Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6t3b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A NE2 GLU 469.A OE2 no hydrogen 3.179 N/A ARG 7.A N GLN 3.A O no hydrogen 3.389 N/A GLN 8.A N ALA 4.A O no hydrogen 3.261 N/A LEU 9.A N PHE 5.A O no hydrogen 3.098 N/A THR 10.A N GLN 6.A O no hydrogen 2.842 N/A THR 10.A OG1 GLN 6.A O no hydrogen 2.717 N/A THR 10.A OG1 ASP 16.A OD1 no hydrogen 3.487 N/A ALA 11.A N ARG 7.A O no hydrogen 3.253 N/A ILE 13.A N LEU 9.A O no hydrogen 2.777 N/A GLY 14.A N THR 10.A O no hydrogen 2.997 N/A THR 18.A OG1 ASP 16.A OD1 no hydrogen 2.736 N/A THR 18.A OG1 ASP 16.A OD2 no hydrogen 3.239 N/A ASP 19.A N ASP 16.A O no hydrogen 3.256 N/A SER 21.A OG ASP 19.A OD2 no hydrogen 2.830 N/A ASN 22.A ND2 THR 269.A O no hydrogen 2.794 N/A PHE 30.A N ASP 26.A O no hydrogen 2.850 N/A THR 31.A N GLU 27.A O no hydrogen 3.143 N/A THR 31.A OG1 GLU 27.A O no hydrogen 2.931 N/A THR 31.A OG1 LEU 28.A O no hydrogen 2.883 N/A ARG 32.A N LEU 28.A O no hydrogen 3.028 N/A ARG 33.A N GLU 29.A O no hydrogen 3.185 N/A GLY 34.A N PHE 30.A O no hydrogen 2.939 N/A LEU 35.A N THR 31.A O no hydrogen 3.028 N/A MET 40.A N VAL 36.A O no hydrogen 2.963 N/A ALA 41.A N THR 37.A O no hydrogen 2.913 N/A GLU 42.A N PRO 38.A O no hydrogen 3.335 N/A VAL 43.A N ARG 39.A O no hydrogen 3.097 N/A ALA 44.A N MET 40.A O no hydrogen 3.123 N/A SER 45.A N ALA 41.A O no hydrogen 3.357 N/A SER 45.A OG ALA 41.A O no hydrogen 2.858 N/A SER 45.A OG GLU 42.A O no hydrogen 3.279 N/A SER 45.A OG GLU 42.A OE2 no hydrogen 3.494 N/A ARG 46.A N GLU 42.A O no hydrogen 2.956 N/A ARG 46.A NH1 LEU 437.A O no hydrogen 2.875 N/A ARG 46.A NH1 GLY 474.A O no hydrogen 2.922 N/A ARG 46.A NH2 GLY 474.A O no hydrogen 2.892 N/A LEU 50.A N ASP 47.A OD2 no hydrogen 2.811 N/A TYR 51.A N ASP 47.A O no hydrogen 3.159 N/A TYR 51.A OH CYS 475.A O no hydrogen 2.725 N/A ALA 52.A N PRO 48.A O no hydrogen 3.252 N/A MET 53.A N LYS 49.A O no hydrogen 3.371 N/A HIS 54.A NE2 ASP 110.A O no hydrogen 2.837 N/A THR 58.A N ASN 121.A O no hydrogen 2.894 N/A THR 58.A OG1 GLU 403.A OE1 no hydrogen 3.497 N/A THR 58.A OG1 ASP 405.A OD2 no hydrogen 3.361 N/A SER 59.A N GLU 403.A OE1 no hydrogen 3.324 N/A SER 59.A N GLU 403.A OE2 no hydrogen 3.109 N/A SER 59.A OG GLU 403.A OE1 no hydrogen 3.124 N/A SER 59.A OG GLU 403.A OE2 no hydrogen 3.030 N/A LYS 60.A N THR 58.A OG1 no hydrogen 3.252 N/A LYS 60.A NZ THR 58.A OG1 no hydrogen 3.370 N/A LYS 60.A NZ GLU 403.A OE1 no hydrogen 3.144 N/A LYS 60.A NZ ASP 405.A OD2 no hydrogen 2.898 N/A LYS 60.A NZ ASP 406.A OD2 no hydrogen 2.814 N/A LEU 66.A N PRO 63.A O no hydrogen 3.250 N/A TRP 67.A N PRO 63.A O no hydrogen 3.266 N/A LYS 69.A NZ LEU 129.A O no hydrogen 3.009 N/A LYS 69.A NZ LYS 130.A O no hydrogen 3.328 N/A ILE 70.A N TRP 67.A O no hydrogen 3.250 N/A CYS 74.A SG ALA 71.A O no hydrogen 3.643 N/A CYS 74.A SG ASN 72.A O no hydrogen 3.654 N/A ILE 75.A N VAL 89.A O no hydrogen 2.810 N/A ILE 77.A N ILE 87.A O no hydrogen 3.022 N/A VAL 78.A N ILE 135.A O no hydrogen 3.138 N/A ILE 79.A N GLN 85.A O no hydrogen 3.179 N/A HIS 80.A N VAL 137.A O no hydrogen 2.894 N/A HIS 80.A ND1 VAL 137.A O no hydrogen 2.796 N/A ARG 81.A N THR 83.A O no hydrogen 2.814 N/A ARG 81.A NH2 LEU 139.A O no hydrogen 3.451 N/A GLN 85.A N ILE 79.A O no hydrogen 3.097 N/A ILE 87.A N ILE 77.A O no hydrogen 2.806 N/A VAL 89.A N ILE 75.A O no hydrogen 2.828 N/A SER 90.A N ASP 93.A OD2 no hydrogen 3.312 N/A ASP 93.A N SER 90.A O no hydrogen 3.277 N/A ALA 97.A N THR 94.A O no hydrogen 3.082 N/A ILE 98.A N THR 94.A O no hydrogen 3.452 N/A LEU 99.A N PRO 95.A O no hydrogen 2.850 N/A GLN 100.A N GLY 96.A O no hydrogen 2.972 N/A VAL 103.A N ASP 140.A O no hydrogen 2.799 N/A ARG 105.A N VAL 138.A O no hydrogen 3.204 N/A ARG 105.A NE ASP 140.A OD2 no hydrogen 2.932 N/A ARG 105.A NH1 ARG 109.A O no hydrogen 2.800 N/A ARG 105.A