Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wsy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 6.A N ASN 531.A O no hydrogen 2.973 N/A GLY 9.A N GLN 529.A O no hydrogen 3.383 N/A LEU 13.A N TRP 525.A O no hydrogen 2.965 N/A HIS 17.A N ASP 15.A OD1 no hydrogen 2.754 N/A HIS 17.A ND1 ASP 15.A OD1 no hydrogen 2.764 N/A HIS 17.A ND1 ASP 15.A OD2 no hydrogen 2.876 N/A GLN 19.A N ARG 37.A O no hydrogen 3.096 N/A VAL 21.A N LEU 35.A O no hydrogen 2.828 N/A HIS 23.A N VAL 33.A O no hydrogen 2.643 N/A ALA 25.A N VAL 31.A O no hydrogen 3.056 N/A SER 29.A N GLY 26.A O no hydrogen 2.473 N/A SER 29.A OG GLY 26.A O no hydrogen 2.591 N/A ILE 32.A N SER 53.A O no hydrogen 3.233 N/A VAL 33.A N HIS 23.A O no hydrogen 2.640 N/A ALA 34.A N TYR 51.A O no hydrogen 2.790 N/A LEU 35.A N VAL 21.A O no hydrogen 2.857 N/A ALA 36.A N ASP 49.A O no hydrogen 2.721 N/A ARG 37.A N GLN 19.A O no hydrogen 3.021 N/A ARG 37.A NE ASP 38.A O no hydrogen 3.252 N/A ARG 37.A NH1 ALA 80.A O no hydrogen 3.138 N/A ARG 37.A NH2 GLN 19.A OE1 no hydrogen 2.514 N/A LYS 46.A N ASP 38.A OD2 no hydrogen 3.277 N/A SER 47.A N ASP 38.A OD2 no hydrogen 3.127 N/A SER 47.A OG HIS 17.A NE2 no hydrogen 2.704 N/A SER 47.A OG ASP 38.A OD2 no hydrogen 3.442 N/A ASP 49.A N ALA 36.A O no hydrogen 2.895 N/A VAL 50.A N SER 64.A OG no hydrogen 2.968 N/A TYR 51.A N ALA 34.A O no hydrogen 2.845 N/A TYR 51.A OH ASP 15.A OD2 no hydrogen 2.700 N/A VAL 52.A N LYS 61.A O no hydrogen 2.851 N/A SER 53.A N ILE 32.A O no hydrogen 2.977 N/A SER 53.A OG ASP 55.A OD1 no hydrogen 2.623 N/A SER 53.A OG SER 59.A O no hydrogen 3.279 N/A TYR 54.A OH PHE 108.A O no hydrogen 2.899 N/A ASP 55.A N SER 53.A OG no hydrogen 3.381 N/A TYR 56.A N ASN 30.A O no hydrogen 2.895 N/A TYR 56.A OH GLU 504.A OE1 no hydrogen 2.694 N/A TYR 56.A OH SER 509.A OG no hydrogen 3.231 N/A GLY 57.A N SER 53.A OG no hydrogen 2.903 N/A LYS 58.A N ASP 55.A O no hydrogen 3.361 N/A LYS 58.A N ASP 55.A OD1 no hydrogen 2.998 N/A SER 59.A N ASP 55.A OD1 no hydrogen 3.149 N/A SER 59.A OG ASP 55.A OD2 no hydrogen 2.306 N/A LYS 61.A N VAL 52.A O no hydrogen 2.691 N/A ILE 63.A N VAL 50.A O no hydrogen 2.847 N/A SER 64.A OG ASP 49.A OD1 no hydrogen 2.517 N/A LYS 66.A N ILE 63.A O no hydrogen 2.703 N/A LYS 66.A NZ ASN 110.A O no hydrogen 2.354 N/A LEU 67.A N SER 64.A O no hydrogen 3.045 N/A ASN 68.A ND2 ASP 65.A O no hydrogen 3.028 N/A GLY 70.A N ASN 68.A OD1 no hydrogen 2.869 N/A ASN 73.A N GLY 70.A O no hydrogen 3.184 N/A SER 75.A N ASN 73.A OD1 no hydrogen 2.699 N/A SER 75.A OG ASN 73.A OD1 no hydrogen 2.023 N/A VAL 78.A N ASP 96.A OD1 no hydrogen 2.802 N/A ILE 79.A N SER 48.A OG no hydrogen 2.725 N/A ALA 80.A N ALA 95.A O no hydrogen 3.130 N/A TYR 83.A N ILE 93.A O no hydrogen 2.824 N/A ALA 87.A N SER 85.A OG no hydrogen 3.098 N/A ASP 88.A N SER 85.A OG no hydrogen 3.205 N/A ARG 91.A NE ASP 88.A OD2 no hydrogen 2.816 N/A TYR 92.A N THR 105.A O no hydrogen 3.184 N/A TYR 92.A OH ASN 89.A O no hydrogen 2.989 N/A ILE 93.A N TYR 83.A O no hydrogen 3.021 N/A PHE 94.A N TRP 103.A O no hydrogen 2.913 N/A ALA 95.A N GLN 