydrogen 3.385 N/A ARG 431.A NH2 ASP 261.A OD1 no hydrogen 3.497 N/A ASN 432.A N TYR 428.A O no hydrogen 2.946 N/A VAL 433.A N ASN 259.A OD1 no hydrogen 3.224 N/A ILE 434.A N ASN 555.A OD1 no hydrogen 3.043 N/A THR 438.A N MET 564.A O no hydrogen 2.825 N/A THR 438.A OG1 GLU 563.A OE1 no hydrogen 2.320 N/A GLN 439.A N GLY 457.A O no hydrogen 2.932 N/A ASN 441.A N VAL 455.A O no hydrogen 2.921 N/A LYS 443.A N ARG 453.A O no hydrogen 2.689 N/A TYR 444.A OH LYS 309.A O no hydrogen 3.140 N/A SER 447.A N PHE 338.A O no hydrogen 3.254 N/A SER 447.A OG LYS 449.A O no hydrogen 2.511 N/A LYS 449.A N SER 447.A OG no hydrogen 2.831 N/A THR 454.A OG1 ASP 350.A OD2 no hydrogen 2.598 N/A VAL 455.A N ASN 441.A O no hydrogen 2.890 N/A SER 462.A OG GLN 559.A OE1 no hydrogen 3.059 N/A THR 463.A N SER 459.A O no hydrogen 3.271 N/A THR 463.A OG1 SER 459.A O no hydrogen 3.250 N/A MET 464.A N ILE 460.A O no hydrogen 2.898 N/A THR 465.A N CYS 461.A O no hydrogen 2.986 N/A THR 465.A OG1 CYS 461.A O no hydrogen 3.146 N/A THR 465.A OG1 SER 462.A O no hydrogen 3.201 N/A ASN 466.A N SER 462.A O no hydrogen 2.894 N/A ASN 466.A ND2 SER 462.A O no hydrogen 3.078 N/A ASN 466.A ND2 SER 462.A OG no hydrogen 3.148 N/A ARG 467.A N THR 463.A O no hydrogen 2.882 N/A ARG 467.A NH1 TYR 414.A OH no hydrogen 2.598 N/A GLN 468.A N MET 464.A O no hydrogen 2.988 N/A PHE 469.A N THR 465.A O no hydrogen 2.932 N/A HIS 470.A N ASN 466.A O no hydrogen 2.895 N/A HIS 470.A N ARG 467.A O no hydrogen 3.240 N/A HIS 470.A NE2 GLU 556.A OE2 no hydrogen 3.000 N/A GLN 471.A N ARG 467.A O no hydrogen 2.888 N/A LEU 474.A N HIS 470.A O no hydrogen 2.941 N/A LYS 475.A N GLN 471.A O no hydrogen 2.873 N/A SER 476.A N LYS 472.A O no hydrogen 2.935 N/A SER 476.A OG ASP 382.A OD1 no hydrogen 2.959 N/A ILE 477.A N LEU 473.A O no hydrogen 2.897 N/A ALA 478.A N LEU 474.A O no hydrogen 2.931 N/A ALA 479.A N SER 476.A O no hydrogen 3.366 N/A THR 480.A OG1 SER 476.A O no hydrogen 2.776 N/A ARG 481.A NH1 ALA 478.A O no hydrogen 3.329 N/A ARG 481.A NH1 THR 480.A O no hydrogen 3.357 N/A VAL 486.A N ILE 655.A O no hydrogen 3.050 N/A THR 489.A N VAL 486.A O no hydrogen 3.301 N/A THR 489.A OG1 VAL 486.A O no hydrogen 3.394 N/A LYS 491.A NZ GLN 713.A OE1 no hydrogen 3.113 N/A LYS 491.A NZ ASP 763.A OD2 no hydrogen 2.694 N/A PHE 492.A N SER 490.A OG no hydrogen 3.367 N/A TYR 493.A N MET 809.A O no hydrogen 3.016 N/A GLY 495.A N PHE 492.A O no hydrogen 2.960 N/A TRP 496.A N LYS 491.A O no hydrogen 3.385 N/A TRP 496.A NE1 THR 715.A OG1 no hydrogen 2.748 N/A ASN 498.A N GLY 494.A O no hydrogen 3.039 N/A MET 