Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1br1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N ASN 17.A OD1 no hydrogen 3.350 N/A GLN 2.A N ASN 17.A OD1 no hydrogen 2.634 N/A SER 6.A N GLU 9.A OE1 no hydrogen 2.428 N/A SER 6.A OG ASP 7.A OD1 no hydrogen 3.138 N/A ASP 8.A N SER 6.A OG no hydrogen 3.067 N/A ASP 8.A N ASP 7.A OD1 no hydrogen 3.173 N/A LYS 10.A N SER 6.A O no hydrogen 3.150 N/A PHE 11.A N ASP 8.A O no hydrogen 2.620 N/A LEU 12.A N GLU 9.A O no hydrogen 3.146 N/A PHE 13.A N GLU 9.A O no hydrogen 2.630 N/A LEU 23.A N ASN 21.A OD1 no hydrogen 3.044 N/A GLN 25.A NE2 GLN 25.A O no hydrogen 2.605 N/A ALA 26.A N LEU 23.A O no hydrogen 3.391 N/A ASP 27.A N LEU 23.A O no hydrogen 2.882 N/A TRP 28.A N ALA 24.A O no hydrogen 3.283 N/A SER 29.A N ALA 26.A O no hydrogen 3.223 N/A SER 29.A OG ALA 26.A O no hydrogen 3.186 N/A ALA 30.A N ASP 27.A O no hydrogen 2.764 N/A VAL 34.A N ALA 46.A O no hydrogen 2.634 N/A TRP 35.A N GLN 75.A O no hydrogen 2.596 N/A VAL 36.A N GLU 44.A O no hydrogen 3.153 N/A LYS 40.A N SER 38.A OG no hydrogen 3.356 N/A HIS 41.A N SER 38.A O no hydrogen 3.343 N/A HIS 41.A N SER 38.A OG no hydrogen 2.640 N/A GLY 42.A N SER 38.A O no hydrogen 2.857 N/A GLU 44.A N VAL 36.A O no hydrogen 2.813 N/A ALA 46.A N VAL 34.A O no hydrogen 3.292 N/A SER 47.A N GLU 59.A O no hydrogen 2.883 N/A SER 47.A OG ALA 30.A O no hydrogen 3.121 N/A ILE 48.A N LYS 32.A O no hydrogen 2.566 N/A LYS 49.A N THR 57.A O no hydrogen 2.507 N/A GLU 50.A N THR 57.A O no hydrogen 3.018 N/A LYS 52.A N GLU 55.A O no hydrogen 2.703 N/A GLU 55.A N LYS 52.A O no hydrogen 3.033 N/A VAL 56.A N LEU 69.A O no hydrogen 2.837 N/A THR 57.A N GLU 50.A O no hydrogen 2.684 N/A THR 57.A OG1 GLU 50.A O no hydrogen 3.421 N/A VAL 58.A N VAL 67.A O no hydrogen 2.969 N/A GLU 59.A N SER 47.A O no hydrogen 2.946 N/A LEU 60.A N LYS 65.A O no hydrogen 2.805 N/A GLN 61.A N ALA 45.A O no hydrogen 3.160 N/A GLY 64.A N LEU 60.A O no hydrogen 3.077 N/A VAL 67.A N VAL 58.A O no hydrogen 2.855 N/A LEU 69.A N VAL 56.A O no hydrogen 2.979 N/A SER 70.A OG ASP 54.A O no hydrogen 3.170 N/A SER 70.A OG ASP 72.A OD2 no hydrogen 2.862 N/A LYS 71.A N ASP 54.A O no hydrogen 2.469 N/A LYS 71.A NZ GLU 51.A OE1 no hydrogen 2.983 N/A LYS 71.A NZ GLY 53.A O no hydrogen 3.145 N/A ASP 73.A N SER 70.A O no hydrogen 3.001 N/A GLN 75.A N TRP 35.A O no hydrogen 2.795 N/A PHE 82.A N PRO 79.A O no hydrogen 3.065 N/A SER 83.A N PRO 80.A O no hydrogen 3.328 N/A VAL 85.A N ASN 102.A OD1 no hydrogen 3.061 N/A ASP 87.A N GLU 90.A OE1 no hydrogen 2.905 N/A MET 88.A N TYR 115.A O no hydrogen 3.102 N/A ALA 89.A N ASP 87.A OD1 no hydrogen 2.923 N/A CYS 93.A SG MET 77.A O no hydrogen 3.965 N/A ASN 95.A ND2 GLN 75.A OE1 no hydrogen 3.522 N/A SER 98.A OG CYS 93.A O no hydrogen 3.548 N/A SER 98.A OG ASN 95.A OD1 no hydrogen 3.178 N/A VAL 99.A N ASN 95.A O no hydrogen 3.046 N/A HIS 101.A N ALA 97.A O no hydrogen 2.665 N/A ASN 102.A N SER 98.A O no hydrogen 2.744 N/A ASN 102.A ND2 VAL 85.A O no hydrogen 3.120 N/A LEU 103.A N VAL 99.A O no hydrogen 3.377 N/A ARG 104.A N LEU 100.A O no hydrogen 2.821 N/A ARG 104.A NH1 HIS 41.A O no hydrogen 3.252 N/A GLU 105.A N HIS 101.A O no hydrogen 2.938 N/A ARG 106.A N ASN 102.A O no hydrogen 3.119 N/A ARG 106.A NE LYS 84.A O no hydrogen 3.258 N/A ARG 106.A NH1 TYR 113.A O no hydrogen 3.127 N/A TYR 107.A N LEU 103.A O no hydrogen 2.986 N/A TYR 107.A OH ASN 124.A O no hydrogen 3.328 N/A PHE 108.A N ARG 104.A O no hydrogen 3.022 N/A SER 109.A N GLU 105.A O no hydrogen 2.878 N/A SER 109.A OG GLU 105.A O no hydrogen 3.165 N/A GLY 110.A N TYR 107.A O no hydrogen 3.147 N/A LEU 111.A N ARG 106.A O no hydrogen 2.799 N/A TYR 113.A OH TYR 132.A OH no hydrogen 2.460 N/A TYR 113.A OH ASN 185.A OD1 