Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7jk5_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A SG PHE 5.A O no hydrogen 3.774 N/A GLN 22.A N LYS 18.A O no hydrogen 3.036 N/A GLN 23.A N VAL 20.A O no hydrogen 3.005 N/A GLU 28.A N PRO 24.A O no hydrogen 2.914 N/A TYR 29.A N PHE 25.A O no hydrogen 2.897 N/A ARG 30.A N TYR 26.A O no hydrogen 2.885 N/A ARG 30.A NH2 TYR 26.A OH no hydrogen 3.279 N/A LYS 31.A N GLU 27.A O no hydrogen 2.945 N/A ALA 32.A N GLU 28.A O no hydrogen 2.958 N/A TRP 33.A N TYR 29.A O no hydrogen 2.866 N/A ASN 34.A N ARG 30.A O no hydrogen 2.869 N/A GLN 35.A N LYS 31.A O no hydrogen 2.999 N/A ILE 36.A N ALA 32.A O no hydrogen 2.926 N/A ASN 37.A N TRP 33.A O no hydrogen 2.870 N/A ASP 38.A N ASN 34.A O no hydrogen 2.929 N/A HIS 39.A N GLN 35.A O no hydrogen 2.981 N/A HIS 39.A ND1 TYR 241.A OH no hydrogen 2.361 N/A ILE 40.A N ILE 36.A O no hydrogen 2.963 N/A ALA 41.A N ASN 37.A O no hydrogen 2.956 N/A ASP 42.A N ASP 38.A O no hydrogen 2.957 N/A LEU 43.A N HIS 39.A O no hydrogen 2.967 N/A GLN 44.A N ILE 40.A O no hydrogen 2.956 N/A HIS 45.A N ALA 41.A O no hydrogen 2.935 N/A ARG 46.A N ASP 42.A O no hydrogen 2.892 N/A SER 47.A N LEU 43.A O no hydrogen 2.971 N/A SER 47.A OG LEU 43.A O no hydrogen 2.871 N/A SER 47.A OG GLN 44.A O no hydrogen 2.862 N/A TYR 48.A N GLN 44.A O no hydrogen 2.912 N/A THR 51.A OG1 TYR 48.A O no hydrogen 2.454 N/A LEU 52.A N TYR 48.A O no hydrogen 2.901 N/A GLU 53.A N ALA 49.A O no hydrogen 2.902 N/A GLN 54.A N ARG 50.A O no hydrogen 2.918 N/A LEU 55.A N THR 51.A O no hydrogen 2.891 N/A VAL 56.A N LEU 52.A O no hydrogen 2.949 N/A ASP 57.A N GLU 53.A O no hydrogen 2.896 N/A PHE 58.A N GLN 54.A O no hydrogen 2.906 N/A VAL 59.A N LEU 55.A O no hydrogen 2.951 N/A VAL 60.A N VAL 56.A O no hydrogen 2.926 N/A GLY 61.A N ASP 57.A O no hydrogen 2.858 N/A GLN 62.A N PHE 58.A O no hydrogen 2.924 N/A ALA 63.A N VAL 59.A O no hydrogen 2.921 N/A GLU 64.A N VAL 60.A O no hydrogen 2.897 N/A ARG 65.A N GLN 62.A O no hydrogen 3.142 N/A THR 70.A N ARG 215.A O no hydrogen 2.942 N/A THR 70.A OG1 LEU 191.A O no hydrogen 2.189 N/A ALA 71.A N LEU 191.A O no hydrogen 2.879 N/A LEU 73.A N LEU 193.A O no hydrogen 2.920 N/A LEU 74.A N PHE 219.A O no hydrogen 2.903 N/A THR 75.A N LEU 73.A O no hydrogen 2.696 N/A GLN 79.A N ASN 78.A OD1 no hydrogen 2.838 N/A HIS 82.A N GLN 79.A O no hydrogen 2.904 N/A HIS 82.A ND1 GLN 79.A O no hydrogen 2.298 N/A LEU 83.A N PRO 80.A O no hydrogen 3.310 N/A PHE 86.A N HIS 82.A O no hydrogen 2.973 N/A THR 87.A N LEU 83.A O no hydrogen 3.082 N/A THR 87.A OG1 