Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8qat_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N GLU 3.A OE2 no hydrogen 2.632 N/A THR 4.A OG1 ASP 1.A OD1 no hydrogen 2.446 N/A CYS 5.A SG ASP 1.A O no hydrogen 3.562 N/A LEU 6.A N GLU 3.A O no hydrogen 3.079 N/A MET 7.A N GLU 3.A O no hydrogen 3.412 N/A VAL 8.A N THR 4.A O no hydrogen 3.109 N/A PHE 9.A N CYS 5.A O no hydrogen 2.919 N/A LYS 10.A N LEU 6.A O no hydrogen 2.956 N/A ASN 11.A N MET 7.A O no hydrogen 2.987 N/A HIS 12.A N VAL 8.A O no hydrogen 3.049 N/A TRP 13.A N PHE 9.A O no hydrogen 2.893 N/A TRP 13.A NE1 GLU 64.A OE2 no hydrogen 2.783 N/A SER 14.A N LYS 10.A O no hydrogen 2.828 N/A SER 14.A OG LYS 10.A O no hydrogen 2.961 N/A SER 14.A OG ASN 11.A O no hydrogen 2.684 N/A GLN 15.A N ASN 11.A O no hydrogen 3.160 N/A VAL 16.A N HIS 12.A O no hydrogen 2.921 N/A VAL 17.A N TRP 13.A O no hydrogen 2.896 N/A ARG 18.A N SER 14.A O no hydrogen 3.071 N/A ARG 18.A NH1 GLN 15.A OE1 no hydrogen 2.398 N/A ARG 18.A NH2 GLN 15.A OE1 no hydrogen 3.261 N/A ILE 19.A N GLN 15.A O no hydrogen 2.976 N/A LEU 20.A N VAL 16.A O no hydrogen 2.917 N/A GLU 21.A N VAL 17.A O no hydrogen 2.910 N/A ARG 22.A N ARG 18.A O no hydrogen 2.983 N/A LEU 27.A N GLY 23.A O no hydrogen 2.881 N/A SER 28.A N ALA 24.A O no hydrogen 2.900 N/A SER 28.A OG ALA 24.A O no hydrogen 2.790 N/A ALA 29.A N ASP 25.A O no hydrogen 2.915 N/A VAL 30.A N ASP 26.A O no hydrogen 2.899 N/A ARG 31.A N LEU 27.A O no hydrogen 2.871 N/A ASN 32.A N SER 28.A O no hydrogen 3.001 N/A HIS 33.A N ALA 29.A O no hydrogen 2.963 N/A THR 34.A N VAL 30.A O no hydrogen 2.773 N/A THR 34.A OG1 VAL 30.A O no hydrogen 2.192 N/A TYR 35.A N ARG 31.A O no hydrogen 2.891 N/A GLN 36.A N ASN 32.A O no hydrogen 2.966 N/A MET 37.A N HIS 33.A O no hydrogen 2.869 N/A LEU 38.A N THR 34.A O no hydrogen 2.934 N/A THR 39.A N TYR 35.A O no hydrogen 2.933 N/A THR 39.A OG1 TYR 35.A O no hydrogen 2.609 N/A THR 39.A OG1 GLN 36.A O no hydrogen 2.870 N/A LEU 40.A N GLN 36.A O no hydrogen 2.944 N/A LEU 41.A N MET 37.A O no hydrogen 2.848 N/A ALA 42.A N LEU 38.A O no hydrogen 2.957 N/A GLU 43.A N LEU 40.A O no hydrogen 3.195 N/A ASP 44.A N LEU 41.A O no hydrogen 3.368 N/A ARG 45.A NH1 ASP 44.A O no hydrogen 2.936 N/A GLY 53.A N ALA 50.A O no hydrogen 3.329 N/A LEU 57.A N ASP 44.A OD1 no hydrogen 3.227 N/A GLU 59.A N GLY 55.A O no hydrogen 2.871 N/A PHE 60.A N PRO 56.A O no hydrogen 2.919 N/A ALA 61.A N LEU 57.A O no hydrogen 2.920 N/A LEU 62.A N LEU 58.A O no hydrogen 2.862 N/A LEU 66.A N ALA 61.A O no hydrogen 3.086 N/A THR 68.A OG1 ASP 65.A OD1 no hydrogen 2.667 N/A THR 68.A OG1 ASP 65.A OD2 no hydrogen 3.297 N/A ARG 69.A N ASP 65.A O no hydrogen 3.323 N/A VAL 70.A N LEU 66.A O no hydrogen 2.979 N/A LEU 71.A N LEU 67.A O no hydrogen 