499.A N GLY 495.A O no hydrogen 2.903 N/A LEU 500.A N TRP 496.A O no hydrogen 2.953 N/A LYS 501.A N HIS 497.A O no hydrogen 2.902 N/A THR 502.A N ASN 498.A O no hydrogen 2.907 N/A THR 502.A OG1 ASN 498.A O no hydrogen 2.712 N/A VAL 503.A N MET 499.A O no hydrogen 2.949 N/A TYR 504.A N LEU 500.A O no hydrogen 3.000 N/A SER 505.A N THR 502.A O no hydrogen 3.337 N/A SER 505.A OG THR 502.A O no hydrogen 3.187 N/A SER 505.A OG SER 505.A O no hydrogen 2.582 N/A HIS 511.A N PHE 664.A O no hydrogen 2.925 N/A HIS 511.A ND1 PRO 510.A O no hydrogen 2.851 N/A LEU 512.A N GLU 700.A O no hydrogen 2.929 N/A MET 513.A N VAL 662.A O no hydrogen 2.859 N/A GLY 514.A N TRP 698.A O no hydrogen 2.916 N/A TYR 517.A OH ASN 593.A OD1 no hydrogen 2.488 N/A CYS 520.A SG ASP 658.A OD1 no hydrogen 3.191 N/A ARG 522.A N LYS 519.A O no hydrogen 3.271 N/A ARG 522.A NE ASP 521.A OD2 no hydrogen 3.022 N/A ARG 522.A NH1 ASP 350.A O no hydrogen 2.677 N/A ARG 522.A NH2 ASP 350.A OD2 no hydrogen 2.772 N/A ALA 523.A N LYS 519.A O no hydrogen 2.829 N/A ASN 526.A ND2 PRO 575.A O no hydrogen 3.662 N/A ARG 529.A N PRO 525.A O no hydrogen 3.381 N/A ARG 529.A NH1 ARG 529.A O no hydrogen 3.564 N/A ILE 530.A N ASN 526.A O no hydrogen 2.922 N/A MET 531.A N MET 527.A O no hydrogen 2.875 N/A ALA 532.A N LEU 528.A O no hydrogen 2.901 N/A SER 533.A N ARG 529.A O no hydrogen 2.940 N/A SER 533.A OG GLU 556.A OE2 no hydrogen 3.124 N/A LEU 534.A N ILE 530.A O no hydrogen 2.901 N/A VAL 535.A N MET 531.A O no hydrogen 2.883 N/A LEU 536.A N ALA 532.A O no hydrogen 2.935 N/A ALA 537.A N SER 533.A O no hydrogen 2.901 N/A ALA 537.A N LEU 534.A O no hydrogen 3.170 N/A ARG 538.A N VAL 535.A O no hydrogen 3.193 N/A ARG 538.A NH1 GLU 372.A OE2 no hydrogen 3.539 N/A LYS 539.A NZ PHE 378.A O no hydrogen 2.459 N/A LYS 539.A NZ TYR 381.A O no hydrogen 2.504 N/A HIS 540.A N ALA 537.A O no hydrogen 3.399 N/A CYS 543.A SG HIS 540.A ND1 no hydrogen 3.179 N/A CYS 544.A N HIS 540.A O no hydrogen 3.341 N/A ARG 549.A N SER 545.A O no hydrogen 3.190 N/A PHE 550.A N LEU 546.A O no hydrogen 2.921 N/A TYR 551.A N SER 547.A O no hydrogen 2.903 N/A TYR 551.A OH HIS 258.A O no hydrogen 2.727 N/A ARG 552.A N HIS 548.A O no hydrogen 2.921 N/A ARG 552.A NH1 THR 429.A OG1 no hydrogen 3.078 N/A LEU 553.A N ARG 549.A O no hydrogen 2.930 N/A ALA 554.A N PHE 550.A O no hydrogen 2.877 N/A ASN 555.A N TYR 551.A O no hydrogen 2.883 N/A ASN 555.A ND2 ASN 432.A O no hydrogen 2.750 N/A ASN 555.A ND2 TYR 551.A O no hydrogen 2.802 N/A GLU 556.A N ARG 552.A O no hydrogen 2.946 N/A CYS 557.A N LEU 553.A O no hydrogen 2.901 