SER 84.A O no hydrogen 2.433 N/A ALA 88.A N SER 84.A O no hydrogen 2.909 N/A LEU 89.A N GLN 85.A O no hydrogen 3.074 N/A THR 90.A N PHE 86.A O no hydrogen 3.067 N/A THR 90.A OG1 THR 87.A O no hydrogen 2.455 N/A GLN 91.A N THR 87.A O no hydrogen 3.044 N/A ARG 92.A N ALA 88.A O no hydrogen 2.990 N/A ARG 92.A NH2 GLU 53.A OE2 no hydrogen 3.422 N/A LEU 93.A N LEU 89.A O no hydrogen 3.093 N/A HIS 94.A N THR 90.A O no hydrogen 2.871 N/A HIS 94.A N GLN 91.A O no hydrogen 3.018 N/A ALA 95.A N ARG 92.A O no hydrogen 2.965 N/A GLN 96.A N ARG 92.A O no hydrogen 3.085 N/A ARG 97.A NE HIS 94.A O no hydrogen 2.535 N/A MET 100.A N GLN 157.A O no hydrogen 3.000 N/A VAL 101.A N ASP 126.A OD2 no hydrogen 2.548 N/A CYS 102.A N VAL 159.A O no hydrogen 3.152 N/A CYS 102.A SG LEU 119.A O no hydrogen 3.407 N/A LEU 104.A N ILE 161.A O no hydrogen 2.740 N/A SER 106.A N ASP 164.A OD1 no hydrogen 3.271 N/A SER 106.A N ASP 164.A OD2 no hydrogen 3.402 N/A SER 106.A OG ASP 164.A OD2 no hydrogen 2.369 N/A ASP 108.A N GLN 105.A O no hydrogen 3.121 N/A CYS 109.A N SER 106.A O no hydrogen 3.382 N/A ALA 115.A N THR 111.A O no hydrogen 2.977 N/A VAL 116.A N LEU 112.A O no hydrogen 2.982 N/A GLU 117.A N LYS 113.A O no hydrogen 3.003 N/A THR 118.A N ALA 114.A O no hydrogen 2.978 N/A THR 118.A OG1 ALA 114.A O no hydrogen 3.180 N/A THR 118.A OG1 ALA 115.A O no hydrogen 3.148 N/A LEU 119.A N ALA 115.A O no hydrogen 2.954 N/A VAL 120.A N VAL 116.A O no hydrogen 2.997 N/A PHE 121.A N GLU 117.A O no hydrogen 2.874 N/A GLY 122.A N THR 118.A O no hydrogen 2.889 N/A LEU 123.A N LEU 119.A O no hydrogen 3.004 N/A VAL 124.A N VAL 120.A O no hydrogen 2.977 N/A GLU 125.A N PHE 121.A O no hydrogen 2.930 N/A ASP 126.A N GLY 122.A O no hydrogen 2.879 N/A ASN 127.A N LEU 123.A O no hydrogen 2.998 N/A ALA 128.A N VAL 124.A O no hydrogen 2.972 N/A GLU 129.A N GLU 125.A O no hydrogen 2.898 N/A VAL 130.A N ASP 126.A O no hydrogen 2.930 N/A GLU 131.A N ASN 127.A O no hydrogen 3.296 N/A GLN 137.A N ARG 134.A O no hydrogen 3.220 N/A CYS 138.A SG GLU 117.A O no hydrogen 3.971 N/A CYS 138.A SG ARG 134.A O no hydrogen 3.697 N/A CYS 138.A SG ARG 135.A O no hydrogen 3.252 N/A THR 139.A N GLN 137.A O no hydrogen 2.711 N/A GLN 142.A N THR 139.A OG1 no hydrogen 3.277 N/A GLN 142.A NE2 GLN 137.A OE1 no hydrogen 2.399 N/A LEU 143.A N THR 139.A O no hydrogen 3.221 N/A LYS 144.A N MET 140.A O no hydrogen 2.929 N/A SER 145.A N LYS 141.A O no hydrogen 2.951 N/A SER 145.A OG LYS 141.A O no hydrogen 3.293 N/A SER 145.A OG GLN 142.A O no hydrogen 2.871 N/A TRP 146.A N GLN 142.A O no hydrogen 