2.908 N/A THR 72.A N THR 68.A O no hydrogen 2.874 N/A TRP 73.A N ARG 69.A O no hydrogen 2.915 N/A GLN 74.A N VAL 70.A O no hydrogen 3.028 N/A LEU 75.A N LEU 71.A O no hydrogen 2.862 N/A GLN 76.A N THR 72.A O no hydrogen 2.948 N/A ASP 78.A N LEU 75.A O no hydrogen 3.305 N/A LEU 80.A N TRP 77.A O no hydrogen 3.296 N/A GLY 81.A N ASP 78.A O no hydrogen 3.351 N/A ARG 87.A N GLY 83.A O no hydrogen 3.039 N/A ARG 87.A NE ASP 82.A O no hydrogen 3.333 N/A ARG 87.A NH2 TRP 77.A O no hydrogen 3.231 N/A ARG 87.A NH2 ASP 82.A O no hydrogen 3.210 N/A ARG 88.A N VAL 84.A O no hydrogen 2.964 N/A GLU 90.A N GLU 86.A O no hydrogen 2.932 N/A GLN 91.A N ARG 87.A O no hydrogen 2.994 N/A GLN 91.A NE2 GLN 74.A OE1 no hydrogen 3.071 N/A LEU 92.A N ARG 88.A O no hydrogen 2.931 N/A LYS 93.A N ALA 89.A O no hydrogen 2.901 N/A LYS 93.A NZ TYR 35.A OH no hydrogen 3.277 N/A LEU 94.A N GLU 90.A O no hydrogen 2.969 N/A PHE 95.A N GLN 91.A O no hydrogen 2.941 N/A GLU 96.A N LEU 92.A O no hydrogen 2.929 N/A MET 97.A N LYS 93.A O no hydrogen 2.915 N/A LEU 98.A N LEU 94.A O no hydrogen 3.024 N/A VAL 99.A N PHE 95.A O no hydrogen 2.954 N/A SER 100.A N GLU 96.A O no hydrogen 2.905 N/A SER 100.A OG GLU 96.A O no hydrogen 2.834 N/A GLU 101.A N MET 97.A O no hydrogen 2.867 N/A HIS 109.A N LEU 106.A O no hydrogen 3.245 N/A ARG 113.A NH2 LEU 107.A O no hydrogen 2.925 N/A GLU 114.A N GLY 110.A O no hydrogen 2.917 N/A ALA 115.A N PRO 111.A O no hydrogen 2.893 N/A LEU 116.A N VAL 112.A O no hydrogen 2.925 N/A LEU 117.A N ARG 113.A O no hydrogen 2.900 N/A THR 118.A N GLU 114.A O no hydrogen 2.902 N/A THR 118.A OG1 GLU 114.A O no hydrogen 2.593 N/A LEU 119.A N ALA 115.A O no hydrogen 2.910 N/A LEU 120.A N LEU 116.A O no hydrogen 2.921 N/A ASP 121.A N LEU 117.A O no hydrogen 3.230 N/A ALA 122.A N THR 118.A O no hydrogen 2.903 N/A CYS 123.A N LEU 119.A O no hydrogen 2.911 N/A CYS 123.A SG LEU 119.A O no hydrogen 3.354 N/A GLY 124.A N ASP 121.A O no hydrogen 3.298 N/A ARG 125.A NE ASP 121.A O no hydrogen 3.638 N/A SER 129.A OG ASP 134.A OD1 no hydrogen 3.100 N/A SER 129.A OG ASP 134.A OD2 no hydrogen 3.119 N/A SER 130.A N GLU 85.A OE1 no hydrogen 2.887 N/A SER 130.A OG GLU 85.A OE1 no hydrogen 2.781 N/A LEU 133.A N SER 130.A O no hydrogen 3.133 N/A ASP 134.A N SER 130.A O no hydrogen 3.362 N/A GLU 135.A N PRO 131.A O no hydrogen 2.909 N/A GLY 136.A N ALA 132.A O no hydrogen 2.914 N/A LEU 137.A N LEU 133.A O no hydrogen 2.892 N/A VAL 138.A N ASP 134.A O no hydrogen 2.928 N/A LEU 139.A N GLU 135.A O no hydrogen 2.925 N/A LEU 140.A N GLY 136.A O no hydrogen 2.888 N/A LEU 141.A N LEU 137.A O no hydrogen 2.925 N/A SER 142.A N VAL 138.A O no hydrogen 2.864 N/A GLN 143.A N LEU 139.A O no hydrogen 2.961 N/A LEU 144.A N LEU 140.A O no hydrogen 2.925 N/A CYS 145.A N