no hydrogen 3.425 N/A THR 114.A N VAL 121.A O no hydrogen 3.104 N/A THR 114.A OG1 ILE 112.A O no hydrogen 3.377 N/A TYR 115.A N GLU 86.A O no hydrogen 2.971 N/A SER 116.A N PHE 119.A O no hydrogen 2.982 N/A SER 116.A OG PHE 119.A O no hydrogen 3.148 N/A GLY 117.A N ASP 87.A OD1 no hydrogen 3.123 N/A CYS 120.A N PHE 647.A O no hydrogen 3.363 N/A CYS 120.A SG VAL 121.A O no hydrogen 3.445 N/A VAL 121.A N THR 114.A O no hydrogen 2.828 N/A ASN 124.A N ILE 651.A O no hydrogen 3.101 N/A ASN 124.A ND2 GLY 179.A O no hydrogen 3.254 N/A GLN 128.A N GLN 128.A OE1 no hydrogen 2.875 N/A TYR 132.A OH TYR 113.A OH no hydrogen 2.460 N/A GLU 134.A N GLY 205.A O no hydrogen 2.615 N/A ILE 137.A N SER 133.A O no hydrogen 2.711 N/A ASP 138.A N GLU 134.A O no hydrogen 2.981 N/A MET 139.A N LYS 135.A O no hydrogen 3.236 N/A MET 139.A N ILE 136.A O no hydrogen 3.235 N/A TYR 140.A N ILE 136.A O no hydrogen 3.334 N/A TYR 140.A N ILE 137.A O no hydrogen 3.229 N/A TYR 140.A OH PRO 149.A O no hydrogen 2.639 N/A LYS 141.A N ILE 137.A O no hydrogen 2.996 N/A LYS 141.A NZ ASP 138.A OD1 no hydrogen 3.383 N/A GLY 142.A N ASP 157.A OD2 no hydrogen 3.346 N/A HIS 151.A NE2 ILE 131.A O no hydrogen 2.676 N/A TYR 153.A N HIS 151.A ND1 no hydrogen 2.625 N/A ALA 154.A N HIS 151.A O no hydrogen 2.994 N/A ALA 156.A N ILE 152.A O no hydrogen 3.117 N/A ASP 157.A N TYR 153.A O no hydrogen 3.200 N/A THR 158.A N ALA 154.A O no hydrogen 2.785 N/A THR 158.A OG1 ALA 154.A O no hydrogen 2.741 N/A ALA 159.A N ILE 155.A O no hydrogen 3.108 N/A TYR 160.A N ALA 156.A O no hydrogen 2.933 N/A TYR 160.A OH GLY 253.A O no hydrogen 2.578 N/A ARG 161.A N ASP 157.A O no hydrogen 3.087 N/A SER 162.A N THR 158.A O no hydrogen 3.196 N/A MET 163.A N ALA 159.A O no hydrogen 2.811 N/A GLN 165.A N ARG 161.A O no hydrogen 2.768 N/A GLN 165.A N SER 162.A O no hydrogen 3.217 N/A ASP 166.A N SER 162.A O no hydrogen 3.205 N/A GLN 170.A N PHE 447.A O no hydrogen 3.492 N/A GLN 170.A NE2 GLU 168.A O no hydrogen 2.878 N/A SER 171.A N ASN 644.A O no hydrogen 2.576 N/A SER 171.A OG THR 643.A OG1 no hydrogen 3.221 N/A SER 171.A OG ASN 644.A O no hydrogen 3.149 N/A ILE 172.A N GLY 449.A O no hydrogen 2.490 N/A LEU 173.A N ASN 646.A O no hydrogen 2.903 N/A CYS 174.A N LEU 451.A O no hydrogen 3.334 N/A CYS 174.A SG LYS 182.A O no hydrogen 3.544 N/A SER 178.A N PHE 456.A O no hydrogen 3.093 N/A ALA 180.A N GLU 177.A O no hydrogen 3.009 N/A LYS 182.A NZ GLY 176.A O no hydrogen 2.486 N/A THR 183.A OG1 SER 239.A OG no hydrogen 2.925 N/A ASN 185.A ND2 GLY 181.A O no hydrogen 3.246 N/A THR 186.A N THR 183.A O no hydrogen 2.447 N/A THR 186.A OG1 LYS 182.A O no hydrogen 3.104 N/A LYS 187.A N THR 183.A O no hydrogen 3.128 N/A LYS 187.A NZ GLU 225.A OE2 no hydrogen 2.677 N/A LYS 188.A N GLU 184.A O no hydrogen 3.042 N/A LYS 188.A NZ GLN 191.A OE1 no hydrogen 2.850 N/A VAL 189.A N ASN 185.A O no hydrogen 3.480 N/A ILE 190.A N THR 186.A O no hydrogen 3.100 N/A GLN 191.A N LYS 187.A O no hydrogen 2.914 N/A TYR 192.A N LYS 188.A O no hydrogen 2.707 N/A TYR 192.A OH ASP 157.A OD2 no hydrogen 2.503 N/A LEU 193.A N VAL 189.A O no hydrogen 3.180 N/A ALA 194.A N ILE 190.A O no hydrogen 2.690 N/A VAL 195.A N TYR 192.A O no hydrogen 2.794 N/A VAL 196.A N TYR 192.A O no hydrogen 2.875 N/A ALA 197.A N LEU 193.A O no hydrogen 3.279 N/A SER 198.A OG SER 199.A O no hydrogen 3.299 N/A SER 199.A N GLU 214.A OE2 no hydrogen 3.378 N/A LYS 203.A NZ SER 209.A OG no hydrogen 3.167 N/A SER 207.A N GLN 204.A O no hydrogen 2.783 N/A SER 207.A OG GLN 204.A O no hydrogen 2.975 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.627 N/A LYS 215.A NZ TYR 210.A O no hydrogen 2.805 N/A LYS 215.A NZ GLY 211.A O no hydrogen 3.485 N/A LEU 217.A N LEU 213.A O no hydrogen 2.786 N/A