2.878 N/A TYR 147.A N LEU 143.A O no hydrogen 2.896 N/A THR 148.A N LYS 144.A O no hydrogen 2.994 N/A THR 148.A OG1 LYS 144.A O no hydrogen 2.894 N/A ASN 149.A N SER 145.A O no hydrogen 2.803 N/A ASN 150.A N TRP 146.A O no hydrogen 2.979 N/A PHE 151.A N TYR 147.A O no hydrogen 2.779 N/A SER 153.A OG ASP 152.A OD1 no hydrogen 3.400 N/A GLN 157.A N ALA 98.A O no hydrogen 2.671 N/A LEU 158.A N PRO 188.A O no hydrogen 2.869 N/A VAL 159.A N MET 100.A O no hydrogen 2.851 N/A LEU 162.A N VAL 192.A O no hydrogen 3.182 N/A PHE 165.A N GLY 194.A O no hydrogen 3.224 N/A CYS 167.A N ASP 164.A O no hydrogen 3.303 N/A CYS 167.A SG SER 106.A OG no hydrogen 3.342 N/A LEU 173.A N ASN 169.A O no hydrogen 3.260 N/A GLN 174.A N ALA 170.A O no hydrogen 2.941 N/A GLN 174.A NE2 THR 205.A O no hydrogen 3.439 N/A ASP 175.A N SER 171.A O no hydrogen 2.965 N/A LEU 176.A N VAL 172.A O no hydrogen 2.904 N/A ILE 177.A N LEU 173.A O no hydrogen 2.966 N/A LEU 178.A N GLN 174.A O no hydrogen 2.935 N/A ILE 179.A N ASP 175.A O no hydrogen 2.911 N/A LEU 180.A N LEU 176.A O no hydrogen 2.930 N/A SER 181.A N ILE 177.A O no hydrogen 2.887 N/A ALA 182.A N LEU 178.A O no hydrogen 2.967 N/A HIS 183.A N ILE 179.A O no hydrogen 3.171 N/A LEU 187.A N HIS 183.A O no hydrogen 2.939 N/A VAL 190.A N LEU 158.A O no hydrogen 3.183 N/A LEU 191.A N PRO 69.A O no hydrogen 3.314 N/A GLY 194.A N LEU 162.A O no hydrogen 3.000 N/A THR 197.A OG1 ALA 198.A O no hydrogen 3.504 N/A ALA 198.A N THR 197.A OG1 no hydrogen 2.475 N/A ALA 201.A N ALA 198.A O no hydrogen 3.080 N/A HIS 203.A N MET 199.A O no hydrogen 2.991 N/A GLY 204.A N THR 200.A O no hydrogen 2.861 N/A THR 205.A N ALA 201.A O no hydrogen 2.932 N/A THR 205.A OG1 ALA 201.A O no hydrogen 2.944 N/A LEU 206.A N VAL 202.A O no hydrogen 3.339 N/A SER 211.A N PRO 207.A O no hydrogen 2.965 N/A SER 211.A OG PRO 207.A O no hydrogen 2.912 N/A SER 211.A OG TYR 208.A O no hydrogen 2.627 N/A SER 212.A N TYR 208.A O no hydrogen 2.990 N/A SER 212.A OG HIS 209.A O no hydrogen 2.403 N/A LYS 213.A N HIS 209.A O no hydrogen 3.100 N/A LYS 213.A N VAL 210.A O no hydrogen 3.294 N/A ARG 217.A N THR 70.A O no hydrogen 2.951 N/A PHE 219.A N ALA 72.A O no hydrogen 2.892 N/A GLY 227.A N ALA 223.A O no hydrogen 2.913 N/A LEU 228.A N ALA 224.A O no hydrogen 2.894 N/A ASN 229.A N PRO 225.A O no hydrogen 2.941 N/A GLU 230.A N THR 226.A O no hydrogen 2.945 N/A VAL 231.A N GLY 227.A O no hydrogen 2.941 N/A LEU 232.A N LEU 228.A O no hydrogen 2.896 N/A ASP 233.A N ASN 229.A O no hydrogen 2.926 N/A LYS 234.A N GLU 230.A O no hydrogen 2.971 N/A LYS 