NH2 ASP 140.A OD2 no hydrogen 3.205 N/A ARG 105.A NH2 THR 567.A OG1 no hydrogen 2.961 N/A VAL 106.A N GLU 111.A O no hydrogen 2.899 N/A CYS 107.A N HIS 136.A O no hydrogen 3.264 N/A CYS 107.A SG HIS 80.A ND1 no hydrogen 3.568 N/A ARG 109.A N VAL 106.A O no hydrogen 3.242 N/A ARG 109.A NH1 ASP 534.A OD1 no hydrogen 2.878 N/A ARG 109.A NH2 ASP 534.A OD1 no hydrogen 3.253 N/A ASP 110.A N GLY 536.A O no hydrogen 3.008 N/A LEU 113.A N LEU 104.A O no hydrogen 2.807 N/A ILE 119.A N ASP 93.A O no hydrogen 3.182 N/A LYS 120.A N PRO 91.A O no hydrogen 3.329 N/A ASN 121.A N PRO 118.A O no hydrogen 3.070 N/A PHE 122.A N ILE 119.A O no hydrogen 3.088 N/A GLN 123.A N TRP 56.A O no hydrogen 3.075 N/A ARG 126.A N PHE 122.A O no hydrogen 3.322 N/A ARG 126.A NE LYS 120.A O no hydrogen 2.762 N/A ARG 126.A NH1 PRO 61.A O no hydrogen 2.856 N/A ARG 126.A NH2 LYS 60.A O no hydrogen 2.801 N/A ARG 126.A NH2 LYS 120.A O no hydrogen 3.443 N/A HIS 127.A N GLN 123.A O no hydrogen 3.162 N/A CYS 128.A N TRP 124.A O no hydrogen 3.045 N/A CYS 128.A SG TRP 124.A O no hydrogen 3.325 N/A LEU 129.A N VAL 125.A O no hydrogen 3.050 N/A LYS 130.A N ARG 126.A O no hydrogen 3.319 N/A LYS 130.A NZ GLU 598.A OE2 no hydrogen 3.317 N/A ASN 131.A N HIS 127.A O no hydrogen 3.337 N/A ASN 131.A ND2 HIS 127.A O no hydrogen 3.234 N/A GLU 133.A N CYS 128.A O no hydrogen 2.782 N/A HIS 136.A ND1 GLU 134.A O no hydrogen 3.341 N/A VAL 137.A N VAL 78.A O no hydrogen 2.959 N/A VAL 138.A N ARG 105.A O no hydrogen 2.768 N/A LEU 139.A N HIS 80.A O no hydrogen 3.031 N/A ASP 140.A N VAL 103.A O no hydrogen 2.847 N/A THR 141.A N ASP 140.A OD1 no hydrogen 2.814 N/A ALA 146.A N ASP 144.A OD1 no hydrogen 3.440 N/A LEU 147.A N ASP 144.A O no hydrogen 3.256 N/A ASP 148.A N PRO 145.A O no hydrogen 3.062 N/A LEU 155.A N ALA 291.A O no hydrogen 2.807 N/A TRP 156.A N SER 154.A OG no hydrogen 3.324 N/A ASP 157.A N SER 154.A O no hydrogen 3.419 N/A CYS 158.A N LEU 155.A O no hydrogen 3.270 N/A CYS 158.A SG SER 154.A O no hydrogen 3.666 N/A PHE 162.A N ILE 212.A O no hydrogen 2.859 N/A ARG 163.A NE ASP 284.A OD1 no hydrogen 3.345 N/A ARG 163.A NH2 ASP 284.A OD1 no hydrogen 3.341 N/A VAL 164.A N LEU 208.A O no hydrogen 3.268 N/A ILE 166.A N VAL 206.A O no hydrogen 3.226 N/A ARG 167.A N SER 280.A O no hydrogen 2.846 N/A ARG 167.A NE GLU 250.A OE1 no hydrogen 3.005 N/A ILE 169.A N VAL 202.A O no hydrogen 3.082 N/A ASP 170.A N SER 278.A O no hydrogen 3.434 N/A ILE 171.A N GLU 200.A O no hydrogen 2.945 N/A VAL 175.A N LYS 196.A O no hydrogen 2.912 N/A PHE 176.A N TYR 228.A O no hydrogen 3.322 N/A VAL 177.A N THR 193.A OG1 no hydrogen 2.803 N/A GLU 178.A N GLN 226.A O no hydrogen 2.783 N/A ALA 179.A N ARG 191.A O no hydrogen 2.881 N/A ASN 180.A N ASN 224.A O no hydrogen 2.825 N/A ASN 180.A ND2 GLU 178.A OE1 no hydrogen 3.509 N/A ASN 180.A ND2 ASN 224.A OD1 no hydrogen 3.380 N/A ILE 181.A N CYS 189.A O no hydrogen 3.218 N/A GLN 182.A N LEU 222.A O no hydrogen 2.823 N/A HIS 183.A N GLN 186.A O no hydrogen 3.022 N/A LEU 188.A N ILE 181.A O no hydrogen 2.805 N/A GLN 190.A NE2 ASN 180.A OD1 no hydrogen 3.483 N/A ARG 191.A N ALA 179.A O no hydrogen 3.081 N/A ARG 191.A NH1 GLU 209.A O no hydrogen 2.812 N/A THR 193.A N VAL 177.A O no hydrogen 3.122 N/A THR 193.A OG1 VAL 177.A O no hydrogen 3.551 N/A LYS 196.A N VAL 175.A O no hydrogen 3.163 N/A LYS 196.A NZ LEU 203.A O no hydrogen 2.819 N/A THR 199.A OG1 GLU 201.A O no hydrogen 3.110 N/A VAL 202.A N ILE 169.A O no hydrogen 3.330 N/A TRP 204.A N ARG 167.A O no hydrogen 2.973 N/A TRP 204.A NE1 SER 194.A O no hydrogen 2.808 N/A ASN 205.A N ARG 167.A O no hydrogen 3.329 N/A LEU 208.A N VAL 164.A O no hydrogen 2.905 N/A PHE 210.A N PHE 162.A O no hydrogen 2.823 N/A LYS 213.A NZ SER 211.A O no hydrogen 3.461 N/A ILE 214.A N ARG 160.A O no hydrogen 2.985 N/A LYS 215.A N CYS 158.A O no hydrogen 3.225 N/A