N/A CYS 557.A SG LEU 553.A O no hydrogen 3.684 N/A ALA 558.A N ALA 554.A O no hydrogen 2.890 N/A GLN 559.A N ASN 555.A O no hydrogen 2.912 N/A GLN 559.A NE2 ILE 434.A O no hydrogen 2.767 N/A SER 562.A N CYS 557.A O no hydrogen 2.916 N/A VAL 565.A N TYR 572.A O no hydrogen 2.863 N/A MET 566.A N THR 438.A O no hydrogen 2.931 N/A CYS 567.A N SER 570.A O no hydrogen 2.896 N/A SER 570.A N CYS 567.A O no hydrogen 2.914 N/A LEU 571.A N ALA 297.A O no hydrogen 2.902 N/A TYR 572.A N VAL 565.A O no hydrogen 2.909 N/A VAL 573.A N PHE 294.A O no hydrogen 3.453 N/A LYS 574.A N GLU 563.A O no hydrogen 3.260 N/A LYS 574.A NZ VAL 560.A O no hydrogen 3.069 N/A LYS 574.A NZ GLU 563.A OE1 no hydrogen 3.549 N/A THR 578.A N ASP 521.A O no hydrogen 3.369 N/A SER 579.A OG GLU 563.A OE1 no hydrogen 3.102 N/A SER 579.A OG GLU 563.A OE2 no hydrogen 2.320 N/A ASP 582.A N SER 579.A O no hydrogen 3.094 N/A THR 585.A OG1 SER 579.A O no hydrogen 2.990 N/A THR 585.A OG1 ASP 582.A O no hydrogen 3.256 N/A ALA 588.A N THR 584.A O no hydrogen 3.185 N/A ASN 589.A N THR 585.A O no hydrogen 2.921 N/A SER 590.A N ALA 586.A O no hydrogen 2.882 N/A SER 590.A OG ALA 586.A O no hydrogen 2.725 N/A VAL 591.A N TYR 587.A O no hydrogen 2.952 N/A PHE 592.A N ALA 588.A O no hydrogen 2.922 N/A ASN 593.A N ASN 589.A O no hydrogen 2.886 N/A ILE 594.A N SER 590.A O no hydrogen 2.950 N/A CYS 595.A N VAL 591.A O no hydrogen 2.898 N/A GLN 596.A N PHE 592.A O no hydrogen 2.922 N/A GLN 596.A NE2 GLN 687.A OE1 no hydrogen 2.739 N/A ALA 597.A N ASN 593.A O no hydrogen 2.961 N/A VAL 598.A N ILE 594.A O no hydrogen 2.914 N/A THR 599.A N CYS 595.A O no hydrogen 2.886 N/A THR 599.A OG1 CYS 595.A O no hydrogen 2.730 N/A ALA 600.A N GLN 596.A O no hydrogen 2.908 N/A ASN 601.A N ALA 597.A O no hydrogen 2.944 N/A ASN 601.A ND2 ALA 597.A O no hydrogen 2.824 N/A VAL 602.A N VAL 598.A O no hydrogen 2.900 N/A ASN 603.A N THR 599.A O no hydrogen 2.904 N/A ASN 603.A ND2 TYR 686.A OH no hydrogen 3.117 N/A ALA 604.A N ALA 600.A O no hydrogen 2.892 N/A LEU 605.A N ASN 601.A O no hydrogen 2.932 N/A LEU 606.A N VAL 602.A O no hydrogen 2.915 N/A SER 607.A N ASN 603.A O no hydrogen 2.904 N/A SER 607.A OG ASN 603.A O no hydrogen 2.896 N/A SER 607.A OG ALA 604.A O no hydrogen 3.286 N/A THR 608.A OG1 ALA 604.A O no hydrogen 2.735 N/A THR 608.A OG1 LEU 605.A O no hydrogen 3.524 N/A THR 608.A OG1 GLY 672.A O no hydrogen 2.612 N/A LYS 612.A NZ GLN 671.A O no hydrogen 2.261 N/A ILE 613.A N GLY 610.A O no hydrogen 3.201 N/A TYR 617.A N ASP 615.A OD1 no hydrogen 3.316 N/A ARG 619.A N ASP 615.A O no hydrogen 3.163 