81.A O no hydrogen 3.256 N/A ASP 96.A N TYR 101.A O no hydrogen 3.288 N/A ALA 97.A N VAL 78.A O no hydrogen 2.568 N/A TYR 98.A N ASP 96.A OD2 no hydrogen 2.788 N/A TYR 98.A OH PRO 45.A O no hydrogen 2.750 N/A ALA 99.A N ASP 96.A OD2 no hydrogen 2.597 N/A TYR 101.A N ALA 99.A O no hydrogen 2.432 N/A LEU 102.A N PHE 115.A O no hydrogen 2.756 N/A TRP 103.A N PHE 94.A O no hydrogen 2.842 N/A TRP 103.A NE1 ASN 68.A O no hydrogen 3.076 N/A ILE 104.A N GLN 113.A O no hydrogen 2.973 N/A THR 105.A OG1 THR 111.A O no hydrogen 3.514 N/A PHE 108.A N LYS 90.A O no hydrogen 3.028 N/A ASN 110.A N ASP 107.A O no hydrogen 3.233 N/A THR 111.A N ASP 107.A OD1 no hydrogen 2.754 N/A THR 111.A N ASP 107.A OD2 no hydrogen 2.888 N/A THR 111.A OG1 ASP 107.A OD2 no hydrogen 2.116 N/A GLN 113.A N ILE 104.A O no hydrogen 2.905 N/A PHE 115.A N LEU 102.A O no hydrogen 2.989 N/A ILE 117.A N GLN 100.A O no hydrogen 2.724 N/A ARG 120.A NH1 SER 140.A OG no hydrogen 2.768 N/A ALA 122.A N ARG 120.A O no hydrogen 2.900 N/A ASP 123.A N PHE 137.A O no hydrogen 3.371 N/A LEU 125.A N LEU 135.A O no hydrogen 2.841 N/A HIS 127.A N LEU 133.A O no hydrogen 3.067 N/A LYS 129.A N HIS 127.A ND1 no hydrogen 2.982 N/A ALA 130.A N HIS 127.A ND1 no hydrogen 3.027 N/A ASN 132.A ND2 ASP 150.A O no hydrogen 2.964 N/A LEU 133.A N ALA 130.A O no hydrogen 2.833 N/A LEU 134.A N SER 149.A O no hydrogen 3.331 N/A LEU 135.A N LEU 125.A O no hydrogen 2.803 N/A GLY 136.A N TRP 147.A O no hydrogen 2.867 N/A PHE 137.A N ASP 123.A O no hydrogen 2.816 N/A ASP 138.A N GLN 145.A O no hydrogen 3.293 N/A SER 140.A OG ASP 138.A OD1 no hydrogen 3.339 N/A HIS 141.A N ASP 138.A O no hydrogen 3.280 N/A ASN 143.A N HIS 141.A ND1 no hydrogen 2.986 N/A ASN 143.A ND2 GLU 161.A OE2 no hydrogen 3.400 N/A LYS 144.A N HIS 141.A O no hydrogen 3.010 N/A LEU 146.A N GLN 160.A O no hydrogen 2.922 N/A TRP 147.A N GLY 136.A O no hydrogen 2.837 N/A LYS 148.A N ILE 157.A O no hydrogen 2.842 N/A SER 149.A N LEU 134.A O no hydrogen 3.073 N/A SER 149.A OG ASP 151.A OD1 no hydrogen 3.305 N/A SER 149.A OG THR 155.A O no hydrogen 3.099 N/A ASP 151.A N SER 149.A OG no hydrogen 3.343 N/A PHE 152.A N ASN 132.A O no hydrogen 2.719 N/A GLY 153.A N SER 149.A OG no hydrogen 2.667 N/A GLN 154.A N ASP 151.A OD1 no hydrogen 2.639 N/A GLN 154.A NE2 ASP 151.A O no hydrogen 3.247 N/A THR 155.A N ASP 151.A OD1 no hydrogen 2.944 N/A THR 155.A N ASP 151.A OD2 no hydrogen 3.253 N/A THR 155.A OG1 ASP 151.A OD2 no hydrogen 2.173 N/A TRP 156.A NE1 GLY 153.A O no hydrogen 3.059 N/A ILE 157.A N LYS 148.A O no hydrogen 2.841 N/A ILE 159.A N LEU 146.A O no hydrogen 2.796 N/A GLN 160.A N LEU 146.A O no hydrogen 3.448 N/A GLN 160.A NE2 GLU 161.A O no hydrogen 3.537 N/A HIS 162.A N ASN 143.A O no hydrogen 2.714 N/A VAL 163.A N LYS 144.A O no hydrogen 3.127 N/A LYS 164.A N GLU 182.A O no hydrogen 2.800 N/A LYS 164.A NZ GLU 182.A OE1 no hydrogen 3.018 N/A LYS 164.A NZ GLU 182.A OE2 no hydrogen 3.001 N/A LYS 164.A NZ ARG 213.A O no hydrogen 3.202 N/A SER 165.A N GLU 182.A O no hydrogen 3.414 N/A SER 165.A OG GLU 182.A OE2 no hydrogen 