LEU 218.A N GLU 214.A O no hydrogen 3.198 N/A GLN 219.A N LYS 215.A O no hydrogen 3.376 N/A ILE 223.A N ALA 220.A O no hydrogen 2.660 N/A LEU 224.A N ALA 220.A O no hydrogen 3.349 N/A GLU 225.A N ASN 221.A O no hydrogen 3.174 N/A ALA 226.A N ILE 223.A O no hydrogen 2.581 N/A GLY 228.A N ALA 226.A O no hydrogen 2.750 N/A ASN 229.A ND2 SER 239.A OG no hydrogen 3.153 N/A ALA 230.A N SER 238.A O no hydrogen 2.926 N/A LYS 231.A NZ THR 232.A O no hydrogen 3.016 N/A LYS 231.A NZ ASP 236.A OD1 no hydrogen 2.976 N/A THR 232.A N ASN 235.A O no hydrogen 2.997 N/A LYS 234.A N THR 232.A OG1 no hydrogen 2.941 N/A ASN 235.A N THR 232.A O no hydrogen 2.773 N/A ASN 237.A N ASN 235.A OD1 no hydrogen 2.241 N/A ASN 237.A ND2 GLU 225.A OE1 no hydrogen 3.215 N/A SER 238.A N ALA 230.A O no hydrogen 3.413 N/A SER 239.A OG THR 183.A OG1 no hydrogen 2.925 N/A ARG 240.A N GLY 228.A O no hydrogen 2.902 N/A ARG 240.A NH1 SER 239.A O no hydrogen 3.500 N/A ARG 240.A NH2 GLU 457.A OE1 no hydrogen 2.642 N/A ARG 240.A NH2 GLU 457.A OE2 no hydrogen 2.664 N/A LYS 243.A N ASP 452.A O no hydrogen 2.629 N/A LYS 243.A NZ ASN 221.A OD1 no hydrogen 3.305 N/A LYS 243.A NZ ASP 452.A OD2 no hydrogen 2.615 N/A PHE 244.A N GLU 261.A O no hydrogen 3.100 N/A ILE 245.A N ILE 450.A O no hydrogen 3.024 N/A ARG 246.A N ASN 259.A O no hydrogen 2.904 N/A ILE 247.A N LEU 448.A O no hydrogen 3.080 N/A ASN 248.A N GLY 257.A O no hydrogen 2.873 N/A PHE 249.A N SER 446.A O no hydrogen 2.725 N/A ASP 250.A N TYR 254.A O no hydrogen 2.907 N/A THR 252.A OG1 ASP 250.A OD2 no hydrogen 2.602 N/A TYR 254.A N ASP 250.A OD1 no hydrogen 2.773 N/A VAL 256.A N ASN 248.A O no hydrogen 2.683 N/A GLY 257.A N ASN 248.A O no hydrogen 3.209 N/A ASN 259.A N ARG 246.A O no hydrogen 2.833 N/A GLU 261.A N PHE 244.A O no hydrogen 3.131 N/A TYR 263.A N GLY 242.A O no hydrogen 3.218 N/A GLU 266.A N ARG 240.A O no hydrogen 3.281 N/A LYS 267.A N LEU 265.A O no hydrogen 2.380 N/A SER 268.A OG GLU 465.A OE2 no hydrogen 2.768 N/A ARG 269.A NE GLU 266.A OE2 no hydrogen 2.622 N/A ARG 269.A NH1 GLU 277.A OE1 no hydrogen 2.904 N/A ARG 269.A NH1 ARG 278.A O no hydrogen 2.604 N/A ARG 269.A NH2 GLU 266.A OE2 no hydrogen 2.958 N/A ARG 269.A NH2 GLU 277.A OE1 no hydrogen 2.557 N/A ALA 270.A N LYS 267.A O no hydrogen 3.078 N/A ILE 271.A N SER 268.A O no hydrogen 2.931 N/A GLN 273.A N SER 310.A OG no hydrogen 2.590 N/A GLN 273.A NE2 ARG 269.A O no hydrogen 2.918 N/A GLN 273.A NE2 PHE 308.A O no hydrogen 2.426 N/A ASP 276.A N ASN 311.A OD1 no hydrogen 3.307 N/A GLU 277.A N ALA 274.A O no hydrogen 3.254 N/A ARG 278.A N LYS 231.A O no hydrogen 3.040 N/A ARG 278.A NH1 VAL 314.A O no hydrogen 2.829 N/A ARG 278.A NH1 ASP 321.A OD2 no hydrogen 3.115 N/A ARG 278.A NH2 ASP 321.A OD1 no hydrogen 3.418 N/A THR 279.A N TYR 284.A OH no hydrogen 3.200 N/A THR 279.A OG1 TYR 284.A OH no hydrogen 3.173 N/A HIS 281.A N ASN 229.A O no hydrogen 3.095 N/A HIS 281.A ND1 TYR 285.A OH no hydrogen 2.926 N/A PHE 283.A N PHE 280.A O no hydrogen 2.666 N/A TYR 284.A OH THR 279.A OG1 no hydrogen 3.173 N/A TYR 285.A N HIS 281.A O no hydrogen 3.038 N/A TYR 285.A OH HIS 281.A ND1 no hydrogen 2.926 N/A LEU 286.A N ILE 282.A O no hydrogen 2.786 N/A ILE 287.A N PHE 283.A O no hydrogen 2.883 N/A ALA 288.A N TYR 284.A O no hydrogen 3.066 N/A ALA 288.A N TYR 285.A O no hydrogen 3.091 N/A GLY 289.A N TYR 285.A O no hydrogen 2.435 N/A ALA 290.A N LEU 286.A O no hydrogen 3.081 N/A MET 294.A N SER 291.A OG no hydrogen 3.235 N/A ARG 295.A NE LEU 300.A O no hydrogen 2.652 N/A ASP 297.A N GLN 293.A O no hydrogen 3.289 N/A LEU 299.A N ASN 296.A O no hydrogen 2.392 N/A LEU 300.A N ARG 295.A O no hydrogen 3.036 N/A TYR 306.A OH LEU 299.A O no hydrogen 2.908 N/A TYR 306.A OH GLU 301.A O no hydrogen 3.165 