N/A ARG 619.A NE GLY 610.A O no hydrogen 3.217 N/A ASN 620.A N LYS 616.A O no hydrogen 2.923 N/A LEU 621.A N TYR 617.A O no hydrogen 2.876 N/A GLN 622.A N VAL 618.A O no hydrogen 2.885 N/A GLN 622.A NE2 LEU 605.A O no hydrogen 3.001 N/A GLN 622.A NE2 LEU 606.A O no hydrogen 3.689 N/A GLN 622.A NE2 THR 608.A O no hydrogen 3.301 N/A HIS 623.A N ARG 619.A O no hydrogen 2.950 N/A HIS 623.A NE2 ASN 9.A O no hydrogen 2.535 N/A ARG 624.A N ASN 620.A O no hydrogen 2.908 N/A ARG 624.A NE ASN 620.A O no hydrogen 3.519 N/A LEU 625.A N LEU 621.A O no hydrogen 2.838 N/A TYR 626.A N GLN 622.A O no hydrogen 2.960 N/A TYR 626.A OH ASP 6.A OD2 no hydrogen 2.837 N/A GLU 627.A N HIS 623.A O no hydrogen 2.969 N/A CYS 628.A N ARG 624.A O no hydrogen 2.854 N/A CYS 628.A SG GLU 627.A OE2 no hydrogen 3.141 N/A CYS 628.A SG ASP 636.A OD2 no hydrogen 3.403 N/A LEU 629.A N TYR 626.A O no hydrogen 3.204 N/A TYR 630.A N TYR 626.A O no hydrogen 3.048 N/A TYR 630.A OH ASP 363.A OD2 no hydrogen 2.597 N/A ARG 633.A NH2 ASP 194.A OD1 no hydrogen 2.401 N/A ARG 633.A NH2 ASP 194.A OD2 no hydrogen 3.107 N/A VAL 640.A N ASP 636.A O no hydrogen 3.032 N/A ASN 641.A N THR 637.A O no hydrogen 2.910 N/A GLU 642.A N ASP 638.A O no hydrogen 2.945 N/A PHE 643.A N PHE 639.A O no hydrogen 2.867 N/A TYR 644.A N VAL 640.A O no hydrogen 2.910 N/A ALA 645.A N ASN 641.A O no hydrogen 2.918 N/A TYR 646.A N GLU 642.A O no hydrogen 2.899 N/A TYR 646.A OH LEU 673.A O no hydrogen 3.290 N/A LEU 647.A N PHE 643.A O no hydrogen 2.921 N/A ARG 648.A N TYR 644.A O no hydrogen 2.895 N/A LYS 649.A N ALA 645.A O no hydrogen 2.910 N/A HIS 650.A N TYR 646.A O no hydrogen 2.941 N/A PHE 651.A N LEU 647.A O no hydrogen 2.515 N/A SER 652.A N CYS 663.A O no hydrogen 2.913 N/A SER 652.A OG ARG 648.A O no hydrogen 3.378 N/A MET 654.A N VAL 661.A O no hydrogen 2.891 N/A ILE 655.A N THR 484.A O no hydrogen 3.090 N/A LEU 656.A N ASP 659.A O no hydrogen 2.898 N/A ASP 658.A N LEU 656.A O no hydrogen 2.412 N/A ASP 659.A N LEU 656.A O no hydrogen 2.980 N/A VAL 661.A N MET 654.A O no hydrogen 2.944 N/A VAL 662.A N MET 513.A O no hydrogen 2.908 N/A CYS 663.A N SER 652.A O no hydrogen 2.868 N/A PHE 664.A N HIS 511.A O no hydrogen 2.930 N/A ASN 665.A N HIS 650.A O no hydrogen 3.308 N/A ASN 665.A ND2 GLU 508.A OE1 no hydrogen 2.652 N/A ASN 665.A ND2 HIS 650.A ND1 no hydrogen 3.372 N/A SER 666.A N ASN 509.A O no hydrogen 2.587 N/A THR 667.A OG1 ASN 509.A OD1 no hydrogen 3.189 N/A ALA 669.A N ASN 665.A O no hydrogen 3.120 N/A SER 670.A N SER 666.A O no hydrogen 2.902 N/A GLN 671.A N THR 667.A O no hydrogen 2.921 