2.962 N/A SER 167.A N TYR 180.A O no hydrogen 3.030 N/A SER 167.A OG TRP 168.A O no hydrogen 3.278 N/A TRP 168.A NE1 LEU 125.A O no hydrogen 3.185 N/A GLY 169.A N THR 178.A O no hydrogen 2.828 N/A ILE 170.A N ASP 174.A OD2 no hydrogen 2.764 N/A ASP 174.A N ILE 170.A O no hydrogen 2.849 N/A THR 178.A OG1 LYS 175.A O no hydrogen 2.952 N/A ILE 179.A N SER 195.A O no hydrogen 2.988 N/A TYR 180.A N SER 167.A O no hydrogen 2.740 N/A TYR 180.A OH ASP 174.A OD1 no hydrogen 2.538 N/A ILE 181.A N PHE 193.A O no hydrogen 2.863 N/A GLU 182.A N SER 165.A O no hydrogen 2.901 N/A ARG 183.A N THR 191.A O no hydrogen 2.732 N/A HIS 184.A N HIS 162.A O no hydrogen 2.775 N/A GLU 185.A N TYR 189.A O no hydrogen 2.842 N/A SER 187.A OG GLU 211.A OE1 no hydrogen 2.348 N/A TYR 189.A N SER 187.A OG no hydrogen 3.192 N/A SER 190.A N VAL 212.A O no hydrogen 2.989 N/A THR 191.A N ARG 183.A O no hydrogen 2.811 N/A THR 191.A OG1 GLU 185.A OE2 no hydrogen 3.292 N/A VAL 192.A N LEU 209.A O no hydrogen 3.038 N/A PHE 193.A N ILE 181.A O no hydrogen 2.869 N/A ARG 194.A N GLU 206.A O no hydrogen 2.889 N/A ARG 194.A NE TYR 180.A OH no hydrogen 3.087 N/A ARG 194.A NH1 GLU 206.A OE1 no hydrogen 2.752 N/A SER 195.A N ILE 179.A O no hydrogen 3.092 N/A SER 195.A OG ASN 204.A O no hydrogen 3.480 N/A THR 196.A N ASN 204.A O no hydrogen 3.275 N/A ASP 197.A N SER 195.A OG no hydrogen 3.418 N/A PHE 199.A N SER 195.A OG no hydrogen 2.835 N/A GLN 200.A N ASP 197.A OD1 no hydrogen 3.006 N/A SER 201.A N ASP 197.A OD1 no hydrogen 3.482 N/A SER 201.A N ASP 197.A OD2 no hydrogen 3.155 N/A SER 201.A OG ASP 197.A OD2 no hydrogen 1.799 N/A GLU 203.A N GLU 203.A OE1 no hydrogen 3.077 N/A ASN 204.A ND2 ASP 197.A OD2 no hydrogen 3.191 N/A GLN 205.A N ARG 202.A O no hydrogen 3.355 N/A GLU 206.A N ARG 194.A O no hydrogen 2.794 N/A ILE 208.A N VAL 192.A O no hydrogen 2.761 N/A VAL 212.A N SER 190.A O no hydrogen 2.718 N/A ARG 213.A N THR 225.A O no hydrogen 2.688 N/A ARG 213.A NH2 ASN 262.A O no hydrogen 3.354 N/A GLN 216.A N PHE 223.A O no hydrogen 2.804 N/A ARG 218.A N TYR 221.A O no hydrogen 2.846 N/A LYS 220.A NZ ASP 272.A OD1 no hydrogen 2.591 N/A TYR 221.A N ARG 218.A O no hydrogen 3.174 N/A TYR 221.A OH ASP 272.A O no hydrogen 3.048 N/A MET 222.A N SER 244.A O no hydrogen 2.948 N/A PHE 223.A N GLN 216.A O no hydrogen 2.996 N/A ALA 224.A N TRP 242.A O no hydrogen 3.019 N/A THR 225.A N ASP 214.A O no hydrogen 3.434 N/A THR 225.A OG1 ASP 214.A OD1 no hydrogen 3.154 N/A LYS 226.A N GLN 240.A O no hydrogen 2.969 N/A LYS 226.A NZ GLU 210.A O no hydrogen 2.845 N/A LYS 226.A NZ GLU 211.A O no hydrogen 3.392 N/A VAL 228.A N SER 238.A O no hydrogen 2.759 N/A SER 238.A N VAL 228.A O no hydrogen 2.780 N/A GLN 240.A N LYS 226.A O no hydrogen 2.691 N/A TRP 242.A N ALA 224.A O no hydrogen 2.852 N/A VAL 243.A N ARG 251.A O no hydrogen 2.796 N/A SER 244.A N MET 222.A O no hydrogen 2.916 N/A SER 244.A OG LYS 248.A O no hydrogen 2.181 N/A GLY 246.A N LYS 220.A O no hydrogen 3.137 N/A ARG 247.A NE ASP 174.A OD1 no hydrogen 2.781 N/A ARG 247.A NH1 ASP 219.A O no hydrogen 2.828 N/A