234.A NZ GLU 230.A OE2 no hydrogen 2.376 N/A VAL 235.A N VAL 231.A O no hydrogen 3.083 N/A LEU 237.A N LEU 232.A O no hydrogen 3.242 N/A SER 238.A N VAL 235.A O no hydrogen 3.099 N/A TYR 241.A OH HIS 39.A ND1 no hydrogen 2.361 N/A HIS 244.A N PHE 488.A O no hydrogen 3.071 N/A LYS 248.A NZ SER 491.A O no hydrogen 3.342 N/A THR 249.A OG1 SER 246.A O no hydrogen 3.011 N/A PHE 250.A N SER 246.A O no hydrogen 3.000 N/A LYS 251.A N GLY 247.A O no hydrogen 2.946 N/A LYS 251.A NZ LYS 251.A O no hydrogen 3.469 N/A PHE 252.A N LYS 248.A O no hydrogen 2.912 N/A LEU 253.A N THR 249.A O no hydrogen 2.926 N/A THR 254.A N PHE 250.A O no hydrogen 3.038 N/A HIS 255.A N LYS 251.A O no hydrogen 2.825 N/A ILE 256.A N PHE 252.A O no hydrogen 2.936 N/A PHE 257.A N LEU 253.A O no hydrogen 3.006 N/A LEU 258.A N THR 254.A O no hydrogen 2.920 N/A TYR 259.A N HIS 255.A O no hydrogen 2.868 N/A ASP 261.A N ILE 256.A O no hydrogen 3.457 N/A SER 263.A OG ASP 261.A O no hydrogen 3.519 N/A PHE 267.A N SER 263.A O no hydrogen 2.963 N/A ILE 268.A N ILE 264.A O no hydrogen 2.950 N/A GLN 269.A N HIS 265.A O no hydrogen 2.891 N/A GLY 270.A N GLY 266.A O no hydrogen 2.937 N/A PHE 271.A N PHE 267.A O no hydrogen 2.942 N/A LYS 272.A N ILE 268.A O no hydrogen 2.891 N/A TYR 273.A N GLN 269.A O no hydrogen 2.938 N/A CYS 274.A N GLY 270.A O no hydrogen 2.936 N/A CYS 274.A SG GLY 270.A O no hydrogen 3.187 N/A LEU 275.A N PHE 271.A O no hydrogen 2.906 N/A MET 276.A N LYS 272.A O no hydrogen 2.936 N/A GLU 277.A N TYR 273.A O no hydrogen 2.925 N/A HIS 278.A N CYS 274.A O no hydrogen 2.977 N/A HIS 278.A NE2 LEU 487.A O no hydrogen 2.648 N/A PHE 279.A N LEU 275.A O no hydrogen 2.921 N/A PHE 280.A N MET 276.A O no hydrogen 2.942 N/A ASN 283.A ND2 GLN 23.A OE1 no hydrogen 2.388 N/A ALA 286.A N ASN 283.A O no hydrogen 2.985 N/A LEU 287.A N ALA 284.A O no hydrogen 3.300 N/A CYS 288.A N PHE 285.A O no hydrogen 3.433 N/A CYS 288.A SG ALA 242.A O no hydrogen 3.305 N/A THR 289.A OG1 ASP 290.A OD1 no hydrogen 2.561 N/A ASP 290.A N THR 289.A OG1 no hydrogen 2.478 N/A TYR 291.A OH PRO 338.A O no hydrogen 3.329 N/A SER 292.A N GLU 430.A OE2 no hydrogen 3.205 N/A ALA 294.A N ASP 290.A O no hydrogen 2.907 N/A LEU 295.A N TYR 291.A O no hydrogen 2.931 N/A GLY 296.A N SER 292.A O no hydrogen 3.023 N/A ARG 297.A N LYS 293.A O no hydrogen 2.926 N/A ILE 298.A N ALA 294.A O no hydrogen 2.812 N/A LYS 299.A N LEU 295.A O no hydrogen 3.059 N/A GLN 300.A N GLY 296.A O no hydrogen 2.998 N/A HIS 303.A N THR 302.A OG1 no hydrogen 2.737 N/A GLU 307.A N HIS 303.A O no hydrogen 3.259 N/A THR 