LYS 215.A NZ TRP 156.A O no hydrogen 2.790 N/A LEU 217.A N ILE 214.A O no hydrogen 3.207 N/A LYS 219.A NZ GLU 389.A OE2 no hydrogen 2.795 N/A LEU 222.A N GLN 182.A O no hydrogen 2.813 N/A LEU 223.A N LEU 237.A O no hydrogen 2.801 N/A ASN 224.A N ASN 180.A O no hydrogen 2.818 N/A ASN 224.A ND2 ASN 236.A OD1 no hydrogen 3.453 N/A LEU 225.A N VAL 235.A O no hydrogen 2.819 N/A GLN 226.A N GLU 178.A O no hydrogen 2.984 N/A ILE 227.A N TYR 233.A O no hydrogen 2.799 N/A TYR 228.A N PHE 176.A O no hydrogen 3.324 N/A CYS 229.A N GLN 230.A O no hydrogen 3.044 N/A CYS 229.A SG GLN 230.A O no hydrogen 3.368 N/A LEU 232.A N ILE 227.A O no hydrogen 2.815 N/A TYR 234.A N TRP 256.A O no hydrogen 2.925 N/A TYR 234.A OH ASP 263.A O no hydrogen 3.334 N/A TYR 234.A OH HIS 459.A NE2 no hydrogen 3.140 N/A VAL 235.A N LEU 225.A O no hydrogen 2.983 N/A ASN 236.A ND2 LYS 264.A O no hydrogen 2.815 N/A ASN 236.A ND2 THR 266.A O no hydrogen 3.689 N/A LEU 237.A N LEU 223.A O no hydrogen 3.261 N/A LEU 239.A N ALA 221.A O no hydrogen 2.940 N/A ASP 241.A N LEU 245.A O no hydrogen 2.866 N/A ARG 243.A N ASP 241.A OD1 no hydrogen 2.853 N/A ARG 243.A NE ASP 26.A OD1 no hydrogen 3.481 N/A ARG 243.A NH2 ASP 26.A OD1 no hydrogen 3.318 N/A ARG 243.A NH2 ASP 26.A OD2 no hydrogen 2.814 N/A PHE 244.A N ASP 241.A O no hydrogen 3.069 N/A LEU 245.A N ASP 241.A OD1 no hydrogen 3.211 N/A LEU 246.A N ILE 290.A O no hydrogen 3.085 N/A ARG 247.A N LEU 239.A O no hydrogen 2.880 N/A ARG 247.A NE LEU 238.A O no hydrogen 2.801 N/A ARG 247.A NH1 ASP 25.A OD2 no hydrogen 3.292 N/A ARG 247.A NH2 ASP 25.A OD2 no hydrogen 2.838 N/A GLY 249.A N LEU 283.A O no hydrogen 3.250 N/A TYR 251.A N ILE 281.A O no hydrogen 3.058 N/A TYR 251.A OH ARG 248.A O no hydrogen 3.277 N/A LEU 253.A N ILE 279.A O no hydrogen 3.149 N/A MET 255.A N MET 277.A O no hydrogen 2.750 N/A TRP 256.A N TYR 234.A O no hydrogen 2.801 N/A TRP 256.A NE1 ALA 268.A O no hydrogen 2.916 N/A ILE 258.A N LEU 232.A O no hydrogen 2.880 N/A SER 259.A OG ILE 258.A O no hydrogen 2.761 N/A PHE 260.A N GLN 185.A OE1 no hydrogen 3.117 N/A ALA 262.A N MET 758.A O no hydrogen 3.097 N/A LYS 264.A N ASN 261.A O no hydrogen 3.374 N/A LYS 264.A NZ TYR 234.A OH no hydrogen 3.165 N/A THR 266.A OG1 HIS 459.A O no hydrogen 2.668 N/A ALA 268.A N THR 266.A OG1 no hydrogen 3.368 N/A THR 269.A OG1 HIS 254.A O no hydrogen 2.719 N/A ASN 270.A N HIS 254.A O no hydrogen 3.039 N/A ASN 270.A ND2 MET 255.A O no hydrogen 2.809 N/A ASP 272.A N ASN 270.A OD1 no hydrogen 3.110 N/A LYS 273.A N PRO 271.A O no hydrogen 2.976 N/A LYS 273.A NZ SER 21.A O no hydrogen 3.168 N/A SER 276.A N ASP 272.A O no hydrogen 3.112 N/A SER 276.A OG HIS 254.A ND1 no hydrogen 3.335 N/A SER 276.A OG ASP 272.A O no hydrogen 2.717 N/A SER 278.A N ASP 170.A O no hydrogen 3.096 N/A SER 278.A OG ASP 170.A O no hydrogen 3.372 N/A SER 280.A N GLY 168.A O no hydrogen 3.191 N/A ILE 281.A N TYR 251.A O no hydrogen 3.152 N/A LEU 282.A N LYS 165.A O no hydrogen 3.336 N/A LEU 283.A N GLY 249.A O no hydrogen 3.269 N/A ALA 291.A N VAL 153.A O no hydrogen 2.822 N/A LEU 292.A N PHE 244.A O no hydrogen 2.786 N/A LYS 294.A NZ LEU 292.A O no hydrogen 3.547 N/A ARG 303.A N PRO 299.A O no hydrogen 3.047 N/A LYS 304.A N ASN 300.A O no hydrogen 3.233 N/A GLN 305.A N GLN 301.A O no hydrogen 3.207 N/A LEU 306.A N LEU 302.A O no hydrogen 3.007 N/A GLU 307.A N ARG 303.A O no hydrogen 2.867 N/A ALA 308.A N LYS 304.A O no hydrogen 3.316 N/A ILE 309.A N GLN 305.A O no hydrogen 3.358 N/A ILE 310.A N LEU 306.A O no hydrogen 3.248 N/A ALA 311.A N GLU 307.A O no hydrogen 3.227 N/A THR 312.A N ILE 309.A O no hydrogen 3.244 N/A THR 312.A OG1 ILE 309.A O no hydrogen 2.708 N/A ASN 316.A N ASP 313.A OD1 no hydrogen 2.772 N/A THR 319.A OG1 ASP 322.A OD1 no hydrogen 3.036 N/A ASP 322.A N THR 319.A OG1 no hydrogen 3.410 N/A LYS 323.A N THR 319.A O no hydrogen 