ARG 247.A NH2 ASP 174.A OD1 no hydrogen 2.647 N/A LYS 248.A N PHE 245.A O no hydrogen 3.337 N/A ARG 251.A N VAL 243.A O no hydrogen 3.004 N/A ALA 253.A N LEU 241.A O no hydrogen 2.827 N/A GLN 254.A N LEU 295.A O no hydrogen 3.462 N/A THR 257.A OG1 HIS 259.A O no hydrogen 2.446 N/A ASN 262.A N SER 279.A O no hydrogen 2.867 N/A GLU 263.A N SER 279.A O no hydrogen 3.209 N/A TYR 264.A OH VAL 239.A O no hydrogen 3.034 N/A TYR 265.A N CYS 277.A O no hydrogen 2.852 N/A ALA 267.A N PHE 275.A O no hydrogen 2.936 N/A ASP 268.A N PHE 275.A O no hydrogen 3.374 N/A SER 270.A N GLN 273.A O no hydrogen 2.985 N/A SER 270.A OG ASP 268.A OD1 no hydrogen 3.527 N/A SER 270.A OG ASP 268.A OD2 no hydrogen 3.040 N/A GLN 273.A N SER 270.A O no hydrogen 3.236 N/A GLN 273.A NE2 SER 290.A O no hydrogen 3.521 N/A PHE 275.A N ASP 268.A O no hydrogen 2.819 N/A VAL 276.A N TYR 288.A O no hydrogen 3.022 N/A CYS 277.A N TYR 265.A O no hydrogen 2.707 N/A VAL 278.A N ASN 286.A O no hydrogen 2.925 N/A SER 279.A N GLU 263.A O no hydrogen 3.039 N/A HIS 280.A N ARG 284.A O no hydrogen 2.944 N/A HIS 280.A ND1 PRO 260.A O no hydrogen 3.188 N/A ASN 282.A ND2 HIS 259.A ND1 no hydrogen 3.574 N/A ASN 283.A N HIS 280.A O no hydrogen 3.009 N/A ARG 284.A N ASN 282.A OD1 no hydrogen 2.800 N/A ASN 286.A N VAL 278.A O no hydrogen 3.003 N/A LEU 287.A N LEU 301.A O no hydrogen 2.747 N/A TYR 288.A N VAL 276.A O no hydrogen 2.812 N/A ILE 289.A N SER 298.A O no hydrogen 3.086 N/A SER 290.A N VAL 274.A O no hydrogen 2.690 N/A SER 290.A OG GLU 291.A O no hydrogen 2.702 N/A SER 290.A OG GLY 294.A O no hydrogen 2.826 N/A GLU 291.A N LYS 296.A O no hydrogen 3.072 N/A GLU 293.A N ASP 272.A O no hydrogen 2.685 N/A GLY 294.A N GLU 291.A O no hydrogen 3.332 N/A SER 298.A N ILE 289.A O no hydrogen 3.234 N/A SER 300.A N LEU 287.A O no hydrogen 2.673 N/A SER 300.A OG GLY 362.A O no hydrogen 2.529 N/A LEU 301.A N LEU 287.A O no hydrogen 3.228 N/A ASN 303.A N ASN 286.A OD1 no hydrogen 3.137 N/A VAL 304.A N THR 285.A O no hydrogen 2.889 N/A LEU 305.A N THR 342.A O no hydrogen 2.768 N/A TYR 307.A N PHE 326.A O no hydrogen 2.973 N/A TYR 307.A OH ALA 322.A O no hydrogen 2.848 N/A SER 308.A N ALA 312.A O no hydrogen 2.910 N/A SER 308.A OG GLU 263.A OE1 no hydrogen 3.220 N/A SER 308.A OG GLU 263.A OE2 no hydrogen 2.890 N/A GLY 311.A N SER 308.A OG no hydrogen 3.364 N/A SER 314.A OG PRO 309.A O no hydrogen 2.863 N/A THR 316.A N GLY 313.A O no hydrogen 3.069 N/A THR 316.A OG1 GLY 313.A O no hydrogen 2.651 N/A ARG 319.A N THR 316.A O no hydrogen 3.243 N/A ARG 319.A NH1 SER 314.A O no hydrogen 2.971 N/A TYR 320.A N LEU 317.A O no hydrogen 2.798 N/A PHE 321.A N VAL 318.A O no hydrogen 2.722 N/A PHE 326.A N TYR 307.A O no hydrogen 3.093 N/A ASP 328.A N LEU 305.A O no hydrogen 3.235 N/A HIS 330.A N ILE 340.A O no hydrogen 2.810 N/A HIS 330.A NE2 SER 411.A OG no hydrogen 2.991 N/A ARG 331.A NH1 TYR 339.A OH no hydrogen 3.180 N/A VAL 332.A N VAL 338.A O no hydrogen 3.189 N/A GLU 333.A N SER 411.A OG no hydrogen 3.168 N/A TYR 339.A N THR 358.A O no hydrogen 3.179 N/A TYR 339.A OH ASP 268.A