308.A N GLU 304.A O no hydrogen 2.969 N/A THR 308.A OG1 GLU 304.A O no hydrogen 3.395 N/A THR 308.A OG1 ASP 305.A O no hydrogen 3.280 N/A ILE 309.A N ASP 305.A O no hydrogen 2.906 N/A ARG 310.A N MET 306.A O no hydrogen 2.949 N/A ARG 311.A N GLU 307.A O no hydrogen 3.363 N/A ARG 311.A NH2 GLU 307.A OE1 no hydrogen 2.632 N/A LEU 312.A N ILE 309.A O no hydrogen 3.169 N/A PHE 315.A N LEU 312.A O no hydrogen 3.205 N/A ARG 316.A N PRO 313.A O no hydrogen 2.916 N/A GLU 320.A N ARG 316.A O no hydrogen 3.241 N/A LEU 327.A N ILE 323.A O no hydrogen 3.246 N/A ASP 329.A N ALA 325.A O no hydrogen 3.003 N/A ASP 331.A N ASP 329.A O no hydrogen 2.553 N/A LYS 334.A N ASP 330.A O no hydrogen 2.768 N/A LYS 334.A NZ ASP 331.A OD1 no hydrogen 3.117 N/A LYS 335.A N ASP 331.A O no hydrogen 2.932 N/A LYS 336.A N TYR 332.A O no hydrogen 2.967 N/A GLN 339.A N LYS 336.A O no hydrogen 3.244 N/A LEU 341.A N LEU 337.A O no hydrogen 2.986 N/A ARG 342.A N PRO 338.A O no hydrogen 2.859 N/A ASP 343.A N GLN 339.A O no hydrogen 2.950 N/A CYS 344.A N LEU 340.A O no hydrogen 2.927 N/A LEU 345.A N LEU 341.A O no hydrogen 2.948 N/A LEU 346.A N ARG 342.A O no hydrogen 2.886 N/A HIS 347.A N ASP 343.A O no hydrogen 2.829 N/A PHE 348.A N CYS 344.A O no hydrogen 2.981 N/A LEU 349.A N LEU 345.A O no hydrogen 2.984 N/A LEU 350.A N LEU 346.A O no hydrogen 2.922 N/A PHE 351.A N HIS 347.A O no hydrogen 2.804 N/A ARG 352.A N PHE 348.A O no hydrogen 2.949 N/A ARG 352.A NE LEU 237.A O no hydrogen 2.889 N/A ARG 352.A NH1 ARG 352.A O no hydrogen 2.676 N/A ARG 352.A NH1 GLU 356.A OE1 no hydrogen 3.290 N/A ARG 352.A NH2 GLU 356.A OE1 no hydrogen 3.281 N/A CYS 353.A N LEU 349.A O no hydrogen 3.050 N/A CYS 353.A SG LEU 349.A O no hydrogen 3.209 N/A CYS 353.A SG LEU 350.A O no hydrogen 3.455 N/A SER 354.A N LEU 350.A O no hydrogen 2.894 N/A SER 354.A OG LEU 350.A O no hydrogen 2.885 N/A SER 354.A OG PHE 351.A O no hydrogen 3.049 N/A SER 354.A OG HIS 474.A O no hydrogen 2.626 N/A LEU 355.A N PHE 351.A O no hydrogen 2.846 N/A GLU 356.A N ARG 352.A O no hydrogen 3.001 N/A PHE 357.A N CYS 353.A O no hydrogen 2.988 N/A LEU 358.A N SER 354.A O no hydrogen 2.932 N/A THR 359.A N LEU 355.A O no hydrogen 2.941 N/A GLU 360.A N GLU 356.A O no hydrogen 2.982 N/A LEU 361.A N PHE 357.A O no hydrogen 2.979 N/A VAL 362.A N LEU 358.A O no hydrogen 2.891 N/A GLY 363.A N THR 359.A O no hydrogen 2.912 N/A LEU 365.A N VAL 362.A O no hydrogen 3.062 N/A CYS 368.A N PRO 366.A O no hydrogen 2.932 N/A CYS 368.A SG VAL 362.A O no hydrogen 2.534 N/A CYS 368.A SG LEU 365.A O no hydrogen 3.527 N/A CYS 