2.895 N/A GLU 324.A N ALA 320.A O no hydrogen 2.999 N/A LEU 325.A N GLU 321.A O no hydrogen 3.184 N/A LEU 326.A N ASP 322.A O no hydrogen 3.176 N/A TRP 327.A N LYS 323.A O no hydrogen 3.126 N/A HIS 328.A N GLU 324.A O no hydrogen 2.984 N/A PHE 329.A N LEU 325.A O no hydrogen 3.228 N/A ARG 330.A NH1 TRP 327.A O no hydrogen 3.129 N/A SER 333.A N PHE 329.A O no hydrogen 2.981 N/A SER 333.A OG LEU 326.A O no hydrogen 3.485 N/A SER 333.A OG PHE 329.A O no hydrogen 2.975 N/A LEU 334.A N ARG 330.A O no hydrogen 2.903 N/A LYS 335.A NZ GLU 332.A OE2 no hydrogen 3.191 N/A HIS 336.A N SER 333.A O no hydrogen 3.314 N/A LYS 338.A NZ ASP 374.A OD2 no hydrogen 2.810 N/A TYR 340.A N PRO 337.A O no hydrogen 3.463 N/A TYR 340.A OH LEU 334.A O no hydrogen 3.076 N/A LYS 342.A NZ THR 312.A OG1 no hydrogen 2.831 N/A LYS 342.A NZ ASP 313.A O no hydrogen 3.334 N/A LEU 343.A N ALA 339.A O no hydrogen 2.797 N/A PHE 344.A N TYR 340.A O no hydrogen 2.931 N/A SER 345.A OG PRO 341.A O no hydrogen 2.724 N/A SER 346.A N LEU 343.A O no hydrogen 3.012 N/A SER 346.A OG LYS 342.A O no hydrogen 2.791 N/A GLN 352.A N ASP 216.A OD1 no hydrogen 3.416 N/A ILE 354.A N GLN 351.A O no hydrogen 3.214 N/A VAL 355.A N GLN 351.A O no hydrogen 3.112 N/A ALA 356.A N GLN 352.A O no hydrogen 3.244 N/A LYS 357.A N GLU 353.A O no hydrogen 3.329 N/A THR 358.A N ILE 354.A O no hydrogen 3.084 N/A THR 358.A N VAL 355.A O no hydrogen 3.230 N/A THR 358.A OG1 ILE 354.A O no hydrogen 2.752 N/A TYR 359.A N VAL 355.A O no hydrogen 3.207 N/A TYR 359.A N ALA 356.A O no hydrogen 3.170 N/A TYR 359.A OH ASP 388.A OD1 no hydrogen 2.721 N/A GLN 360.A N ALA 356.A O no hydrogen 3.183 N/A LEU 361.A N LYS 357.A O no hydrogen 3.242 N/A LEU 362.A N THR 358.A O no hydrogen 3.057 N/A ALA 363.A N TYR 359.A O no hydrogen 3.123 N/A ARG 364.A N LEU 361.A O no hydrogen 3.161 N/A TRP 368.A NE1 ILE 394.A O no hydrogen 2.803 N/A ASP 369.A N ARG 365.A O no hydrogen 2.954 N/A SER 371.A N VAL 367.A O no hydrogen 3.092 N/A SER 371.A OG TRP 368.A O no hydrogen 2.732 N/A LEU 377.A N ASP 374.A OD1 no hydrogen 3.080 N/A THR 378.A N ASP 374.A O no hydrogen 2.912 N/A THR 378.A OG1 ASP 374.A O no hydrogen 2.724 N/A MET 379.A N VAL 375.A O no hydrogen 2.888 N/A GLN 380.A N GLY 376.A O no hydrogen 3.071 N/A GLN 380.A NE2 GLY 376.A O no hydrogen 3.632 N/A LEU 382.A N MET 379.A O no hydrogen 3.020 N/A ASN 385.A N ASP 383.A OD1 no hydrogen 3.130 N/A PHE 386.A N ASP 383.A O no hydrogen 3.217 N/A ASN 390.A N ASP 388.A OD2 no hydrogen 3.180 N/A VAL 391.A N ASP 388.A O no hydrogen 3.209 N/A VAL 391.A N ASP 388.A OD2 no hydrogen 3.139 N/A ARG 392.A N ASP 388.A O no hydrogen 3.051 N/A ARG 392.A NH1 LEU 382.A O no hydrogen 2.791 N/A ARG 392.A NH1 ALA 417.A O no hydrogen 3.273 N/A ARG 392.A NH2 LEU 382.A O no hydrogen 3.084 N/A ARG 392.A NH2 PHE 386.A O no hydrogen 2.816 N/A ALA 393.A N GLU 389.A O no hydrogen 3.089 N/A ALA 395.A N ARG 392.A O no hydrogen 3.237 N/A VAL 396.A N ARG 392.A O no hydrogen 3.232 N/A GLN 397.A N ALA 393.A O no hydrogen 3.113 N/A LYS 398.A N ALA 395.A O no hydrogen 3.055 N/A LYS 398.A NZ TRP 368.A O no hydrogen 2.801 N/A LYS 398.A NZ SER 371.A O no hydrogen 2.812 N/A LYS 398.A NZ SER 371.A OG no hydrogen 3.389 N/A LEU 399.A N ALA 395.A O no hydrogen 3.323 N/A SER 401.A N LYS 398.A O no hydrogen 3.307 N/A LEU 402.A N LEU 399.A O no hydrogen 3.303 N/A VAL 407.A N GLU 403.A O no hydrogen 3.010 N/A LEU 408.A N ASP 404.A O no hydrogen 3.159 N/A HIS 409.A ND1 ASP 405.A O no hydrogen 2.778 N/A LEU 414.A N TYR 410.A O no hydrogen 2.824 N/A VAL 415.A N LEU 411.A O no hydrogen 3.015 N/A GLN 416.A N LEU 412.A O no hydrogen 3.110 N/A GLN 416.A NE2 GLU 453.A OE2 no hydrogen 2.809 N/A ALA 417.A N GLN 413.A O no hydrogen 2.956 N/A LYS 419.A N GLN 416.A O no hydrogen 3.085 N/A LYS 419.A NZ GLN 416.A OE1 no hydrogen 3.109 N/A LYS 419.A NZ GLU 453.A OE1 no hydrogen 