N/A SER 310.A N GLN 273.A OE1 no hydrogen 2.629 N/A SER 310.A OG GLN 273.A O no hydrogen 2.683 N/A ASN 311.A ND2 GLN 273.A O no hydrogen 3.633 N/A ASN 311.A ND2 ALA 274.A O no hydrogen 2.696 N/A GLN 319.A N ILE 316.A O no hydrogen 3.202 N/A GLN 319.A NE2 ASP 321.A OD1 no hydrogen 3.043 N/A ASP 322.A N ASP 322.A OD1 no hydrogen 2.430 N/A MET 324.A N GLN 320.A O no hydrogen 2.852 N/A PHE 325.A N ASP 321.A O no hydrogen 3.073 N/A GLU 327.A N GLU 323.A O no hydrogen 3.161 N/A THR 328.A N MET 324.A O no hydrogen 3.107 N/A THR 328.A OG1 PHE 325.A O no hydrogen 3.050 N/A LEU 329.A N PHE 325.A O no hydrogen 2.603 N/A GLU 330.A N GLN 326.A O no hydrogen 2.309 N/A ALA 331.A N GLU 327.A O no hydrogen 2.782 N/A MET 332.A N THR 328.A O no hydrogen 2.818 N/A THR 333.A N LEU 329.A O no hydrogen 3.241 N/A THR 333.A OG1 LEU 329.A O no hydrogen 3.531 N/A THR 333.A OG1 GLU 330.A O no hydrogen 2.278 N/A ILE 334.A N GLU 330.A O no hydrogen 3.104 N/A MET 335.A N ALA 331.A O no hydrogen 2.797 N/A GLY 336.A N MET 332.A O no hydrogen 2.860 N/A PHE 337.A N MET 332.A O no hydrogen 3.126 N/A THR 338.A OG1 GLU 341.A OE1 no hydrogen 2.816 N/A GLU 339.A N GLU 339.A OE1 no hydrogen 2.659 N/A GLN 342.A NE2 PHE 337.A O no hydrogen 2.817 N/A GLN 342.A NE2 THR 338.A O no hydrogen 3.343 N/A THR 343.A OG1 GLU 340.A O no hydrogen 2.512 N/A SER 344.A N GLU 340.A O no hydrogen 3.100 N/A SER 344.A OG GLU 340.A O no hydrogen 2.710 N/A LEU 346.A N GLN 342.A O no hydrogen 3.015 N/A LEU 346.A N THR 343.A O no hydrogen 3.101 N/A ARG 347.A N THR 343.A O no hydrogen 3.101 N/A VAL 348.A N SER 344.A O no hydrogen 3.137 N/A VAL 349.A N LEU 346.A O no hydrogen 2.680 N/A SER 350.A N LEU 346.A O no hydrogen 3.098 N/A SER 350.A OG LEU 346.A O no hydrogen 3.246 N/A SER 350.A OG ARG 347.A O no hydrogen 2.582 N/A SER 351.A N ARG 347.A O no hydrogen 2.713 N/A SER 351.A OG VAL 348.A O no hydrogen 3.116 N/A VAL 352.A N VAL 348.A O no hydrogen 3.286 N/A LEU 353.A N SER 350.A O no hydrogen 2.693 N/A GLN 354.A N SER 350.A O no hydrogen 2.760 N/A LEU 355.A N SER 351.A O no hydrogen 3.121 N/A GLY 356.A N LEU 353.A O no hydrogen 2.892 N/A ASN 357.A N GLN 354.A O no hydrogen 2.446 N/A THR 366.A N GLU 363.A OE1 no hydrogen 2.448 N/A THR 366.A OG1 GLU 363.A OE1 no hydrogen 2.721 N/A GLN 368.A N THR 366.A OG1 no hydrogen 3.288 N/A THR 375.A OG1 ASP 373.A OD2 no hydrogen 3.399 N/A GLN 378.A N ASN 374.A O no hydrogen 2.647 N/A LYS 379.A N THR 375.A O no hydrogen 2.731 N/A LYS 379.A NZ GLU 301.A OE2 no hydrogen 3.038 N/A VAL 380.A N ALA 376.A O no hydrogen 3.136 N/A CYS 381.A N ALA 377.A O no hydrogen 2.816 N/A CYS 381.A SG ASN 387.A O no hydrogen 3.661 N/A HIS 382.A N LYS 379.A O no hydrogen 2.495 N/A LEU 383.A N LYS 379.A O no hydrogen 3.332 N/A MET 384.A N VAL 380.A O no hydrogen 3.127 N/A GLY 385.A N HIS 382.A O no hydrogen 3.093 N/A ILE 386.A N CYS 381.A O no hydrogen 3.186 N/A THR 389.A OG1 ASN 387.A OD1 no hydrogen 2.556 N/A THR 389.A OG1 ASP 390.A OD1 no hydrogen 3.174 N/A ASP 390.A N ASN 387.A OD1 no hydrogen 2.961 N/A PHE 391.A N ASN 387.A O no hydrogen 2.904 N/A THR 392.A N VAL 388.A O no hydrogen 2.730 N/A THR 392.A OG1 VAL 388.A O no hydrogen 2.708 N/A ARG 393.A N THR 389.A O no hydrogen 2.920 N/A SER 394.A N ASP 390.A O no hydrogen 2.924 N/A SER 394.A OG ASP 390.A O no hydrogen 2.504 N/A SER 394.A OG PHE 391.A O no hydrogen 3.367 N/A ILE 395.A N PHE 391.A O no hydrogen 2.542 N/A LEU 396.A N THR 392.A O no hydrogen 2.616 N/A LEU 396.A N ARG 393.A O no hydrogen 2.645 N/A THR 397.A N ARG 393.A O no hydrogen 2.403 N/A THR 397.A OG1 ARG 393.A O no hydrogen 3.406 N/A THR 397.A OG1 THR 397.A O no hydrogen 2.305 N/A ASP 405.A N VAL 402.A O no hydrogen 2.706 N/A LYS 409.A N PRO 398.A O no hydrogen 3.217 N/A LYS 409.A NZ ALA 