368.A SG GLY 371.A O no hydrogen 3.822 N/A ARG 374.A NE GLU 356.A OE1 no hydrogen 2.441 N/A ARG 374.A NH2 GLU 356.A OE2 no hydrogen 2.612 N/A GLU 376.A N LEU 373.A O no hydrogen 3.050 N/A LEU 377.A N LEU 373.A O no hydrogen 3.501 N/A TYR 378.A N ARG 374.A O no hydrogen 2.912 N/A TYR 378.A OH LEU 245.A O no hydrogen 3.145 N/A VAL 379.A N ARG 375.A O no hydrogen 2.909 N/A ASN 380.A N GLU 376.A O no hydrogen 2.959 N/A CYS 381.A N LEU 377.A O no hydrogen 2.861 N/A CYS 381.A SG LEU 475.A O no hydrogen 3.231 N/A CYS 381.A SG ARG 476.A O no hydrogen 3.944 N/A LEU 382.A N TYR 378.A O no hydrogen 2.927 N/A ASN 383.A N VAL 379.A O no hydrogen 2.939 N/A SER 388.A OG ALA 385.A O no hydrogen 3.128 N/A THR 389.A N ILE 386.A O no hydrogen 3.133 N/A THR 389.A OG1 ILE 386.A O no hydrogen 2.830 N/A TYR 392.A N THR 389.A OG1 no hydrogen 3.030 N/A GLU 394.A N PRO 390.A O no hydrogen 2.921 N/A CYS 395.A N GLU 391.A O no hydrogen 2.891 N/A CYS 395.A SG GLU 391.A O no hydrogen 3.251 N/A LEU 396.A N TYR 392.A O no hydrogen 2.883 N/A GLN 397.A N LYS 393.A O no hydrogen 2.921 N/A MET 398.A N GLU 394.A O no hydrogen 2.938 N/A LEU 399.A N CYS 395.A O no hydrogen 2.828 N/A SER 400.A N LEU 396.A O no hydrogen 2.889 N/A SER 400.A OG LEU 396.A O no hydrogen 2.867 N/A SER 400.A OG GLN 397.A O no hydrogen 2.777 N/A SER 403.A OG GLU 406.A OE1 no hydrogen 2.825 N/A GLU 406.A N GLU 406.A OE1 no hydrogen 2.976 N/A PHE 407.A N SER 403.A O no hydrogen 2.959 N/A VAL 408.A N LYS 404.A O no hydrogen 2.941 N/A ALA 409.A N ASP 405.A O no hydrogen 2.950 N/A LYS 410.A N GLU 406.A O no hydrogen 2.890 N/A LYS 410.A NZ LEU 361.A O no hydrogen 2.796 N/A VAL 411.A N PHE 407.A O no hydrogen 2.941 N/A ASN 412.A N VAL 408.A O no hydrogen 2.891 N/A ARG 413.A N ALA 409.A O no hydrogen 2.956 N/A ALA 414.A N LYS 410.A O no hydrogen 2.955 N/A LEU 415.A N VAL 411.A O no hydrogen 2.827 N/A GLU 416.A N ASN 412.A O no hydrogen 2.976 N/A ARG 417.A N ARG 413.A O no hydrogen 2.948 N/A THR 418.A N ALA 414.A O no hydrogen 2.930 N/A THR 418.A OG1 ALA 414.A O no hydrogen 2.898 N/A GLU 419.A N LEU 415.A O no hydrogen 2.940 N/A GLN 420.A N GLU 416.A O no hydrogen 2.987 N/A GLN 420.A NE2 GLU 416.A OE2 no hydrogen 2.457 N/A PHE 421.A N ARG 417.A O no hydrogen 2.968 N/A LEU 422.A N THR 418.A O no hydrogen 2.886 N/A VAL 423.A N GLU 419.A O no hydrogen 2.940 N/A LEU 429.A N ILE 426.A O no hydrogen 3.045 N/A CYS 435.A SG LEU 346.A O no hydrogen 3.326 N/A CYS 435.A SG LEU 431.A O no hydrogen 4.000 N/A THR 436.A N GLY 432.A O no hydrogen 3.227 N/A ALA 437.A N GLU 433.A O no hydrogen 2.939 N/A