OD2 no hydrogen 2.875 N/A ILE 340.A N HIS 330.A O no hydrogen 2.976 N/A ALA 341.A N VAL 356.A O no hydrogen 2.879 N/A THR 342.A N ASP 328.A O no hydrogen 2.992 N/A LEU 343.A N ARG 354.A O no hydrogen 2.737 N/A ILE 344.A N ASN 303.A O no hydrogen 2.859 N/A ASN 345.A N ASN 352.A O no hydrogen 2.973 N/A ASN 349.A N SER 347.A O no hydrogen 2.912 N/A ASN 352.A N ASN 349.A O no hydrogen 2.734 N/A ASN 352.A ND2 SER 347.A O no hydrogen 2.587 N/A MET 353.A N GLU 350.A O no hydrogen 2.982 N/A ARG 354.A N LEU 343.A O no hydrogen 3.200 N/A SER 355.A N HIS 391.A ND1 no hydrogen 3.074 N/A SER 355.A OG LEU 392.A O no hydrogen 3.277 N/A VAL 356.A N ALA 341.A O no hydrogen 2.856 N/A ILE 357.A N GLU 366.A O no hydrogen 2.727 N/A THR 358.A N TYR 339.A O no hydrogen 3.075 N/A THR 358.A OG1 THR 364.A O no hydrogen 2.506 N/A ASP 360.A N THR 358.A OG1 no hydrogen 3.308 N/A LYS 361.A N GLY 337.A O no hydrogen 2.925 N/A LYS 361.A NZ SER 270.A O no hydrogen 2.305 N/A GLY 362.A N THR 358.A OG1 no hydrogen 3.193 N/A GLY 363.A N ASP 360.A O no hydrogen 3.381 N/A THR 364.A N ASP 360.A OD1 no hydrogen 3.105 N/A THR 364.A OG1 ASP 360.A OD1 no hydrogen 3.236 N/A THR 364.A OG1 ASP 360.A OD2 no hydrogen 2.787 N/A TRP 365.A NE1 SER 300.A OG no hydrogen 3.023 N/A GLU 366.A N ILE 357.A O no hydrogen 2.859 N/A THR 374.A N GLU 378.A O no hydrogen 2.761 N/A GLY 375.A N GLU 447.A OE2 no hydrogen 3.159 N/A GLY 377.A N THR 374.A OG1 no hydrogen 3.276 N/A LYS 379.A NZ ALA 372.A O no hydrogen 2.868 N/A LYS 379.A NZ ILE 380.A O no hydrogen 3.136 N/A ILE 380.A N ALA 372.A O no hydrogen 2.746 N/A GLN 386.A N GLU 383.A O no hydrogen 2.955 N/A GLY 387.A N LEU 384.A O no hydrogen 2.678 N/A CYS 388.A N GLU 383.A O no hydrogen 3.062 N/A SER 389.A N GLY 426.A O no hydrogen 3.006 N/A LEU 390.A N LEU 368.A O no hydrogen 2.793 N/A HIS 391.A N SER 424.A O no hydrogen 2.933 N/A HIS 391.A NE2 GLY 426.A O no hydrogen 2.941 N/A LEU 392.A N SER 355.A OG no hydrogen 3.132 N/A ALA 393.A N THR 422.A O no hydrogen 2.754 N/A GLN 394.A NE2 ILE 340.A O no hydrogen 3.250 N/A LEU 396.A N ASP 328.A OD1 no hydrogen 2.840 N/A SER 397.A N ASP 328.A OD2 no hydrogen 2.938 N/A SER 397.A OG ASP 328.A OD2 no hydrogen 2.826 N/A GLN 398.A N GLN 394.A O no hydrogen 2.954 N/A GLN 398.A NE2 MET 407.A O no hydrogen 3.429 N/A LEU 399.A N ARG 395.A O no hydrogen 2.572 N/A LEU 400.A N LEU 396.A O no hydrogen 2.894 N/A ASN 401.A N SER 397.A O no hydrogen 3.496 N/A LEU 402.A N LEU 399.A O no hydrogen 2.919 N/A GLN 403.A N GLN 398.A O no hydrogen 3.129 N/A LEU 410.A N ILE 420.A O no hydrogen 2.746 N/A SER 411.A OG HIS 330.A NE2 no hydrogen 2.991 N/A GLU 413.A N GLU 333.A OE2 no hydrogen 3.201 N/A SER 414.A OG GLU 507.A OE1 no hydrogen 2.146 N/A ALA 415.A N LYS 412.A O no hydrogen 3.012 N/A LEU 418.A N ALA 415.A O no hydrogen 2.995 N/A ILE 419.A N SER 438.A O no hydrogen 2.843 N/A ILE 420.A N LEU 410.A O no hydrogen 3.052 N/A ALA 421.A N TYR 436.A O no hydrogen 2.967 N/A GLY 423.A N ASN 434.A O no hydrogen 2.927 N/A SER 424.A N HIS 391.A O no hydrogen 2.792 N/A SER 424.A OG SER 431.A O no hydrogen 