410.A O no hydrogen 2.397 N/A GLN 411.A N LEU 396.A O no hydrogen 3.273 N/A LYS 413.A NZ PHE 360.A O no hydrogen 3.419 N/A GLU 414.A N GLU 414.A OE1 no hydrogen 2.529 N/A ALA 416.A N THR 412.A O no hydrogen 2.956 N/A ASP 417.A N GLU 414.A O no hydrogen 2.490 N/A PHE 418.A N GLU 414.A O no hydrogen 2.825 N/A ALA 419.A N GLN 415.A O no hydrogen 3.257 N/A GLU 421.A N ASP 417.A O no hydrogen 2.506 N/A ALA 422.A N PHE 418.A O no hydrogen 3.192 N/A LYS 425.A N GLU 421.A O no hydrogen 2.907 N/A ALA 426.A N LEU 423.A O no hydrogen 3.021 N/A LYS 427.A N LEU 423.A O no hydrogen 2.709 N/A LYS 427.A NZ SER 351.A OG no hydrogen 3.280 N/A PHE 428.A N ALA 424.A O no hydrogen 2.804 N/A ARG 430.A N ALA 426.A O no hydrogen 3.129 N/A ARG 430.A NH2 TRP 612.A O no hydrogen 3.329 N/A LEU 431.A N PHE 428.A O no hydrogen 2.315 N/A PHE 432.A N PHE 428.A O no hydrogen 3.244 N/A ARG 433.A N GLU 429.A O no hydrogen 3.130 N/A ARG 433.A NH2 THR 262.A O no hydrogen 2.836 N/A ARG 433.A NH2 TYR 263.A O no hydrogen 3.220 N/A TRP 434.A N LEU 431.A O no hydrogen 2.717 N/A ILE 435.A N LEU 431.A O no hydrogen 2.863 N/A LEU 436.A N PHE 432.A O no hydrogen 2.950 N/A THR 437.A N TRP 434.A O no hydrogen 2.906 N/A THR 437.A OG1 ARG 433.A O no hydrogen 2.450 N/A THR 437.A OG1 TRP 434.A O no hydrogen 3.013 N/A ARG 438.A N ILE 435.A O no hydrogen 2.434 N/A ARG 438.A NE ARG 438.A O no hydrogen 3.312 N/A VAL 439.A N ILE 435.A O no hydrogen 2.649 N/A ASN 440.A N LEU 436.A O no hydrogen 3.108 N/A ASN 440.A ND2 ILE 260.A O no hydrogen 3.033 N/A ASN 440.A ND2 LEU 436.A O no hydrogen 3.446 N/A LYS 441.A N ARG 438.A O no hydrogen 3.167 N/A ALA 442.A N VAL 439.A O no hydrogen 2.863 N/A LEU 443.A N VAL 439.A O no hydrogen 3.243 N/A SER 446.A N PHE 249.A O no hydrogen 3.185 N/A SER 446.A OG PHE 249.A O no hydrogen 3.295 N/A PHE 447.A N ASP 169.A OD1 no hydrogen 2.520 N/A LEU 448.A N ILE 247.A O no hydrogen 2.727 N/A GLY 449.A N GLN 170.A O no hydrogen 2.510 N/A ILE 450.A N ILE 245.A O no hydrogen 3.087 N/A LEU 451.A N ILE 172.A O no hydrogen 3.001 N/A ASP 452.A N LYS 243.A O no hydrogen 2.732 N/A PHE 456.A N ASN 473.A OD1 no hydrogen 2.456 N/A GLU 457.A N ASN 470.A OD1 no hydrogen 3.384 N/A ASN 462.A ND2 THR 578.A O no hydrogen 3.051 N/A SER 463.A OG GLU 465.A OE1 no hydrogen 2.864 N/A GLU 465.A N GLU 465.A OE1 no hydrogen 2.243 N/A GLN 466.A NE2 ILE 461.A O no hydrogen 3.128 N/A LEU 467.A N PHE 464.A O no hydrogen 2.461 N/A CYS 468.A N PHE 464.A O no hydrogen 3.148 N/A CYS 468.A SG PHE 464.A O no hydrogen 3.621 N/A ILE 469.A N GLU 465.A O no hydrogen 2.862 N/A ASN 470.A N GLN 466.A O no hydrogen 3.002 N/A TYR 471.A N CYS 468.A O no hydrogen 2.996 N/A TYR 471.A OH GLU 516.A OE1 no hydrogen 2.800 N/A THR 472.A N CYS 468.A O no hydrogen 2.818 N/A THR 472.A OG1 CYS 468.A O no hydrogen 2.607 N/A THR 472.A OG1 ILE 469.A O no hydrogen 3.267 N/A THR 472.A OG1 TYR 629.A OH no hydrogen 2.964 N/A ASN 473.A N ILE 469.A O no hydrogen 3.100 N/A ASN 473.A ND2 ALA 454.A O no hydrogen 2.463 N/A ASN 473.A ND2 ILE 469.A O no hydrogen 3.268 N/A GLU 474.A N ASN 470.A O no hydrogen 3.309 N/A LYS 475.A N TYR 471.A O no hydrogen 2.750 N/A LEU 476.A N THR 472.A O no hydrogen 2.652 N/A GLN 477.A N ASN 473.A O no hydrogen 3.194 N/A GLN 477.A NE2 ASN 674.A O no hydrogen 3.265 N/A GLN 478.A N GLU 474.A O no hydrogen 3.331 N/A LEU 479.A N LYS 475.A O no hydrogen 3.286 N/A LEU 479.A N LEU 476.A O no hydrogen 2.597 N/A PHE 480.A N LEU 476.A O no hydrogen 3.274 N/A ASN 481.A N GLN 477.A O no hydrogen 3.036 N/A HIS 482.A N GLN 478.A O no hydrogen 2.886 N/A THR 483.A N LEU 479.A O no hydrogen 2.941 N/A THR 483.A OG1 LEU 479.A O no hydrogen 2.367 N/A MET 484.A N PHE 480.A O no hydrogen 2.918 N/A PHE 485.A N ASN 481.A O no hydrogen 3.053 N/A LEU 