VAL 438.A N ALA 434.A O no hydrogen 2.906 N/A LEU 439.A N CYS 435.A O no hydrogen 2.902 N/A ARG 440.A N THR 436.A O no hydrogen 2.879 N/A ARG 440.A NE THR 436.A OG1 no hydrogen 3.091 N/A ARG 440.A NH2 THR 436.A OG1 no hydrogen 3.402 N/A LYS 442.A NZ VAL 438.A O no hydrogen 2.483 N/A LEU 443.A N LEU 439.A O no hydrogen 2.948 N/A GLU 444.A N ARG 440.A O no hydrogen 2.856 N/A ALA 445.A N PRO 441.A O no hydrogen 2.899 N/A ILE 446.A N LYS 442.A O no hydrogen 3.003 N/A ARG 447.A N LEU 443.A O no hydrogen 2.887 N/A LEU 448.A N GLU 444.A O no hydrogen 2.928 N/A ALA 449.A N ALA 445.A O no hydrogen 2.993 N/A VAL 450.A N ILE 446.A O no hydrogen 2.904 N/A ASP 451.A N ARG 447.A O no hydrogen 2.954 N/A GLU 452.A N LEU 448.A O no hydrogen 2.982 N/A VAL 453.A N ALA 449.A O no hydrogen 2.993 N/A VAL 454.A N VAL 450.A O no hydrogen 2.906 N/A LYS 455.A N ASP 451.A O no hydrogen 3.262 N/A GLN 460.A N ARG 457.A O no hydrogen 3.279 N/A THR 462.A N ALA 458.A O no hydrogen 3.011 N/A THR 462.A OG1 LEU 459.A O no hydrogen 2.489 N/A LEU 463.A N LEU 459.A O no hydrogen 2.910 N/A GLN 464.A N GLN 460.A O no hydrogen 2.920 N/A LEU 465.A N LYS 461.A O no hydrogen 2.966 N/A ILE 466.A N THR 462.A O no hydrogen 2.915 N/A GLU 467.A N LEU 463.A O no hydrogen 2.961 N/A THR 468.A N GLN 464.A O no hydrogen 2.934 N/A THR 468.A OG1 GLN 464.A O no hydrogen 3.138 N/A THR 468.A OG1 GLN 464.A OE1 no hydrogen 2.629 N/A THR 468.A OG1 GLU 467.A OE1 no hydrogen 3.241 N/A GLN 469.A N LEU 465.A O no hydrogen 2.887 N/A ILE 470.A N ILE 466.A O no hydrogen 3.142 N/A VAL 471.A N ILE 466.A O no hydrogen 3.031 N/A GLN 472.A N GLU 467.A O no hydrogen 2.848 N/A HIS 474.A N ILE 470.A O no hydrogen 2.828 N/A ARG 476.A NE GLN 472.A O no hydrogen 3.334 N/A ARG 476.A NE ASP 473.A O no hydrogen 3.053 N/A ARG 476.A NH1 ASP 480.A O no hydrogen 3.520 N/A ALA 481.A N LEU 478.A O no hydrogen 3.393 N/A HIS 485.A ND1 PRO 482.A O no hydrogen 3.138 N/A PHE 488.A N HIS 485.A O no hydrogen 2.826 N/A VAL 489.A N HIS 485.A O no hydrogen 2.788 N/A ARG 497.A N ILE 493.A O no hydrogen 2.883 N/A ARG 498.A N ALA 494.A O no hydrogen 2.953 N/A ASN 499.A ND2 TYR 273.A OH no hydrogen 2.559 N/A ALA 507.A N ALA 503.A O no hydrogen 2.935 N/A LEU 508.A N PRO 504.A O no hydrogen 2.965 N/A HIS 509.A N ARG 505.A O no hydrogen 2.941 N/A HIS 509.A ND1 TYR 534.A OH no hydrogen 2.703 N/A THR 510.A N ALA 506.A O no hydrogen 2.880 N/A ALA 511.A N ALA 507.A O no hydrogen 2.974 N/A LEU 512.A N LEU 508.A O no hydrogen 2.964 N/A ASN 513.A ND2 HIS 509.A NE2 no hydrogen 3.628 N/A ASN 514.A N THR 510.A O no hydrogen 