N/A GLY 672.A N ALA 669.A O no hydrogen 3.047 N/A LEU 673.A N TYR 668.A O no hydrogen 2.733 N/A ALA 675.A N ASN 601.A OD1 no hydrogen 3.462 N/A SER 676.A N ASN 679.A OD1 no hydrogen 2.882 N/A LYS 678.A NZ ASN 679.A OD1 no hydrogen 3.431 N/A PHE 680.A N SER 676.A O no hydrogen 3.121 N/A LYS 681.A N ILE 677.A O no hydrogen 2.894 N/A LYS 681.A NZ ASP 38.A OD1 no hydrogen 2.520 N/A LYS 681.A NZ GLU 39.A OE1 no hydrogen 2.819 N/A SER 682.A N LYS 678.A O no hydrogen 2.935 N/A SER 682.A OG PHE 37.A O no hydrogen 3.068 N/A SER 682.A OG LYS 678.A O no hydrogen 2.988 N/A VAL 683.A N ASN 679.A O no hydrogen 2.917 N/A LEU 684.A N PHE 680.A O no hydrogen 2.894 N/A TYR 685.A N LYS 681.A O no hydrogen 2.922 N/A TYR 685.A OH TYR 66.A O no hydrogen 3.341 N/A TYR 685.A OH TYR 78.A OH no hydrogen 2.313 N/A TYR 686.A N SER 682.A O no hydrogen 2.981 N/A GLN 687.A N VAL 683.A O no hydrogen 2.815 N/A ASN 689.A ND2 TYR 685.A O no hydrogen 3.615 N/A VAL 690.A N LEU 684.A O no hydrogen 3.238 N/A LYS 696.A N SER 693.A O no hydrogen 3.382 N/A CYS 697.A SG SER 693.A O no hydrogen 3.298 N/A TRP 698.A N GLY 514.A O no hydrogen 2.912 N/A GLU 700.A N LEU 512.A O no hydrogen 2.872 N/A THR 704.A N ASP 702.A OD1 no hydrogen 3.386 N/A THR 704.A OG1 ASP 702.A OD1 no hydrogen 3.339 N/A LYS 705.A N ASP 702.A O no hydrogen 3.251 N/A PHE 710.A N GLN 713.A O no hydrogen 3.009 N/A CYS 711.A SG ASP 659.A OD2 no hydrogen 3.632 N/A GLN 713.A N PHE 710.A O no hydrogen 3.107 N/A GLN 713.A NE2 CYS 711.A O no hydrogen 3.635 N/A GLN 713.A NE2 SER 712.A O no hydrogen 2.921 N/A HIS 714.A N TYR 729.A O no hydrogen 2.908 N/A HIS 714.A NE2 ASP 731.A OD1 no hydrogen 2.986 N/A MET 716.A N LEU 727.A O no hydrogen 2.979 N/A VAL 718.A N VAL 725.A O no hydrogen 2.897 N/A GLN 720.A N ASP 723.A O no hydrogen 2.889 N/A ASP 723.A N GLN 720.A O no hydrogen 2.918 N/A VAL 725.A N VAL 718.A O no hydrogen 2.918 N/A TYR 726.A N HIS 497.A ND1 no hydrogen 3.310 N/A TYR 726.A OH LEU 703.A O no hydrogen 3.214 N/A LEU 727.A N MET 716.A O no hydrogen 2.863 N/A TYR 729.A N HIS 714.A O no hydrogen 2.868 N/A SER 733.A OG HIS 337.A ND1 no hydrogen 3.069 N/A ARG 734.A NH1 ARG 734.A O no hydrogen 3.261 N/A ILE 735.A N ASP 731.A O no hydrogen 3.234 N/A LEU 736.A N PRO 732.A O no hydrogen 2.920 N/A GLY 737.A N SER 733.A O no hydrogen 2.863 N/A ALA 738.A N ARG 734.A O no hydrogen 2.913 N/A GLY 739.A N ILE 735.A O no hydrogen 2.948 N/A CYS 740.A N LEU 736.A O no hydrogen 2.877 N/A CYS 740.A SG LEU 736.A O no hydrogen 3.204 N/A PHE 741.A N GLY 737.A O no hydrogen 2.979 N/A LYS 747.A N ASP 744.A O no hydrogen 