3.110 N/A SER 424.A OG LYS 432.A O no hydrogen 2.803 N/A GLY 426.A N SER 389.A O no hydrogen 3.046 N/A LEU 429.A N MET 353.A O no hydrogen 3.209 N/A ALA 430.A N ASN 428.A OD1 no hydrogen 2.995 N/A SER 431.A OG VAL 425.A O no hydrogen 3.033 N/A ASN 434.A N GLY 423.A O no hydrogen 2.762 N/A ASN 434.A ND2 PRO 450.A O no hydrogen 2.089 N/A VAL 435.A N LEU 449.A O no hydrogen 2.918 N/A TYR 436.A N ALA 421.A O no hydrogen 2.830 N/A TYR 436.A OH ASN 434.A OD1 no hydrogen 2.905 N/A ILE 437.A N ARG 446.A O no hydrogen 3.077 N/A SER 438.A N ILE 419.A O no hydrogen 2.999 N/A SER 438.A OG SER 440.A OG no hydrogen 2.784 N/A SER 438.A OG ARG 444.A O no hydrogen 2.838 N/A SER 439.A OG GLU 482.A OE1 no hydrogen 2.998 N/A SER 439.A OG GLU 482.A OE2 no hydrogen 3.456 N/A SER 440.A N SER 438.A OG no hydrogen 2.932 N/A SER 440.A OG SER 438.A OG no hydrogen 2.784 N/A ALA 441.A N GLY 417.A O no hydrogen 3.005 N/A GLY 442.A N SER 438.A OG no hydrogen 3.007 N/A ALA 443.A N SER 440.A O no hydrogen 3.027 N/A ARG 444.A N SER 440.A OG no hydrogen 2.938 N/A ARG 444.A NH1 GLU 553.A OE1 no hydrogen 2.775 N/A ARG 444.A NH2 GLU 553.A OE1 no hydrogen 3.147 N/A ARG 444.A NH2 GLU 553.A OE2 no hydrogen 3.519 N/A ARG 446.A N ILE 437.A O no hydrogen 2.878 N/A ALA 448.A N VAL 435.A O no hydrogen 2.744 N/A LEU 449.A N VAL 435.A O no hydrogen 3.363 N/A HIS 453.A ND1 GLY 451.A O no hydrogen 3.046 N/A TYR 454.A N ILE 467.A O no hydrogen 2.927 N/A TYR 454.A OH VAL 498.A O no hydrogen 2.827 N/A TYR 455.A OH PRO 408.A O no hydrogen 3.091 N/A THR 456.A N THR 465.A O no hydrogen 2.983 N/A GLY 458.A N ILE 463.A O no hydrogen 2.747 N/A HIS 460.A N GLU 507.A O no hydrogen 2.962 N/A GLY 461.A N GLY 458.A O no hydrogen 3.121 N/A GLY 462.A N ASP 459.A O no hydrogen 3.127 N/A ILE 463.A N GLY 458.A O no hydrogen 3.197 N/A ILE 464.A N SER 479.A O no hydrogen 2.835 N/A THR 465.A N THR 456.A O no hydrogen 2.844 N/A THR 465.A OG1 THR 456.A O no hydrogen 3.549 N/A ALA 466.A N LYS 477.A O no hydrogen 3.033 N/A ILE 467.A N TYR 454.A O no hydrogen 2.937 N/A GLN 469.A N PRO 452.A O no hydrogen 3.045 N/A GLN 469.A NE2 ARG 405.A O no hydrogen 2.706 N/A GLU 472.A N GLU 472.A OE1 no hydrogen 2.738 N/A THR 473.A N VAL 496.A O no hydrogen 2.809 N/A ASN 474.A ND2 SER 492.A O no hydrogen 2.979 N/A ASN 474.A ND2 GLU 493.A O no hydrogen 3.355 N/A GLU 475.A N THR 473.A OG1 no hydrogen 3.005 N/A LEU 476.A N PHE 489.A O no hydrogen 2.844 N/A LYS 477.A N ALA 466.A O no hydrogen 2.956 N/A LYS 477.A NZ HIS 453.A NE2 no hydrogen 3.263 N/A TYR 478.A N LYS 487.A O no hydrogen 2.867 N/A SER 479.A N ILE 464.A O no hydrogen 2.858 N/A SER 479.A OG ASN 481.A OD1 no hydrogen 2.582 N/A SER 479.A OG THR 485.A O no hydrogen 3.035 N/A ASN 481.A N SER 479.A OG no hydrogen 3.071 N/A ASN 481.A ND2 THR 485.A OG1 no hydrogen 2.714 N/A GLY 483.A N SER 479.A OG no hydrogen 2.846 N/A GLU 484.A N ASN 481.A O no hydrogen 3.298 N/A THR 485.A N ASN 481.A OD1 no hydrogen 3.259 N/A TRP 486.A NE1 GLY 483.A O no hydrogen 2.903 N/A LYS 487.A N TYR 478.A O no hydrogen 2.971 N/A PHE 489.A N LEU 476.A O no hydrogen 2.884 