LEU 141.A O no hydrogen 2.850 N/A CYS 145.A SG LEU 141.A O no hydrogen 3.153 N/A CYS 145.A SG ALA 194.A O no hydrogen 3.460 N/A VAL 146.A N SER 142.A O no hydrogen 2.927 N/A CYS 147.A N GLN 143.A O no hydrogen 2.974 N/A CYS 147.A SG VAL 99.A O no hydrogen 3.773 N/A CYS 147.A SG GLN 143.A O no hydrogen 3.597 N/A VAL 148.A N LEU 144.A O no hydrogen 2.904 N/A ALA 149.A N CYS 145.A O no hydrogen 2.848 N/A GLN 150.A N VAL 146.A O no hydrogen 2.956 N/A GLU 151.A N CYS 147.A O no hydrogen 3.116 N/A GLU 156.A N GLU 156.A OE1 no hydrogen 2.815 N/A PHE 158.A N LEU 154.A O no hydrogen 2.934 N/A LEU 159.A N LEU 155.A O no hydrogen 3.201 N/A LEU 159.A N GLU 156.A O no hydrogen 3.154 N/A ALA 167.A N GLU 164.A O no hydrogen 3.057 N/A ARG 170.A NE GLN 160.A OE1 no hydrogen 3.178 N/A ARG 170.A NH1 ASP 121.A OD1 no hydrogen 2.686 N/A ARG 170.A NH1 ASP 121.A OD2 no hydrogen 3.174 N/A ARG 170.A NH2 ASP 121.A OD2 no hydrogen 2.403 N/A PHE 174.A N LEU 171.A O no hydrogen 3.312 N/A SER 175.A N LEU 171.A O no hydrogen 3.076 N/A LEU 177.A N PHE 174.A O no hydrogen 3.209 N/A PHE 180.A N LEU 177.A O no hydrogen 3.364 N/A GLN 189.A N GLY 185.A O no hydrogen 3.429 N/A GLN 190.A N THR 186.A O no hydrogen 2.890 N/A ALA 191.A N LEU 187.A O no hydrogen 2.959 N/A ARG 192.A N GLY 188.A O no hydrogen 2.911 N/A ARG 192.A NH1 VAL 181.A O no hydrogen 2.654 N/A ARG 192.A NH1 LEU 183.A O no hydrogen 3.131 N/A ARG 192.A NH2 GLN 189.A OE1 no hydrogen 3.071 N/A ASP 193.A N GLN 189.A O no hydrogen 2.939 N/A ALA 194.A N GLN 190.A O no hydrogen 2.940 N/A LEU 195.A N ALA 191.A O no hydrogen 2.913 N/A LEU 196.A N ARG 192.A O no hydrogen 2.905 N/A LEU 197.A N ASP 193.A O no hydrogen 2.933 N/A LEU 198.A N ALA 194.A O no hydrogen 2.970 N/A MET 199.A N LEU 195.A O no hydrogen 2.892 N/A ALA 200.A N LEU 196.A O no hydrogen 2.924 N/A LEU 201.A N LEU 197.A O no hydrogen 2.982 N/A SER 202.A N LEU 198.A O no hydrogen 2.859 N/A ALA 203.A N ALA 200.A O no hydrogen 3.349 N/A GLY 204.A N LEU 201.A O no hydrogen 3.381 N/A SER 205.A OG GLU 156.A OE2 no hydrogen 2.695 N/A THR 207.A OG1 SER 205.A OG no hydrogen 3.310 N/A GLY 209.A N SER 205.A O no hydrogen 3.349 N/A ARG 210.A N PRO 206.A O no hydrogen 3.154 N/A TYR 211.A N THR 207.A O no hydrogen 3.102 N/A TYR 211.A OH PRO 169.A O no hydrogen 3.355 N/A ILE 212.A N VAL 208.A O no hydrogen 2.926 N/A ALA 213.A N GLY 209.A O no hydrogen 2.904 N/A HIS 215.A N TYR 211.A O no hydrogen 2.714 N/A VAL 221.A N TYR 217.A O no hydrogen 3.275 N/A LEU 222.A N PHE 218.A O no hydrogen 2.946 N/A ALA 223.A N CYS 219.A O no hydrogen 2.934 N/A THR 224.A N PRO 220.A O no hydrogen 2.871 N/A THR 224.A OG1 PRO 220.A O no hydrogen 2.557 N/A THR 224.A OG1 VAL 221.A O no hydrogen 3.120 N/A GLY 225.A N VAL 221.A O no hydrogen 2.883 N/A LEU 226.A N