487.A N HIS 482.A O no hydrogen 2.780 N/A GLN 489.A N PHE 485.A O no hydrogen 3.306 N/A GLN 489.A NE2 PHE 485.A O no hydrogen 3.034 N/A GLN 489.A NE2 ILE 502.A O no hydrogen 3.556 N/A GLU 490.A N ILE 486.A O no hydrogen 3.303 N/A GLU 491.A N LEU 487.A O no hydrogen 3.369 N/A GLN 493.A N GLN 489.A O no hydrogen 3.183 N/A ARG 494.A N GLU 490.A O no hydrogen 2.796 N/A GLU 495.A N GLU 491.A O no hydrogen 3.047 N/A ILE 497.A N TYR 492.A O no hydrogen 3.107 N/A ASN 500.A ND2 ASN 500.A O no hydrogen 2.414 N/A LEU 508.A N GLN 478.A OE1 no hydrogen 2.575 N/A GLN 509.A N ASP 507.A OD1 no hydrogen 2.489 N/A CYS 511.A SG LEU 571.A O no hydrogen 3.360 N/A CYS 511.A SG HIS 572.A ND1 no hydrogen 3.668 N/A ILE 512.A N LEU 508.A O no hydrogen 3.192 N/A ILE 512.A N GLN 509.A O no hydrogen 2.626 N/A GLU 513.A N GLN 509.A O no hydrogen 2.944 N/A LEU 514.A N PRO 510.A O no hydrogen 3.124 N/A ILE 515.A N ILE 512.A O no hydrogen 2.855 N/A GLU 516.A N ILE 512.A O no hydrogen 2.399 N/A GLU 516.A N GLU 513.A O no hydrogen 3.082 N/A VAL 524.A N LEU 514.A O no hydrogen 2.761 N/A LEU 527.A N GLY 523.A O no hydrogen 3.278 N/A LEU 528.A N VAL 524.A O no hydrogen 3.426 N/A ASP 529.A N ALA 526.A O no hydrogen 2.739 N/A GLU 530.A N ALA 526.A O no hydrogen 3.330 N/A GLU 531.A N LEU 527.A O no hydrogen 2.958 N/A CYS 532.A SG LEU 585.A O no hydrogen 3.799 N/A TRP 533.A N GLU 530.A O no hydrogen 2.420 N/A ALA 537.A N PRO 535.A O no hydrogen 2.599 N/A THR 538.A N SER 541.A OG no hydrogen 2.296 N/A THR 538.A OG1 THR 540.A OG1 no hydrogen 3.386 N/A THR 540.A OG1 THR 538.A OG1 no hydrogen 3.386 N/A SER 541.A N THR 538.A OG1 no hydrogen 3.307 N/A SER 541.A OG GLU 531.A OE1 no hydrogen 3.109 N/A SER 541.A OG THR 538.A O no hydrogen 2.395 N/A PHE 542.A N THR 538.A O no hydrogen 2.606 N/A VAL 543.A N ASP 539.A O no hydrogen 2.901 N/A GLU 544.A N THR 540.A O no hydrogen 3.021 N/A LYS 545.A N SER 541.A O no hydrogen 3.067 N/A LEU 546.A N PHE 542.A O no hydrogen 2.636 N/A ILE 547.A N VAL 543.A O no hydrogen 2.700 N/A GLN 548.A N GLU 544.A O no hydrogen 3.042 N/A GLU 549.A N LYS 545.A O no hydrogen 3.051 N/A GLU 549.A N GLN 548.A OE1 no hydrogen 2.727 N/A GLN 550.A NE2 PRO 522.A O no hydrogen 2.652 N/A LYS 555.A N HIS 553.A ND1 no hydrogen 2.745 N/A LYS 555.A NZ ALA 554.A O no hydrogen 3.210 N/A PHE 556.A N HIS 553.A O no hydrogen 2.536 N/A GLN 557.A N CYS 569.A O no hydrogen 3.082 N/A GLN 557.A NE2 LYS 558.A O no hydrogen 2.674 N/A LEU 562.A N SER 559.A OG no hydrogen 3.121 N/A LYS 563.A NZ GLN 561.A O no hydrogen 3.272 N/A LYS 565.A N LEU 562.A O no hydrogen 2.863 N/A THR 566.A N LEU 562.A O no hydrogen 2.617 N/A THR 566.A OG1 LYS 563.A O no hydrogen 3.019 N/A PHE 568.A N TYR 579.A O no hydrogen 2.996 N/A CYS 569.A N GLN 557.A O no hydrogen 2.719 N/A LEU 571.A N LYS 555.A O no hydrogen 2.858 N/A HIS 572.A N GLY 575.A O no hydrogen 3.160 N/A HIS 572.A NE2 TYR 579.A OH no hydrogen 2.626 N/A TYR 573.A N GLU 474.A OE1 no hydrogen 2.986 N/A TYR 579.A N PHE 568.A O no hydrogen 2.714 N/A TYR 579.A OH GLN 466.A O no hydrogen 3.410 N/A TYR 579.A OH HIS 572.A NE2 no hydrogen 2.626 N/A ASN 580.A N ASN 462.A O no hydrogen 3.156 N/A ASN 580.A ND2 LYS 565.A O no hydrogen 2.808 N/A ASN 580.A ND2 THR 566.A O no hydrogen 3.598 N/A TRP 584.A N ALA 581.A O no hydrogen 3.124 N/A LEU 585.A N ASP 539.A OD1 no hydrogen 3.085 N/A THR 586.A OG1 ALA 583.A O no hydrogen 3.027 N/A LYS 587.A N ALA 583.A O no hydrogen 3.323 N/A LYS 587.A NZ SER 463.A OG no hydrogen 3.184 N/A ASN 588.A N TRP 584.A O no hydrogen 2.812 N/A ASN 588.A ND2 ASP 529.A OD1 no hydrogen 3.175 N/A MET 589.A N THR 586.A O no hydrogen 2.955 N/A ASP 590.A N THR 586.A O no hydrogen 2.826 N/A ASN 593.A ND2 SER 394.A O no hydrogen 2.462 N/A ASP 594.A N ASP 594.A OD1 