2.939 N/A LYS 419.A NZ THR 759.A O no hydrogen 3.240 N/A PHE 420.A N ALA 417.A O no hydrogen 3.187 N/A GLU 421.A N VAL 418.A O no hydrogen 2.949 N/A TYR 423.A OH ILE 240.A O no hydrogen 2.721 N/A SER 426.A OG HIS 424.A O no hydrogen 3.220 N/A ARG 430.A N SER 426.A O no hydrogen 2.943 N/A ARG 430.A NE ASP 425.A OD1 no hydrogen 2.782 N/A ARG 430.A NH2 ASP 425.A OD2 no hydrogen 3.098 N/A PHE 431.A N ALA 427.A O no hydrogen 2.871 N/A LEU 432.A N LEU 428.A O no hydrogen 2.940 N/A LEU 433.A N ALA 429.A O no hydrogen 3.206 N/A LYS 434.A N ARG 430.A O no hydrogen 3.209 N/A ARG 435.A N PHE 431.A O no hydrogen 3.064 N/A ARG 435.A NH1 LEU 402.A O no hydrogen 2.820 N/A ARG 435.A NH2 LEU 402.A O no hydrogen 2.924 N/A ARG 435.A NH2 ASP 404.A OD1 no hydrogen 3.081 N/A GLY 436.A N LEU 432.A O no hydrogen 3.053 N/A LEU 437.A N LEU 433.A O no hydrogen 2.875 N/A ARG 438.A NE GLU 42.A OE2 no hydrogen 3.491 N/A LYS 440.A NZ ASP 148.A OD1 no hydrogen 2.816 N/A ILE 442.A N ASN 439.A OD1 no hydrogen 3.275 N/A GLY 443.A N ASN 439.A O no hydrogen 3.013 N/A HIS 444.A N LYS 440.A O no hydrogen 2.912 N/A HIS 444.A NE2 PRO 532.A O no hydrogen 2.780 N/A PHE 445.A N ARG 441.A O no hydrogen 3.198 N/A LEU 446.A N ILE 442.A O no hydrogen 2.821 N/A PHE 447.A N GLY 443.A O no hydrogen 2.925 N/A TRP 448.A N HIS 444.A O no hydrogen 3.307 N/A TRP 448.A NE1 GLN 486.A OE1 no hydrogen 2.782 N/A PHE 449.A N PHE 445.A O no hydrogen 2.786 N/A LEU 450.A N LEU 446.A O no hydrogen 2.868 N/A ARG 451.A N PHE 447.A O no hydrogen 2.775 N/A ARG 451.A NE LEU 12.A O no hydrogen 2.789 N/A ARG 451.A NH2 ALA 11.A O no hydrogen 3.466 N/A ARG 451.A NH2 GLU 491.A OE2 no hydrogen 3.329 N/A SER 452.A N TRP 448.A O no hydrogen 3.086 N/A SER 452.A OG SER 617.A O no hydrogen 3.394 N/A ILE 454.A N LEU 450.A O no hydrogen 3.074 N/A ALA 455.A N ARG 451.A O no hydrogen 3.184 N/A HIS 459.A NE2 TYR 234.A OH no hydrogen 3.140 N/A TYR 460.A N SER 457.A OG no hydrogen 3.203 N/A TYR 460.A OH ALA 262.A O no hydrogen 2.711 N/A TYR 460.A OH LYS 419.A O no hydrogen 2.796 N/A GLN 461.A NE2 ILE 454.A O no hydrogen 2.901 N/A GLN 461.A NE2 SER 457.A O no hydrogen 3.639 N/A GLN 462.A NE2 ASN 22.A O no hydrogen 3.594 N/A ARG 463.A NE HIS 424.A ND1 no hydrogen 2.878 N/A ARG 463.A NH1 VAL 418.A O no hydrogen 3.206 N/A ARG 463.A NH1 GLU 421.A O no hydrogen 2.796 N/A PHE 464.A N TYR 460.A O no hydrogen 3.042 N/A ALA 465.A N GLN 461.A O no hydrogen 2.933 N/A LEU 468.A N PHE 464.A O no hydrogen 2.957 N/A GLU 469.A N ALA 465.A O no hydrogen 2.921 N/A ALA 470.A N VAL 466.A O no hydrogen 3.259 N/A TYR 471.A N ILE 467.A O no hydrogen 3.021 N/A LEU 472.A N LEU 468.A O no hydrogen 2.815 N/A ARG 473.A N GLU 469.A O no hydrogen 3.035 N/A ARG 473.A NH2 GLU 469.A OE2 no hydrogen 3.390 N/A GLY 474.A N TYR 471.A O no hydrogen 2.964 N/A CYS 475.A SG LEU 472.A O no hydrogen 3.579 N/A CYS 475.A SG GLY 476.A O no hydrogen 3.933 N/A THR 477.A N GLU 149.A O no hydrogen 3.353 N/A THR 477.A OG1 GLU 149.A O no hydrogen 2.738 N/A LEU 480.A N GLY 476.A O no hydrogen 3.076 N/A HIS 481.A N THR 477.A O no hydrogen 3.015 N/A ASP 482.A N ALA 478.A O no hydrogen 3.174 N/A PHE 483.A N MET 479.A O no hydrogen 2.806 N/A THR 484.A N HIS 481.A O no hydrogen 3.207 N/A THR 484.A OG1 LEU 480.A O no hydrogen 2.723 N/A GLN 485.A N HIS 481.A O no hydrogen 3.174 N/A GLN 486.A N ASP 482.A O no hydrogen 3.038 N/A GLN 486.A NE2 ASP 482.A O no hydrogen 3.372 N/A VAL 487.A N PHE 483.A O no hydrogen 3.063 N/A GLN 488.A N THR 484.A O no hydrogen 2.882 N/A ILE 490.A N GLN 486.A O no hydrogen 2.908 N/A GLU 491.A N VAL 487.A O no hydrogen 2.867 N/A MET 492.A N GLN 488.A O no hydrogen 3.181 N/A LEU 493.A N VAL 489.A O no hydrogen 2.879 N/A GLN 494.A N ILE 490.A O no hydrogen 3.029 N/A LYS 495.A N GLU 491.A O no hydrogen 3.294 N/A THR 497.A N LEU 493.A O no hydrogen 3.158 N/A THR 497.A OG1 LEU 493.A O