LEU 222.A O no hydrogen 2.977 N/A SER 227.A N ALA 223.A O no hydrogen 2.913 N/A ALA 228.A N THR 224.A O no hydrogen 2.845 N/A LEU 229.A N GLY 225.A O no hydrogen 2.913 N/A TYR 230.A N LEU 226.A O no hydrogen 2.927 N/A SER 231.A OG SER 227.A O no hydrogen 3.561 N/A SER 231.A OG TYR 230.A O no hydrogen 2.997 N/A ARG 235.A NH1 GLU 307.A OE2 no hydrogen 2.928 N/A ILE 237.A N GLU 306.A OE2 no hydrogen 3.151 N/A TRP 244.A NE1 ASP 251.A OD2 no hydrogen 2.803 N/A HIS 245.A ND1 SER 365.A OG no hydrogen 3.085 N/A ARG 248.A N ASP 251.A OD2 no hydrogen 2.884 N/A ARG 248.A NE ASP 251.A OD2 no hydrogen 2.851 N/A ARG 248.A NH2 ASP 251.A OD2 no hydrogen 3.382 N/A ASP 251.A N ARG 248.A O no hydrogen 3.102 N/A TRP 252.A N ARG 248.A O no hydrogen 3.252 N/A GLY 254.A N ASP 251.A O no hydrogen 3.069 N/A LEU 258.A N VAL 255.A O no hydrogen 3.189 N/A ALA 259.A N VAL 255.A O no hydrogen 3.240 N/A MET 262.A N LEU 258.A O no hydrogen 2.926 N/A SER 263.A N ALA 259.A O no hydrogen 2.907 N/A SER 264.A N LEU 260.A O no hydrogen 2.956 N/A LEU 265.A N PHE 261.A O no hydrogen 2.869 N/A GLU 266.A N MET 262.A O no hydrogen 2.914 N/A PHE 267.A N SER 263.A O no hydrogen 2.939 N/A CYS 268.A N SER 264.A O no hydrogen 2.923 N/A CYS 268.A SG SER 264.A O no hydrogen 3.251 N/A ASN 269.A N LEU 265.A O no hydrogen 2.871 N/A ASN 269.A ND2 SER 323.A OG no hydrogen 2.753 N/A ASN 269.A ND2 GLU 324.A OE2 no hydrogen 3.546 N/A ALA 270.A N GLU 266.A O no hydrogen 2.937 N/A VAL 271.A N PHE 267.A O no hydrogen 2.935 N/A ILE 272.A N CYS 268.A O no hydrogen 2.928 N/A GLN 273.A N ASN 269.A O no hydrogen 2.911 N/A VAL 274.A N ALA 270.A O no hydrogen 2.952 N/A VAL 274.A N VAL 271.A O no hydrogen 3.230 N/A ALA 275.A N VAL 271.A O no hydrogen 2.972 N/A LEU 278.A N HIS 276.A ND1 no hydrogen 3.089 N/A GLN 280.A N HIS 276.A O no hydrogen 2.631 N/A GLN 280.A NE2 ALA 275.A O no hydrogen 2.640 N/A LYS 281.A N PRO 277.A O no hydrogen 2.906 N/A GLN 282.A N LEU 278.A O no hydrogen 2.963 N/A GLN 282.A NE2 ALA 213.A O no hydrogen 2.618 N/A LEU 283.A N VAL 279.A O no hydrogen 2.906 N/A VAL 284.A N GLN 280.A O no hydrogen 2.882 N/A ASP 285.A N LYS 281.A O no hydrogen 2.924 N/A TYR 286.A N GLN 282.A O no hydrogen 2.899 N/A ILE 287.A N LEU 283.A O no hydrogen 2.858 N/A HIS 288.A N VAL 284.A O no hydrogen 3.009 N/A HIS 288.A ND1 ASN 289.A OD1 no hydrogen 2.718 N/A ASN 289.A N ASP 285.A O no hydrogen 2.923 N/A GLY 290.A N TYR 286.A O no hydrogen 2.879 N/A PHE 291.A N ILE 287.A O no hydrogen 2.924 N/A PHE 291.A N HIS 288.A O no hydrogen 3.398 N/A LEU 292.A N HIS 288.A O no hydrogen 2.983 N/A VAL 293.A N HIS 288.A O no hydrogen 3.373 N/A MET 296.A N PHE 291.A O no hydrogen 3.209 N/A GLY 297.A N LEU 292.A O no hydrogen 2.641 N/A ALA 299.A N VAL 295.A O no hydrogen 2.972 N/A LEU 300.A N