no hydrogen 2.343 N/A VAL 596.A N ASN 593.A OD1 no hydrogen 2.432 N/A THR 597.A N ASN 593.A O no hydrogen 2.986 N/A THR 597.A OG1 ASN 593.A O no hydrogen 3.395 N/A SER 598.A N ASP 594.A O no hydrogen 2.891 N/A SER 598.A OG ASP 594.A O no hydrogen 2.597 N/A LEU 599.A N ASN 595.A O no hydrogen 3.239 N/A LEU 600.A N VAL 596.A O no hydrogen 3.076 N/A LEU 600.A N THR 597.A O no hydrogen 2.889 N/A ASN 601.A N THR 597.A O no hydrogen 3.142 N/A ASN 601.A ND2 TRP 612.A O no hydrogen 3.356 N/A GLN 602.A NE2 SER 598.A O no hydrogen 2.372 N/A SER 603.A N LEU 600.A O no hydrogen 2.322 N/A SER 603.A OG MET 384.A O no hydrogen 2.963 N/A SER 603.A OG GLY 385.A O no hydrogen 3.422 N/A SER 603.A OG ASP 605.A O no hydrogen 3.366 N/A SER 604.A N GLY 385.A O no hydrogen 2.736 N/A ALA 609.A N ASP 605.A O no hydrogen 2.665 N/A ASP 610.A N LYS 606.A O no hydrogen 2.662 N/A LEU 611.A N PHE 607.A O no hydrogen 2.906 N/A TRP 612.A N VAL 608.A O no hydrogen 3.058 N/A LYS 613.A N ALA 609.A O no hydrogen 2.396 N/A ARG 617.A NH1 ARG 623.A O no hydrogen 3.180 N/A ILE 618.A N VAL 615.A O no hydrogen 3.143 N/A THR 624.A OG1 ASP 529.A OD1 no hydrogen 2.942 N/A THR 624.A OG1 ASN 588.A OD1 no hydrogen 2.611 N/A VAL 625.A N ASN 588.A O no hydrogen 3.295 N/A GLY 626.A N ASN 588.A OD1 no hydrogen 3.498 N/A GLN 627.A N THR 624.A O no hydrogen 3.099 N/A LEU 628.A N THR 624.A O no hydrogen 2.693 N/A TYR 629.A N VAL 625.A O no hydrogen 2.848 N/A TYR 629.A OH THR 472.A OG1 no hydrogen 2.964 N/A LYS 630.A N GLY 626.A O no hydrogen 3.240 N/A LYS 630.A NZ GLU 516.A O no hydrogen 2.394 N/A GLN 632.A N TYR 629.A O no hydrogen 2.531 N/A GLN 632.A NE2 THR 262.A O no hydrogen 3.613 N/A LEU 633.A N TYR 629.A O no hydrogen 3.129 N/A THR 634.A N GLU 631.A O no hydrogen 3.291 N/A THR 634.A OG1 LYS 630.A O no hydrogen 2.776 N/A THR 634.A OG1 GLU 631.A O no hydrogen 2.676 N/A LYS 635.A N GLN 632.A O no hydrogen 2.800 N/A LEU 636.A N GLN 632.A O no hydrogen 2.960 N/A MET 637.A N LEU 633.A O no hydrogen 3.488 N/A THR 638.A N LYS 635.A O no hydrogen 2.837 N/A THR 638.A OG1 THR 634.A O no hydrogen 2.662 N/A THR 639.A N LYS 635.A O no hydrogen 3.234 N/A LEU 640.A N LEU 636.A O no hydrogen 3.160 N/A ASN 642.A N THR 639.A O no hydrogen 2.648 N/A THR 643.A N LEU 640.A O no hydrogen 3.163 N/A THR 643.A OG1 SER 171.A OG no hydrogen 3.221 N/A THR 643.A OG1 LEU 640.A O no hydrogen 2.980 N/A ASN 644.A N ASP 169.A O no hydrogen 2.826 N/A ASN 646.A ND2 GLN 170.A OE1 no hydrogen 3.450 N/A ASN 646.A ND2 SER 171.A O no hydrogen 2.709 N/A VAL 648.A N LEU 173.A O no hydrogen 3.251 N/A ARG 649.A NE THR 175.A OG1 no hydrogen 3.280 N/A ARG 649.A NH2 THR 175.A OG1 no hydrogen 3.204 N/A ARG 649.A NH2 GLN 477.A OE1 no hydrogen 3.289 N/A CYS 650.A SG THR 175.A O no hydrogen 3.644 N/A CYS 650.A SG VAL 648.A O no hydrogen 3.540 N/A ILE 652.A N GLN 670.A OE1 no hydrogen 2.611 N/A ASN 654.A ND2 ARG 658.A O no hydrogen 2.494 N/A ASN 654.A ND2 LYS 661.A O no hydrogen 2.723 N/A LYS 657.A NZ ASP 236.A OD1 no hydrogen 3.282 N/A ARG 658.A N ASN 654.A OD1 no hydrogen 2.807 N/A LYS 661.A NZ GLU 656.A OE1 no hydrogen 2.976 N/A ASP 663.A N PRO 653.A O no hydrogen 2.910 N/A LEU 666.A N ASP 663.A OD1 no hydrogen 3.153 N/A VAL 667.A N ASP 663.A O no hydrogen 3.122 N/A GLU 669.A N HIS 665.A O no hydrogen 2.714 N/A GLN 670.A N LEU 666.A O no hydrogen 3.459 N/A GLN 670.A NE2 ILE 652.A O no hydrogen 3.262 N/A GLN 670.A NE2 LEU 666.A O no hydrogen 2.634 N/A LEU 671.A N VAL 667.A O no hydrogen 3.426 N/A ARG 672.A N GLU 669.A O no hydrogen 2.381 N/A ARG 672.A NE GLU 96.A OE2 no hydrogen 3.144 N/A ARG 672.A NH2 GLU 96.A OE1 no hydrogen 3.528 N/A CYS 673.A N GLU 669.A O no hydrogen 2.814 N/A CYS 673.A SG GLU 669.A OE1 no hydrogen 3.615 N/A CYS 673.A SG GLN 670.A