no hydrogen 2.863 N/A LEU 498.A N GLN 494.A O no hydrogen 3.264 N/A ASP 499.A N LYS 495.A O no hydrogen 3.090 N/A ILE 500.A N VAL 496.A O no hydrogen 2.886 N/A LYS 501.A N THR 497.A O no hydrogen 3.166 N/A LYS 501.A NZ HIS 580.A O no hydrogen 2.947 N/A SER 502.A N LEU 498.A O no hydrogen 3.313 N/A SER 502.A OG LEU 498.A O no hydrogen 3.428 N/A SER 502.A OG ASP 499.A O no hydrogen 2.713 N/A LEU 503.A N ILE 500.A O no hydrogen 3.245 N/A SER 504.A N LYS 501.A O no hydrogen 3.431 N/A SER 504.A OG ILE 500.A O no hydrogen 3.397 N/A ILE 510.A N SER 506.A O no hydrogen 3.497 N/A SER 511.A N SER 507.A O no hydrogen 3.391 N/A GLN 512.A N GLN 508.A O no hydrogen 3.085 N/A LEU 513.A N VAL 509.A O no hydrogen 2.913 N/A LYS 514.A N ILE 510.A O no hydrogen 3.157 N/A LYS 514.A NZ GLU 545.A O no hydrogen 3.386 N/A LYS 516.A N GLN 512.A O no hydrogen 2.939 N/A LYS 516.A NZ ASP 499.A OD2 no hydrogen 3.069 N/A LEU 517.A N LEU 513.A O no hydrogen 3.151 N/A GLN 521.A N LEU 517.A O no hydrogen 2.864 N/A ASN 522.A N GLU 518.A O no hydrogen 3.426 N/A SER 523.A OG ASN 519.A O no hydrogen 2.728 N/A PHE 529.A N ALA 539.A O no hydrogen 2.805 N/A ARG 530.A NE ASP 482.A OD2 no hydrogen 2.804 N/A ARG 530.A NH1 PRO 535.A O no hydrogen 3.423 N/A VAL 531.A N LEU 537.A O no hydrogen 3.165 N/A ASP 534.A N VAL 531.A O no hydrogen 3.082 N/A LEU 537.A N ASP 534.A O no hydrogen 3.074 N/A ALA 539.A N PHE 529.A O no hydrogen 2.816 N/A GLY 540.A N LYS 562.A O no hydrogen 2.752 N/A ALA 543.A N GLU 560.A O no hydrogen 2.773 N/A GLU 545.A N GLU 545.A OE1 no hydrogen 2.789 N/A LYS 546.A N ALA 543.A O no hydrogen 2.896 N/A CYS 547.A SG ALA 543.A O no hydrogen 3.287 N/A CYS 547.A SG GLU 560.A O no hydrogen 3.974 N/A LYS 548.A N TRP 558.A O no hydrogen 2.890 N/A MET 550.A N PRO 556.A O no hydrogen 3.059 N/A LYS 553.A N SER 552.A OG no hydrogen 2.805 N/A LYS 555.A NZ SER 552.A O no hydrogen 3.486 N/A LEU 557.A N PHE 578.A O no hydrogen 2.818 N/A TRP 558.A N LYS 548.A O no hydrogen 2.812 N/A TRP 558.A NE1 GLU 560.A OE2 no hydrogen 2.813 N/A LEU 559.A N ILE 576.A O no hydrogen 2.957 N/A PHE 561.A N ILE 574.A O no hydrogen 2.828 N/A LYS 562.A N ALA 541.A O no hydrogen 2.804 N/A CYS 563.A SG LYS 538.A O no hydrogen 3.360 N/A ALA 564.A N LYS 538.A O no hydrogen 3.133 N/A THR 567.A N ASP 565.A OD1 no hydrogen 3.406 N/A THR 567.A OG1 ASP 565.A OD1 no hydrogen 2.712 N/A GLU 572.A N SER 570.A OG no hydrogen 3.117 N/A THR 573.A OG1 GLU 560.A OE1 no hydrogen 2.722 N/A ILE 574.A N PHE 561.A O no hydrogen 2.795 N/A ILE 576.A N LEU 559.A O no hydrogen 2.871 N/A ILE 577.A N ILE 625.A O no hydrogen 2.896 N/A PHE 578.A N LEU 557.A O no hydrogen 3.083 N/A LYS 579.A N GLY 623.A O no hydrogen 3.068 N/A LYS 579.A NZ ASP 701.A OD1 no hydrogen 2.956 N/A GLY 581.A N LYS 621.A O no hydrogen 3.098 N/A ARG 585.A NH1 GLU 453.A OE2 no hydrogen 3.409 N/A GLN 586.A NE2 GLY 760.A O no hydrogen 3.620 N/A MET 588.A N LEU 584.A O no hydrogen 2.803 N/A LEU 589.A N ARG 585.A O no hydrogen 3.260 N/A ILE 590.A N GLN 586.A O no hydrogen 3.128 N/A LEU 591.A N ASP 587.A O no hydrogen 3.143 N/A GLN 592.A N MET 588.A O no hydrogen 3.180 N/A GLN 592.A N LEU 589.A O no hydrogen 3.203 N/A GLN 592.A NE2 HIS 409.A O no hydrogen 2.867 N/A ILE 593.A N LEU 589.A O no hydrogen 3.132 N/A LEU 594.A N ILE 590.A O no hydrogen 2.930 N/A ARG 595.A N LEU 591.A O no hydrogen 3.116 N/A ARG 595.A NH2 TYR 613.A O no hydrogen 3.129 N/A ILE 596.A N GLN 592.A O no hydrogen 3.018 N/A MET 597.A N ILE 593.A O no hydrogen 2.804 N/A GLU 598.A N LEU 594.A O no hydrogen 3.147 N/A SER 599.A N ARG 595.A O no hydrogen 3.298 N/A SER 599.A OG ILE 596.A O no hydrogen 2.707 N/A ILE 600.A N ILE 596.A O no hydrogen 2.814 N/A TRP 601.A N MET 597.A O no hydrogen 3.005 N/A TRP 601.A NE1 ALA 738.A O no hydrogen 2.812 N/A GLU 602.A N GLU 598.A O no hydrogen 2.935 N/A THR 603.A N SER 599.A O no