MET 296.A O no hydrogen 3.170 N/A HIS 301.A N PRO 298.A O no hydrogen 3.239 N/A SER 304.A OG GLU 307.A OE1 no hydrogen 2.373 N/A MET 308.A N SER 304.A O no hydrogen 3.077 N/A ILE 309.A N VAL 305.A O no hydrogen 2.918 N/A ALA 310.A N GLU 306.A O no hydrogen 2.919 N/A SER 311.A N GLU 307.A O no hydrogen 2.900 N/A SER 311.A OG GLU 307.A O no hydrogen 3.023 N/A SER 311.A OG MET 308.A O no hydrogen 2.859 N/A THR 312.A N MET 308.A O no hydrogen 2.937 N/A THR 312.A OG1 MET 308.A O no hydrogen 2.661 N/A ALA 313.A N ILE 309.A O no hydrogen 2.924 N/A TYR 314.A N ALA 310.A O no hydrogen 2.913 N/A TYR 314.A OH PRO 234.A O no hydrogen 2.578 N/A LEU 315.A N SER 311.A O no hydrogen 2.920 N/A GLU 316.A N THR 312.A O no hydrogen 2.923 N/A LEU 317.A N ALA 313.A O no hydrogen 2.968 N/A PHE 318.A N TYR 314.A O no hydrogen 2.917 N/A LEU 319.A N LEU 315.A O no hydrogen 2.934 N/A ARG 320.A N GLU 316.A O no hydrogen 2.908 N/A ARG 320.A NH1 LEU 247.A O no hydrogen 3.286 N/A ARG 320.A NH1 GLU 316.A OE1 no hydrogen 3.092 N/A ARG 320.A NH2 LEU 247.A O no hydrogen 2.982 N/A SER 321.A N PHE 318.A O no hydrogen 3.069 N/A SER 321.A OG LEU 317.A O no hydrogen 2.892 N/A ILE 322.A N PHE 318.A O no hydrogen 3.193 N/A SER 323.A OG GLU 324.A OE2 no hydrogen 2.595 N/A LEU 328.A N GLU 324.A O no hydrogen 3.282 N/A ARG 329.A N PRO 325.A O no hydrogen 2.872 N/A THR 330.A N ALA 326.A O no hydrogen 3.297 N/A THR 330.A OG1 ALA 326.A O no hydrogen 3.461 N/A PHE 331.A N LEU 327.A O no hydrogen 2.992 N/A LEU 332.A N LEU 328.A O no hydrogen 2.903 N/A ARG 333.A N ARG 329.A O no hydrogen 2.883 N/A PHE 334.A N THR 330.A O no hydrogen 2.956 N/A LEU 335.A N PHE 331.A O no hydrogen 2.955 N/A LEU 336.A N LEU 332.A O no hydrogen 2.897 N/A LEU 337.A N ARG 333.A O no hydrogen 2.916 N/A HIS 340.A N HIS 343.A O no hydrogen 2.965 N/A THR 342.A OG1 ASP 341.A O no hydrogen 2.656 N/A HIS 343.A N HIS 340.A O no hydrogen 3.000 N/A ILE 345.A N HIS 338.A O no hydrogen 3.414 N/A THR 348.A N THR 344.A O no hydrogen 3.082 N/A THR 348.A OG1 THR 344.A O no hydrogen 2.998 N/A LEU 349.A N ILE 345.A O no hydrogen 2.936 N/A VAL 350.A N LEU 346.A O no hydrogen 2.853 N/A ALA 351.A N ASP 347.A O no hydrogen 2.956 N/A ARG 352.A NH1 LEU 300.A O no hydrogen 3.156 N/A ARG 352.A NH2 LEU 300.A O no hydrogen 2.368 N/A ILE 353.A N VAL 350.A O no hydrogen 3.104 N/A SER 355.A N ILE 353.A O no hydrogen 2.875 N/A SER 355.A OG ARG 352.A O no hydrogen 3.200 N/A ARG 358.A NH1 VAL 239.A O no hydrogen 3.303 N/A ARG 358.A NH2 VAL 239.A O no hydrogen 2.900 N/A CYS 360.A N SER 357.A O no hydrogen 2.983 N/A CYS 360.A SG ILE 353.A O no hydrogen 3.274 N/A VAL 362.A N ARG 358.A O no hydrogen 2.965 N/A SER 363.A N LEU 359.A O no hydrogen 2.935 N/A SER 363.A OG ARG 352.A O no hydrogen 3.385 N/A SER 363.A OG LEU 