N/A PHE 491.A N ASN 474.A O no hydrogen 2.802 N/A LYS 494.A NZ GLU 520.A OE2 no hydrogen 3.453 N/A VAL 496.A N THR 473.A O no hydrogen 2.875 N/A PHE 497.A N SER 517.A O no hydrogen 2.784 N/A TYR 499.A N PHE 515.A O no hydrogen 2.703 N/A TYR 499.A OH HIS 523.A ND1 no hydrogen 2.742 N/A GLY 500.A N PHE 515.A O no hydrogen 3.351 N/A LEU 502.A N THR 513.A O no hydrogen 2.827 N/A THR 503.A OG1 VAL 511.A O no hydrogen 3.521 N/A GLY 506.A N GLU 507.A OE2 no hydrogen 3.066 N/A GLU 507.A N GLU 504.A O no hydrogen 3.083 N/A SER 509.A OG TYR 56.A OH no hydrogen 3.231 N/A THR 510.A OG1 ASN 531.A OD1 no hydrogen 3.268 N/A THR 510.A OG1 THR 533.A OG1 no hydrogen 2.722 N/A PHE 512.A N VAL 530.A O no hydrogen 2.910 N/A THR 513.A N LEU 502.A O no hydrogen 2.683 N/A THR 513.A OG1 GLN 529.A OE1 no hydrogen 2.717 N/A ILE 514.A N LEU 528.A O no hydrogen 2.943 N/A PHE 515.A N GLY 500.A O no hydrogen 2.990 N/A GLY 516.A N LEU 526.A O no hydrogen 2.761 N/A SER 517.A N PHE 497.A O no hydrogen 2.924 N/A SER 517.A OG SER 524.A O no hydrogen 2.500 N/A HIS 523.A ND1 TYR 499.A OH no hydrogen 2.742 N/A SER 524.A N SER 517.A OG no hydrogen 2.693 N/A SER 524.A OG ASP 15.A O no hydrogen 3.362 N/A TRP 525.A N ASP 15.A O no hydrogen 2.788 N/A TRP 525.A NE1 HIS 17.A O no hydrogen 2.755 N/A ILE 527.A N VAL 11.A O no hydrogen 2.766 N/A LEU 528.A N ILE 514.A O no hydrogen 2.774 N/A GLN 529.A N GLY 9.A O no hydrogen 2.962 N/A GLN 529.A NE2 TYR 56.A O no hydrogen 2.609 N/A ASN 531.A N LYS 6.A O no hydrogen 2.822 N/A ALA 532.A N THR 510.A O no hydrogen 2.944 N/A THR 533.A N ASN 531.A OD1 no hydrogen 2.826 N/A THR 533.A OG1 THR 510.A OG1 no hydrogen 2.722 N/A THR 533.A OG1 ASN 531.A OD1 no hydrogen 2.966 N/A ALA 535.A N ALA 532.A O no hydrogen 3.160 N/A LEU 536.A N THR 533.A O no hydrogen 2.760 N/A GLY 537.A N THR 533.A O no hydrogen 2.876 N/A VAL 538.A N LEU 536.A O no hydrogen 2.917 N/A CYS 540.A N PHE 576.A O no hydrogen 3.316 N/A CYS 540.A SG ASN 577.A OD1 no hydrogen 3.785 N/A THR 541.A N ASP 544.A OD2 no hydrogen 2.938 N/A ASP 544.A N THR 541.A O no hydrogen 2.726 N/A TYR 545.A N GLU 542.A O no hydrogen 3.291 N/A TYR 545.A OH ASN 577.A OD1 no hydrogen 2.139 N/A LYS 546.A N ARG 568.A O no hydrogen 3.035 N/A TRP 548.A N PHE 566.A O no hydrogen 2.947 N/A TRP 548.A NE1 GLU 553.A OE2 no hydrogen 3.002 N/A SER 549.A N ASP 552.A OD2 no hydrogen 3.023 N/A SER 549.A OG THR 564.A O no hydrogen 2.669 N/A SER 551.A N SER 549.A OG no hydrogen 3.257 N/A SER 551.A OG GLU 557.A O no hydrogen 2.925 N/A ASP 552.A N SER 549.A O no hydrogen 2.878 N/A GLU 553.A N PRO 550.A O no hydrogen 2.798 N/A ARG 554.A N PRO 550.A O no hydrogen 3.373 N/A ARG 554.A NE GLU 557.A O no hydrogen 2.948 N/A ASN 556.A N SER 551.A O no hydrogen 2.665 N/A GLU 557.A N ARG 554.A O no hydrogen 3.131 N/A LEU 559.A N HIS 562.A O no hydrogen 2.983 N/A HIS 562.A N LEU 559.A O no hydrogen 3.138 N/A HIS 562.A ND1 LEU 560.A O no hydrogen 3.011 N/A HIS 562.A NE2 GLN 336.A OE1 no hydrogen 3.330 N/A LYS 563.A N SER 588.A O no hydrogen 2.992 N/A VAL 565.A N VAL 586.A O no hydrogen 2.730 N/A PHE 566.A