hydrogen 3.259 N/A THR 603.A OG1 ILE 600.A O no hydrogen 2.718 N/A SER 605.A N GLU 602.A O no hydrogen 3.061 N/A SER 605.A OG GLU 64.A OE2 no hydrogen 3.338 N/A LEU 606.A N TRP 601.A O no hydrogen 2.785 N/A CYS 609.A SG ASP 607.A O no hydrogen 4.041 N/A LEU 611.A N TYR 672.A OH no hydrogen 2.809 N/A TYR 613.A N LEU 611.A O no hydrogen 3.031 N/A GLY 614.A N GLU 626.A OE2 no hydrogen 2.804 N/A CYS 615.A SG MET 624.A O no hydrogen 4.006 N/A ILE 616.A N MET 624.A O no hydrogen 3.109 N/A THR 618.A N ILE 622.A O no hydrogen 3.118 N/A THR 618.A OG1 ILE 622.A O no hydrogen 3.033 N/A GLY 619.A N ILE 622.A O no hydrogen 2.811 N/A ILE 622.A N GLY 619.A O no hydrogen 3.436 N/A GLY 623.A N LYS 579.A O no hydrogen 3.302 N/A MET 624.A N ILE 616.A O no hydrogen 3.076 N/A ILE 625.A N ILE 577.A O no hydrogen 2.802 N/A GLU 626.A N GLY 614.A O no hydrogen 2.882 N/A ILE 627.A N GLY 575.A O no hydrogen 3.107 N/A LYS 629.A NZ THR 573.A O no hydrogen 2.810 N/A LYS 629.A NZ THR 573.A OG1 no hydrogen 3.339 N/A THR 632.A N ILE 691.A O no hydrogen 2.979 N/A ILE 634.A N ILE 689.A O no hydrogen 3.146 N/A ILE 637.A N THR 633.A O no hydrogen 3.400 N/A GLN 638.A N ILE 634.A O no hydrogen 3.214 N/A GLN 639.A N ALA 635.A O no hydrogen 2.939 N/A GLU 642.A N GLU 642.A OE1 no hydrogen 2.916 N/A HIS 646.A N GLU 642.A O no hydrogen 2.972 N/A HIS 646.A ND1 GLU 642.A O no hydrogen 2.814 N/A LEU 648.A N LEU 644.A O no hydrogen 3.362 N/A LYS 649.A N ASN 645.A O no hydrogen 3.287 N/A LYS 649.A NZ GLU 655.A OE2 no hydrogen 3.085 N/A GLU 650.A N HIS 646.A O no hydrogen 3.040 N/A LYS 651.A N TRP 647.A O no hydrogen 3.026 N/A SER 652.A OG LEU 648.A O no hydrogen 2.732 N/A LYS 657.A N THR 654.A O no hydrogen 3.032 N/A PHE 658.A N THR 654.A O no hydrogen 3.125 N/A GLN 659.A N GLU 655.A O no hydrogen 3.051 N/A ALA 661.A N LYS 657.A O no hydrogen 2.854 N/A VAL 662.A N PHE 658.A O no hydrogen 3.107 N/A ARG 664.A N ALA 660.A O no hydrogen 2.842 N/A PHE 665.A N ALA 661.A O no hydrogen 2.908 N/A VAL 666.A N VAL 662.A O no hydrogen 3.025 N/A TYR 667.A N GLU 663.A O no hydrogen 3.297 N/A SER 668.A N ARG 664.A O no hydrogen 3.293 N/A SER 668.A OG ARG 664.A O no hydrogen 2.730 N/A SER 668.A OG PHE 665.A O no hydrogen 3.180 N/A CYS 669.A N PHE 665.A O no hydrogen 2.811 N/A ALA 670.A N VAL 666.A O no hydrogen 3.253 N/A GLY 671.A N TYR 667.A O no hydrogen 2.980 N/A TYR 672.A N SER 668.A O no hydrogen 3.213 N/A CYS 673.A N CYS 669.A O no hydrogen 2.919 N/A CYS 673.A SG CYS 669.A O no hydrogen 3.204 N/A CYS 673.A SG VAL 710.A O no hydrogen 3.922 N/A VAL 674.A N ALA 670.A O no hydrogen 3.117 N/A ALA 675.A N GLY 671.A O no hydrogen 3.193 N/A THR 676.A N TYR 672.A O no hydrogen 3.078 N/A THR 676.A OG1 TYR 672.A O no hydrogen 2.681 N/A VAL 678.A N VAL 674.A O no hydrogen 3.158 N/A LEU 679.A N ALA 675.A O no hydrogen 3.308 N/A GLY 680.A N PHE 677.A O no hydrogen 3.351 N/A ILE 681.A N THR 676.A O no hydrogen 2.799 N/A ARG 684.A N GLY 682.A O no hydrogen 3.013 N/A ARG 684.A NH2 ASN 688.A OD1 no hydrogen 2.926 N/A ASP 687.A N HIS 685.A ND1 no hydrogen 3.255 N/A ASN 688.A N HIS 685.A O no hydrogen 2.824 N/A ILE 689.A N ASN 686.A O no hydrogen 3.335 N/A MET 690.A N PHE 698.A O no hydrogen 2.775 N/A ILE 691.A N THR 632.A O no hydrogen 2.924 N/A THR 692.A N ASN 696.A O no hydrogen 2.787 N/A THR 692.A OG1 THR 694.A OG1 no hydrogen 3.342 N/A THR 692.A OG1 ASN 696.A O no hydrogen 3.270 N/A GLU 693.A N ASP 630.A O no hydrogen 2.784 N/A THR 694.A OG1 THR 692.A OG1 no hydrogen 3.342 N/A GLY 695.A N THR 692.A O no hydrogen 2.942 N/A ASN 696.A N THR 692.A OG1 no hydrogen 2.921 N/A ASN 696.A ND2 CYS 609.A O no hydrogen 3.429 N/A LEU 697.A N SER 668.A OG no hydrogen 3.003 N/A PHE 698.A N MET 690.A O no hydrogen 2.797 N/A ILE 700.A N ASN 688.A O no hydrogen 2.802 N/A PHE 702.A N ASP 587.A OD2 no hydrogen 2.798 N/A HIS 704.A N PHE 702.A O no hydrogen 