359.A O no hydrogen 2.603 N/A LEU 364.A N CYS 360.A O no hydrogen 2.884 N/A SER 365.A N MET 361.A O no hydrogen 2.970 N/A SER 365.A OG HIS 245.A ND1 no hydrogen 3.085 N/A LEU 366.A N VAL 362.A O no hydrogen 2.910 N/A PHE 367.A N SER 363.A O no hydrogen 2.954 N/A ARG 368.A N LEU 364.A O no hydrogen 2.865 N/A THR 369.A N SER 365.A O no hydrogen 2.956 N/A THR 369.A OG1 GLU 316.A OE1 no hydrogen 3.246 N/A THR 369.A OG1 SER 365.A O no hydrogen 2.994 N/A LEU 370.A N LEU 366.A O no hydrogen 2.908 N/A LEU 371.A N PHE 367.A O no hydrogen 2.909 N/A ASN 372.A N ARG 368.A O no hydrogen 2.891 N/A LEU 373.A N THR 369.A O no hydrogen 2.963 N/A SER 374.A N LEU 371.A O no hydrogen 3.347 N/A CYS 375.A SG ASP 377.A OD1 no hydrogen 3.280 N/A LEU 380.A N GLU 376.A O no hydrogen 2.900 N/A GLN 381.A N ASP 377.A O no hydrogen 2.908 N/A LEU 382.A N VAL 378.A O no hydrogen 2.901 N/A VAL 383.A N LEU 379.A O no hydrogen 3.000 N/A LEU 384.A N LEU 379.A O no hydrogen 3.222 N/A ARG 385.A N LEU 380.A O no hydrogen 2.703 N/A ARG 385.A NH1 GLN 381.A OE1 no hydrogen 2.487 N/A LEU 387.A N VAL 383.A O no hydrogen 2.977 N/A LEU 387.A N LEU 384.A O no hydrogen 3.034 N/A VAL 388.A N LEU 384.A O no hydrogen 2.689 N/A ALA 400.A N GLN 397.A O no hydrogen 2.952 N/A ARG 402.A NE ASP 459.A O no hydrogen 3.059 N/A ARG 409.A NE ASN 517.A OD1 no hydrogen 2.462 N/A ARG 409.A NH2 ASN 517.A OD1 no hydrogen 3.383 N/A ALA 410.A N ASP 405.A OD1 no hydrogen 2.753 N/A ASP 412.A N GLY 408.A O no hydrogen 3.244 N/A LYS 413.A N ARG 409.A O no hydrogen 2.913 N/A PHE 414.A N ALA 410.A O no hydrogen 2.915 N/A LEU 415.A N ALA 411.A O no hydrogen 2.889 N/A SER 416.A N ASP 412.A O no hydrogen 2.909 N/A SER 416.A OG LYS 413.A O no hydrogen 3.043 N/A LEU 417.A N PHE 414.A O no hydrogen 3.298 N/A CYS 421.A SG GLU 539.A OE1 no hydrogen 3.270 N/A CYS 422.A N PRO 419.A O no hydrogen 3.170 N/A CYS 422.A SG ALA 581.A O no hydrogen 3.268 N/A ARG 423.A N PRO 419.A O no hydrogen 3.164 N/A ARG 423.A NE ILE 418.A O no hydrogen 3.127 N/A ARG 423.A NH2 ILE 418.A O no hydrogen 2.885 N/A HIS 425.A N HIS 425.A ND1 no hydrogen 2.883 N/A LEU 437.A N TYR 433.A O no hydrogen 3.244 N/A ARG 438.A N LEU 434.A O no hydrogen 3.171 N/A ARG 438.A NH1 GLU 435.A OE2 no hydrogen 3.038 N/A GLU 439.A N GLU 435.A O no hydrogen 3.354 N/A ALA 440.A N TYR 436.A O no hydrogen 3.041 N/A ARG 441.A N LEU 437.A O no hydrogen 3.144 N/A ARG 441.A NH2 ALA 597.A O no hydrogen 2.566 N/A ARG 442.A N ARG 438.A O no hydrogen 3.133 N/A GLY 443.A N GLU 439.A O no hydrogen 2.974 N/A VAL 444.A N ALA 440.A O no hydrogen 3.009 N/A ASP 445.A N ARG 441.A O no hydrogen 3.099 N/A ARG 446.A N ARG 442.A O no hydrogen 3.096 N/A CYS 447.A N GLY 443.A O no hydrogen 3.337 N/A VAL 448.A N VAL 444.A O no hydrogen 2.930 N/A ARG 449.A N ASP 