3.365 N/A PHE 517.A N ASN 514.A O no hydrogen 3.137 N/A PHE 517.A N ASN 514.A OD1 no hydrogen 2.747 N/A TYR 518.A N PRO 515.A O no hydrogen 2.881 N/A TYR 518.A OH ALA 507.A O no hydrogen 3.407 N/A MET 519.A N PRO 515.A O no hydrogen 2.435 N/A GLN 520.A N HIS 516.A O no hydrogen 3.218 N/A LYS 522.A NZ GLN 520.A O no hydrogen 3.484 N/A CYS 524.A SG THR 526.A O no hydrogen 3.242 N/A CYS 524.A SG THR 526.A OG1 no hydrogen 3.078 N/A SER 531.A N PRO 528.A O no hydrogen 3.144 N/A TYR 534.A N LEU 530.A O no hydrogen 2.896 N/A TYR 534.A OH HIS 509.A ND1 no hydrogen 2.703 N/A LYS 535.A N SER 531.A O no hydrogen 2.882 N/A LEU 536.A N VAL 532.A O no hydrogen 2.874 N/A HIS 537.A N VAL 533.A O no hydrogen 2.947 N/A HIS 537.A ND1 VAL 533.A O no hydrogen 3.250 N/A LEU 538.A N TYR 534.A O no hydrogen 2.945 N/A GLU 539.A N LYS 535.A O no hydrogen 3.179 N/A CYS 540.A N LEU 536.A O no hydrogen 3.096 N/A CYS 540.A SG MET 543.A O no hydrogen 4.009 N/A ILE 544.A N ALA 587.A O no hydrogen 2.868 N/A TRP 549.A N ASN 545.A O no hydrogen 3.347 N/A LEU 550.A N LEU 546.A O no hydrogen 2.846 N/A GLN 551.A N PHE 547.A O no hydrogen 2.853 N/A ALA 552.A N ASP 548.A O no hydrogen 2.967 N/A PHE 553.A N TRP 549.A O no hydrogen 3.004 N/A ARG 554.A N LEU 550.A O no hydrogen 2.865 N/A SER 555.A N GLN 551.A O no hydrogen 2.906 N/A SER 555.A OG GLN 551.A O no hydrogen 2.936 N/A VAL 556.A N ALA 552.A O no hydrogen 3.015 N/A VAL 557.A N PHE 553.A O no hydrogen 3.348 N/A GLN 561.A N PRO 558.A O no hydrogen 3.083 N/A ARG 563.A N GLN 559.A O no hydrogen 2.939 N/A PHE 564.A N ILE 560.A O no hydrogen 2.909 N/A THR 565.A N GLN 561.A O no hydrogen 2.866 N/A THR 565.A OG1 GLN 561.A O no hydrogen 2.803 N/A ARG 566.A N ALA 562.A O no hydrogen 2.907 N/A ALA 567.A N ARG 563.A O no hydrogen 2.923 N/A VAL 568.A N PHE 564.A O no hydrogen 2.888 N/A ALA 569.A N THR 565.A O no hydrogen 2.915 N/A GLU 570.A N ARG 566.A O no hydrogen 2.972 N/A LEU 571.A N ALA 567.A O no hydrogen 2.825 N/A GLN 572.A N VAL 568.A O no hydrogen 2.899 N/A PHE 573.A N ALA 569.A O no hydrogen 2.961 N/A LEU 574.A N GLU 570.A O no hydrogen 3.212 N/A LEU 574.A N LEU 571.A O no hydrogen 2.977 N/A LYS 578.A N THR 588.A O no hydrogen 2.945 N/A SER 580.A N HIS 586.A O no hydrogen 3.112 N/A SER 580.A OG LYS 583.A O no hydrogen 2.289 N/A SER 580.A OG HIS 586.A O no hydrogen 2.752 N/A ALA 587.A N ILE 544.A O no hydrogen 3.021 N/A THR 588.A N LYS 578.A O no hydrogen 2.930 N/A THR 588.A OG1 ALA 587.A O no hydrogen 3.043 N/A ARG 589.A N ARG 542.A O no hydrogen 2.952 N/A LEU 590.A N TYR 576.A O no hydrogen 2.771 N/A