3.149 N/A THR 748.A N ILE 745.A O no hydrogen 2.935 N/A ILE 754.A N THR 751.A O no hydrogen 2.951 N/A ARG 756.A N LEU 752.A O no hydrogen 3.051 N/A ARG 756.A NH1 ALA 738.A O no hydrogen 2.536 N/A ARG 756.A NH2 ALA 738.A O no hydrogen 3.168 N/A PHE 757.A N MET 753.A O no hydrogen 2.960 N/A VAL 758.A N ILE 754.A O no hydrogen 2.788 N/A SER 759.A N GLU 755.A O no hydrogen 2.968 N/A SER 759.A OG GLU 755.A O no hydrogen 3.357 N/A LEU 760.A N ARG 756.A O no hydrogen 3.043 N/A ALA 761.A N PHE 757.A O no hydrogen 2.553 N/A ILE 762.A N VAL 758.A O no hydrogen 2.748 N/A ILE 762.A N SER 759.A O no hydrogen 2.965 N/A ASP 763.A N SER 759.A O no hydrogen 2.997 N/A ASP 763.A N LEU 760.A O no hydrogen 2.944 N/A ALA 764.A N LEU 760.A O no hydrogen 2.920 N/A THR 768.A N TYR 765.A O no hydrogen 3.082 N/A THR 768.A OG1 TYR 765.A O no hydrogen 2.812 N/A LYS 769.A N PRO 766.A O no hydrogen 2.893 N/A HIS 770.A N LEU 767.A O no hydrogen 3.104 N/A HIS 770.A NE2 TYR 729.A OH no hydrogen 3.060 N/A ASN 772.A N HIS 770.A ND1 no hydrogen 3.424 N/A ASN 772.A ND2 SER 332.A OG no hydrogen 3.146 N/A GLN 773.A NE2 ASP 777.A OD1 no hydrogen 3.306 N/A GLN 773.A NE2 ASP 777.A OD2 no hydrogen 2.825 N/A ALA 776.A N ASN 772.A O no hydrogen 3.476 N/A ASP 777.A N GLN 773.A O no hydrogen 2.897 N/A VAL 778.A N GLU 774.A O no hydrogen 2.978 N/A VAL 778.A N TYR 775.A O no hydrogen 3.140 N/A LEU 781.A N ASP 777.A O no hydrogen 2.866 N/A TYR 782.A N VAL 778.A O no hydrogen 2.984 N/A TYR 782.A OH ILE 735.A O no hydrogen 2.440 N/A LEU 783.A N PHE 779.A O no hydrogen 2.913 N/A GLN 784.A N HIS 780.A O no hydrogen 2.897 N/A TYR 785.A N LEU 781.A O no hydrogen 2.894 N/A ILE 786.A N TYR 782.A O no hydrogen 2.916 N/A ARG 787.A N LEU 783.A O no hydrogen 2.943 N/A LYS 788.A N GLN 784.A O no hydrogen 2.934 N/A LYS 788.A NZ GLU 792.A OE2 no hydrogen 3.183 N/A LEU 789.A N TYR 785.A O no hydrogen 2.879 N/A HIS 790.A N ILE 786.A O no hydrogen 2.938 N/A ASP 791.A N ARG 787.A O no hydrogen 2.924 N/A GLU 792.A N LYS 788.A O no hydrogen 2.877 N/A LEU 793.A N LEU 789.A O no hydrogen 2.882 N/A THR 794.A N HIS 790.A O no hydrogen 3.023 N/A THR 794.A OG1 HIS 790.A O no hydrogen 2.342 N/A SER 798.A N ASP 795.A O no hydrogen 3.278 N/A ARG 799.A N ASN 796.A O no hydrogen 3.480 N/A TYR 800.A N THR 797.A O no hydrogen 2.921 N/A TYR 806.A OH TYR 800.A O no hydrogen 2.309 N/A GLU 807.A N PRO 803.A O no hydrogen 2.882 N/A ALA 808.A N GLU 804.A O no hydrogen 2.930 N/A TYR 810.A N GLU 807.A O no hydrogen 3.360 N/A TYR 810.A OH ILE 762.A O no hydrogen 3.006 N/A THR 811.A OG1 ALA 808.A O no hydrogen 3.037 N/A