445.A O no hydrogen 3.144 N/A ALA 450.A N ARG 446.A O no hydrogen 3.121 N/A CYS 451.A N VAL 448.A O no hydrogen 3.202 N/A CYS 451.A SG CYS 447.A O no hydrogen 3.292 N/A TRP 454.A N CYS 451.A O no hydrogen 3.414 N/A SER 455.A N GLU 376.A OE2 no hydrogen 3.367 N/A TYR 458.A OH GLU 376.A OE1 no hydrogen 2.935 N/A GLU 461.A N ASP 459.A OD2 no hydrogen 2.964 N/A ARG 462.A N ASP 459.A OD2 no hydrogen 3.152 N/A MET 473.A N GLY 470.A O no hydrogen 3.265 N/A ALA 474.A N GLY 470.A O no hydrogen 3.189 N/A VAL 475.A N PRO 471.A O no hydrogen 3.326 N/A LEU 476.A N PHE 472.A O no hydrogen 3.202 N/A PHE 477.A N MET 473.A O no hydrogen 3.057 N/A ALA 478.A N ALA 474.A O no hydrogen 3.038 N/A LYS 479.A N VAL 475.A O no hydrogen 2.935 N/A LYS 479.A NZ SER 355.A O no hydrogen 3.097 N/A LEU 480.A N LEU 476.A O no hydrogen 3.048 N/A GLU 481.A N PHE 477.A O no hydrogen 2.808 N/A GLN 485.A N ASN 482.A O no hydrogen 3.164 N/A ASN 486.A N ASN 482.A O no hydrogen 3.271 N/A ASN 486.A ND2 LYS 479.A O no hydrogen 2.951 N/A ASN 486.A ND2 ASN 491.A OD1 no hydrogen 3.513 N/A TYR 489.A N SER 487.A OG no hydrogen 3.260 N/A ASN 491.A N SER 487.A O no hydrogen 3.090 N/A ASN 491.A ND2 MET 483.A O no hydrogen 2.822 N/A PHE 492.A N VAL 488.A O no hydrogen 3.158 N/A LEU 493.A N TYR 489.A O no hydrogen 3.440 N/A LEU 494.A N VAL 490.A O no hydrogen 2.928 N/A THR 495.A N ASN 491.A O no hydrogen 2.889 N/A THR 495.A OG1 ASN 491.A O no hydrogen 2.650 N/A THR 495.A OG1 PHE 492.A O no hydrogen 3.273 N/A GLY 496.A N PHE 492.A O no hydrogen 3.067 N/A LEU 497.A N LEU 493.A O no hydrogen 2.955 N/A VAL 498.A N LEU 494.A O no hydrogen 3.398 N/A ALA 499.A N THR 495.A O no hydrogen 3.172 N/A GLN 500.A N GLY 496.A O no hydrogen 3.160 N/A LEU 501.A N LEU 497.A O no hydrogen 2.759 N/A ALA 502.A N VAL 498.A O no hydrogen 2.918 N/A CYS 503.A SG ALA 499.A O no hydrogen 3.283 N/A HIS 504.A N LEU 501.A O no hydrogen 3.298 N/A LEU 508.A N TYR 458.A O no hydrogen 3.005 N/A ARG 510.A N GLN 506.A O no hydrogen 2.747 N/A SER 511.A N PRO 507.A O no hydrogen 3.161 N/A SER 511.A OG PRO 507.A O no hydrogen 3.041 N/A SER 511.A OG LEU 508.A O no hydrogen 3.489 N/A LEU 514.A N ARG 510.A O no hydrogen 2.934 N/A MET 518.A N ASN 515.A O no hydrogen 3.339 N/A VAL 519.A N GLN 397.A OE1 no hydrogen 2.629 N/A GLN 521.A N HIS 392.A O no hydrogen 3.112 N/A GLN 521.A NE2 ASN 391.A O no hydrogen 2.632 N/A SER 523.A OG PRO 467.A O no hydrogen 2.977 N/A VAL 524.A N GLN 521.A O no hydrogen 2.984 N/A SER 526.A OG GLN 529.A OE1 no hydrogen 3.212 N/A GLN 529.A N SER 526.A OG no hydrogen 3.107 N/A VAL 530.A N SER 526.A O no hydrogen 3.338 N/A LEU 531.A N LEU 527.A O no hydrogen 3.043 N/A GLY 532.A N LEU 528.A O no hydrogen 2.929 N/A SER 533.A N GLN 529.A O no hydrogen 3.200 N/A SER 533.A OG GLU 481.A