2.802 N/A ARG 706.A NE ASP 683.A OD2 no hydrogen 2.828 N/A THR 712.A OG1 ASP 714.A OD1 no hydrogen 2.692 N/A PHE 715.A N THR 712.A O no hydrogen 2.920 N/A LEU 716.A N THR 712.A O no hydrogen 3.316 N/A PHE 717.A N PRO 713.A O no hydrogen 3.304 N/A VAL 718.A N PHE 715.A O no hydrogen 3.102 N/A MET 719.A N PHE 715.A O no hydrogen 3.336 N/A THR 721.A N LEU 716.A O no hydrogen 2.832 N/A SER 725.A OG MET 719.A O no hydrogen 2.738 N/A SER 725.A OG GLY 720.A O no hydrogen 3.340 N/A GLN 729.A N SER 725.A O no hydrogen 2.868 N/A LYS 730.A N PRO 726.A O no hydrogen 3.403 N/A PHE 731.A N HIS 727.A O no hydrogen 2.954 N/A GLN 732.A N PHE 728.A O no hydrogen 3.028 N/A ASP 733.A N GLN 729.A O no hydrogen 2.912 N/A ILE 734.A N LYS 730.A O no hydrogen 3.232 N/A CYS 735.A N PHE 731.A O no hydrogen 2.986 N/A CYS 735.A SG ALA 670.A O no hydrogen 4.045 N/A VAL 736.A N GLN 732.A O no hydrogen 2.995 N/A LYS 737.A N ASP 733.A O no hydrogen 3.030 N/A LYS 737.A NZ ASP 733.A OD1 no hydrogen 2.812 N/A LYS 737.A NZ ASP 733.A OD2 no hydrogen 3.320 N/A ALA 738.A N ILE 734.A O no hydrogen 2.856 N/A TYR 739.A N CYS 735.A O no hydrogen 3.078 N/A TYR 739.A OH ALA 771.A O no hydrogen 2.704 N/A LEU 740.A N VAL 736.A O no hydrogen 2.860 N/A ALA 741.A N LYS 737.A O no hydrogen 3.322 N/A LEU 742.A N ALA 738.A O no hydrogen 3.296 N/A ARG 743.A N TYR 739.A O no hydrogen 3.267 N/A ARG 743.A NE LEU 772.A O no hydrogen 2.798 N/A ARG 743.A NH2 THR 773.A O no hydrogen 2.802 N/A ARG 743.A NH2 LYS 776.A O no hydrogen 2.800 N/A HIS 744.A NE2 GLU 778.A OE2 no hydrogen 2.810 N/A HIS 745.A N LEU 742.A O no hydrogen 3.101 N/A THR 746.A OG1 ARG 743.A O no hydrogen 2.675 N/A LEU 749.A N HIS 745.A O no hydrogen 3.253 N/A ILE 750.A N THR 746.A O no hydrogen 2.819 N/A ILE 751.A N ASN 747.A O no hydrogen 3.151 N/A LEU 752.A N LEU 748.A O no hydrogen 2.839 N/A PHE 753.A N LEU 749.A O no hydrogen 3.008 N/A SER 754.A N ILE 750.A O no hydrogen 2.898 N/A MET 755.A N ILE 751.A O no hydrogen 3.252 N/A MET 756.A N LEU 752.A O no hydrogen 3.079 N/A LEU 757.A N PHE 753.A O no hydrogen 2.984 N/A MET 758.A N MET 755.A O no hydrogen 2.916 N/A THR 759.A N MET 755.A O no hydrogen 2.789 N/A THR 759.A OG1 MET 755.A O no hydrogen 3.049 N/A GLY 760.A N MET 756.A O no hydrogen 2.832 N/A MET 761.A N MET 756.A O no hydrogen 3.165 N/A TYR 767.A OH PHE 677.A O no hydrogen 2.804 N/A ILE 768.A N ILE 765.A O no hydrogen 3.413 N/A ARG 769.A NH1 ASP 313.A OD2 no hydrogen 2.935 N/A ASP 770.A N TYR 767.A O no hydrogen 3.173 N/A ALA 771.A N TYR 767.A O no hydrogen 2.946 N/A LEU 772.A N ILE 768.A O no hydrogen 2.811 N/A THR 773.A N ASP 770.A O no hydrogen 3.141 N/A VAL 774.A N ARG 769.A O no hydrogen 3.006 N/A ASN 777.A ND2 ASP 780.A OD1 no hydrogen 2.805 N/A ASP 780.A N ASN 777.A OD1 no hydrogen 2.817 N/A ALA 781.A N ASN 777.A O no hydrogen 2.925 N/A LYS 782.A N GLU 778.A O no hydrogen 3.364 N/A PHE 785.A N ALA 781.A O no hydrogen 3.273 N/A LEU 786.A N LYS 782.A O no hydrogen 3.250 N/A ASP 787.A N LYS 783.A O no hydrogen 3.010 N/A GLN 788.A N TYR 784.A O no hydrogen 3.310 N/A GLN 788.A NE2 TYR 784.A O no hydrogen 3.521 N/A ILE 789.A N PHE 785.A O no hydrogen 3.400 N/A GLU 790.A N LEU 786.A O no hydrogen 3.323 N/A VAL 791.A N ASP 787.A O no hydrogen 3.022 N/A CYS 792.A N GLN 788.A O no hydrogen 3.313 N/A CYS 792.A SG PHE 709.A O no hydrogen 3.271 N/A CYS 792.A SG GLN 788.A O no hydrogen 3.283 N/A ARG 793.A N ILE 789.A O no hydrogen 2.952 N/A ARG 793.A NH2 SER 722.A O no hydrogen 3.547 N/A ASP 794.A N GLU 790.A O no hydrogen 2.989 N/A LYS 795.A N VAL 791.A O no hydrogen 2.986 N/A LYS 795.A NZ GLU 705.A OE2 no hydrogen 3.286 N/A LYS 795.A NZ ARG 706.A O no hydrogen 3.013 N/A GLY 796.A N CYS 792.A O no hydrogen 3.008 N/A THR 798.A N LYS 795.A O no hydrogen 3.294 N/A THR 798.A OG1 LYS 795.A O no hydrogen 2.800 N/A PHE 801.A N TRP 797.A O no hydrogen 3.216 N/A