N TRP 548.A O no hydrogen 2.721 N/A LYS 567.A N PRO 584.A O no hydrogen 3.130 N/A LYS 567.A NZ GLU 542.A OE1 no hydrogen 3.489 N/A LYS 567.A NZ GLU 542.A OE2 no hydrogen 3.171 N/A ARG 568.A N LYS 546.A O no hydrogen 3.037 N/A ARG 568.A NH1 PRO 416.A O no hydrogen 3.003 N/A ARG 568.A NH1 SER 439.A O no hydrogen 2.932 N/A ARG 568.A NH2 SER 439.A O no hydrogen 3.087 N/A ARG 569.A NH2 THR 480.A O no hydrogen 3.249 N/A THR 570.A N ASP 544.A O no hydrogen 2.794 N/A THR 570.A OG1 ASP 544.A O no hydrogen 3.511 N/A HIS 572.A NE2 GLU 484.A OE1 no hydrogen 3.004 N/A THR 574.A OG1 HIS 572.A O no hydrogen 3.524 N/A CYS 575.A SG ASP 544.A OD2 no hydrogen 3.289 N/A PHE 576.A N VAL 538.A O no hydrogen 2.689 N/A ASN 577.A N ASP 459.A OD2 no hydrogen 3.069 N/A ASN 577.A ND2 ASP 459.A O no hydrogen 3.483 N/A GLY 578.A N ASP 459.A OD1 no hydrogen 3.017 N/A PHE 581.A N GLY 578.A O no hydrogen 2.795 N/A ARG 583.A NE LYS 567.A O no hydrogen 2.978 N/A ARG 583.A NH2 LYS 567.A O no hydrogen 3.362 N/A VAL 586.A N VAL 565.A O no hydrogen 2.903 N/A SER 588.A N LYS 563.A O no hydrogen 2.942 N/A CYS 590.A N GLY 561.A O no hydrogen 3.278 N/A CYS 592.A N GLY 647.A O no hydrogen 2.744 N/A THR 593.A N ASP 596.A OD2 no hydrogen 2.880 N/A THR 593.A OG1 GLU 595.A OE1 no hydrogen 3.408 N/A ARG 594.A NH1 ARG 594.A O no hydrogen 2.899 N/A ARG 594.A NH1 TYR 597.A O no hydrogen 3.251 N/A ASP 596.A N THR 593.A O no hydrogen 3.085 N/A TYR 597.A N ARG 594.A O no hydrogen 3.069 N/A GLU 598.A N ARG 638.A O no hydrogen 2.854 N/A ASP 600.A N GLY 636.A O no hydrogen 2.925 N/A PHE 601.A N ASP 600.A OD1 no hydrogen 2.776 N/A PHE 603.A N ASP 600.A O no hydrogen 2.898 N/A LYS 604.A N VAL 615.A O no hydrogen 2.962 N/A SER 606.A OG ASP 608.A OD1 no hydrogen 1.821 N/A CYS 614.A N TYR 637.A OH no hydrogen 1.520 N/A CYS 614.A SG GLY 636.A O no hydrogen 3.650 N/A VAL 615.A N LYS 604.A O no hydrogen 2.860 N/A ASP 617.A N GLY 602.A O no hydrogen 3.045 N/A GLU 619.A N ASP 617.A OD1 no hydrogen 2.843 N/A ARG 632.A NE GLY 656.A O no hydrogen 2.522 N/A ARG 632.A NH2 GLY 656.A O no hydrogen 3.238 N/A ARG 635.A NH1 GLU 655.A O no hydrogen 1.922 N/A ARG 638.A N GLU 598.A O no hydrogen 2.827 N/A LYS 639.A NZ CYS 645.A O no hydrogen 2.851 N/A LYS 639.A NZ GLU 651.A OE2 no hydrogen 3.269 N/A ILE 640.A N ASP 596.A O no hydrogen 2.993 N/A ASP 643.A N ILE 640.A O no hydrogen 3.084 N/A THR 644.A N LEU 560.A O no hydrogen 2.885 N/A THR 644.A OG1 LEU 560.A O no hydrogen 3.515 N/A THR 644.A OG1 HIS 562.A ND1 no hydrogen 3.089 N/A THR 644.A OG1 ASN 589.A OD1 no hydrogen 2.912 N/A CYS 645.A N ASP 643.A OD1 no hydrogen 2.622 N/A CYS 645.A SG CYS 590.A O no hydrogen 3.475 N/A CYS 645.A SG ASP 596.A OD2 no hydrogen 3.433 N/A SER 646.A N CYS 590.A O no hydrogen 3.235 N/A ALA 652.A N GLY 648.A O no hydrogen 3.134 N/A ARG 653.A N ASP 649.A O no hydrogen 2.974 N/A LEU 654.A N VAL 650.A O no hydrogen 3.083 N/A GLU 655.A N GLU 651.A O no hydrogen 3.275 N/A VAL 659.A N TYR 631.A O no hydrogen 3.248 N/A CYS 661.A SG PRO 628.A O no hydrogen 3.095 N/A CYS 661.A SG SER 629.A O no hydrogen 3.312 N/A