OE1 no hydrogen 3.303 N/A VAL 534.A N VAL 530.A O no hydrogen 3.121 N/A LYS 535.A N LEU 531.A O no hydrogen 3.074 N/A ASN 536.A N GLY 532.A O no hydrogen 3.073 N/A LYS 537.A N SER 533.A O no hydrogen 3.121 N/A ILE 538.A N VAL 534.A O no hydrogen 2.901 N/A ASN 540.A N ASN 536.A O no hydrogen 3.123 N/A PHE 541.A N LYS 537.A O no hydrogen 3.260 N/A ALA 542.A N ILE 538.A O no hydrogen 3.282 N/A ALA 543.A N GLU 539.A O no hydrogen 3.073 N/A SER 544.A N ASN 540.A O no hydrogen 3.331 N/A GLN 545.A N PHE 541.A O no hydrogen 3.249 N/A LEU 551.A N ASP 547.A O no hydrogen 2.997 N/A LEU 552.A N PHE 548.A O no hydrogen 2.824 N/A LYS 554.A N ALA 550.A O no hydrogen 3.399 N/A ALA 555.A N LEU 551.A O no hydrogen 3.115 N/A LYS 556.A N LEU 552.A O no hydrogen 3.031 N/A LYS 557.A N SER 553.A O no hydrogen 3.220 N/A TYR 558.A N LYS 554.A O no hydrogen 3.210 N/A LEU 559.A N LYS 556.A O no hydrogen 2.751 N/A ILE 560.A N LYS 556.A O no hydrogen 3.213 N/A ARG 562.A N TYR 558.A O no hydrogen 2.890 N/A LYS 564.A N ALA 561.A O no hydrogen 3.190 N/A LEU 565.A N ALA 561.A O no hydrogen 2.844 N/A ALA 571.A N ARG 567.A O no hydrogen 3.256 N/A LEU 572.A N GLN 568.A O no hydrogen 2.715 N/A ARG 573.A N GLY 569.A O no hydrogen 3.065 N/A VAL 574.A N GLU 570.A O no hydrogen 3.076 N/A LYS 575.A N ALA 571.A O no hydrogen 3.168 N/A LYS 575.A NZ TYR 579.A OH no hydrogen 3.181 N/A ASN 576.A N LEU 572.A O no hydrogen 3.017 N/A ASN 576.A ND2 GLN 485.A O no hydrogen 3.242 N/A ALA 577.A N ARG 573.A O no hydrogen 3.372 N/A VAL 578.A N VAL 574.A O no hydrogen 3.130 N/A TYR 579.A N LYS 575.A O no hydrogen 3.318 N/A CYS 580.A N ASN 576.A O no hydrogen 2.881 N/A CYS 580.A SG MET 483.A O no hydrogen 3.584 N/A ALA 581.A N ALA 577.A O no hydrogen 3.167 N/A ALA 581.A N VAL 578.A O no hydrogen 3.271 N/A VAL 582.A N TYR 579.A O no hydrogen 3.149 N/A ILE 583.A N TYR 579.A O no hydrogen 3.296 N/A PHE 584.A N CYS 580.A O no hydrogen 3.025 N/A PHE 587.A N ILE 583.A O no hydrogen 2.606 N/A LEU 588.A N PHE 584.A O no hydrogen 2.965 N/A LYS 589.A N PRO 585.A O no hydrogen 2.892 N/A LYS 589.A NZ LEU 429.A O no hydrogen 2.773 N/A LYS 589.A NZ ASN 432.A OD1 no hydrogen 2.756 N/A LYS 589.A NZ GLU 586.A OE2 no hydrogen 3.413 N/A GLU 590.A N GLU 586.A O no hydrogen 3.239 N/A LEU 591.A N PHE 587.A O no hydrogen 3.062 N/A ALA 592.A N LEU 588.A O no hydrogen 3.207 N/A ALA 593.A N LYS 589.A O no hydrogen 3.015 N/A ILE 594.A N GLU 590.A O no hydrogen 3.166 N/A SER 595.A N LEU 591.A O no hydrogen 3.346 N/A GLN 596.A N ALA 592.A O no hydrogen 2.964 N/A ALA 597.A N ALA 593.A O no hydrogen 2.956 N/A HIS 598.A N ILE 594.A O no hydrogen 3.181 N/A HIS 598.A NE2 ALA 502.A O no hydrogen 2.831 N/A ALA 599.A N GLN 596.A O no hydrogen 3.405 N/A VAL 600.A N ALA 597.A O no hydrogen 3.332 N/A