O no hydrogen 3.992 N/A ASN 674.A N GLN 670.A O no hydrogen 3.052 N/A ASN 674.A ND2 GLN 670.A O no hydrogen 3.358 N/A GLY 675.A N ARG 672.A O no hydrogen 3.380 N/A GLU 678.A N GLU 678.A OE1 no hydrogen 2.352 N/A GLY 679.A N GLY 675.A O no hydrogen 2.727 N/A ILE 680.A N LEU 677.A O no hydrogen 2.595 N/A ARG 681.A N LEU 677.A O no hydrogen 2.902 N/A ARG 681.A NE GLN 685.A OE1 no hydrogen 2.956 N/A ARG 681.A NH2 GLN 685.A OE1 no hydrogen 2.666 N/A CYS 683.A SG GLY 679.A O no hydrogen 3.007 N/A ARG 684.A N ILE 680.A O no hydrogen 3.104 N/A ARG 684.A N ARG 681.A O no hydrogen 2.922 N/A GLN 685.A N ARG 681.A O no hydrogen 2.320 N/A GLY 686.A N ILE 682.A O no hydrogen 2.602 N/A PHE 687.A N TYR 492.A OH no hydrogen 2.751 N/A ILE 691.A N ILE 740.A O no hydrogen 2.926 N/A PHE 693.A N SER 738.A O no hydrogen 2.945 N/A PHE 696.A N VAL 692.A O no hydrogen 3.163 N/A ARG 697.A N PHE 693.A O no hydrogen 3.497 N/A ARG 697.A NE GLU 701.A OE1 no hydrogen 2.941 N/A ARG 699.A N GLU 695.A O no hydrogen 2.883 N/A ARG 699.A NE GLU 751.A OE2 no hydrogen 2.897 N/A ARG 699.A NH2 GLU 751.A OE2 no hydrogen 3.074 N/A TYR 700.A N PHE 696.A O no hydrogen 3.328 N/A TYR 700.A OH GLU 751.A OE1 no hydrogen 2.538 N/A LYS 716.A N ASP 714.A OD1 no hydrogen 3.233 N/A GLN 717.A N ASP 714.A OD2 no hydrogen 3.436 N/A ALA 718.A N ASP 714.A O no hydrogen 2.592 N/A CYS 719.A N GLY 715.A O no hydrogen 2.985 N/A CYS 719.A N LYS 716.A O no hydrogen 2.558 N/A CYS 719.A SG LYS 716.A O no hydrogen 3.592 N/A ILE 720.A N LYS 716.A O no hydrogen 2.956 N/A LEU 721.A N GLN 717.A O no hydrogen 3.157 N/A ILE 723.A N ILE 720.A O no hydrogen 3.272 N/A LYS 724.A N ILE 720.A O no hydrogen 3.377 N/A LYS 724.A N LEU 721.A O no hydrogen 2.835 N/A LYS 724.A NZ TYR 733.A OH no hydrogen 3.445 N/A ALA 725.A N LEU 721.A O no hydrogen 2.989 N/A LEU 726.A N ILE 723.A O no hydrogen 3.291 N/A GLU 727.A N LYS 724.A O no hydrogen 2.921 N/A LEU 728.A N ILE 723.A O no hydrogen 3.304 N/A ASN 731.A N ASP 729.A O no hydrogen 2.590 N/A LEU 732.A N ASP 729.A O no hydrogen 2.910 N/A GLY 736.A N LYS 739.A O no hydrogen 2.998 N/A GLN 737.A N GLU 495.A OE1 no hydrogen 2.854 N/A SER 738.A N GLU 495.A OE1 no hydrogen 2.774 N/A SER 738.A OG GLU 495.A OE2 no hydrogen 3.412 N/A LYS 739.A NZ GLU 491.A OE1 no hydrogen 3.455 N/A ILE 740.A N ILE 691.A O no hydrogen 2.673 N/A PHE 741.A N ARG 734.A O no hydrogen 2.619 N/A PHE 742.A N ASN 689.A O no hydrogen 2.671 N/A ARG 743.A NE ASN 731.A O no hydrogen 2.712 N/A ARG 743.A NH2 ASN 731.A O no hydrogen 2.540 N/A THR 744.A OG1 CYS 683.A O no hydrogen 3.012 N/A VAL 746.A N ARG 743.A O no hydrogen 3.049 N/A HIS 749.A N GLY 745.A O no hydrogen 3.177 N/A GLU 751.A N LEU 747.A O no hydrogen 2.966 N/A GLU 752.A N ALA 748.A O no hydrogen 2.918 N/A GLU 753.A N HIS 749.A O no hydrogen 3.117 N/A ARG 754.A N LEU 750.A O no hydrogen 3.325 N/A ARG 754.A NH2 GLU 751.A OE2 no hydrogen 2.650 N/A ASP 755.A N GLU 751.A O no hydrogen 2.967 N/A LEU 756.A N GLU 752.A O no hydrogen 3.011 N/A LEU 756.A N GLU 753.A O no hydrogen 2.747 N/A LYS 757.A N GLU 753.A O no hydrogen 2.711 N/A THR 759.A N LEU 756.A O no hydrogen 3.166 N/A THR 759.A OG1 ASP 755.A O no hydrogen 3.138 N/A THR 759.A OG1 LEU 756.A O no hydrogen 2.504 N/A VAL 761.A N ASP 760.A OD1 no hydrogen 3.010 N/A ILE 762.A N ILE 758.A O no hydrogen 2.990 N/A ILE 763.A N THR 759.A O no hydrogen 2.635 N/A ALA 764.A N ASP 760.A O no hydrogen 2.492 N/A PHE 765.A N VAL 761.A O no hydrogen 2.643 N/A GLN 766.A N ILE 762.A O no hydrogen 2.593 N/A ALA 767.A N ILE 763.A O no hydrogen 3.245 N/A ALA 767.A N ALA 764.A O no hydrogen 3.172 N/A CYS 769.A N PHE 765.A O no hydrogen 3.146 N/A CYS 769.A SG PHE 765.A O no hydrogen 3.466 N/A ARG 770.A N GLN 766.A O no hydrogen 3.061 N/A GLY 771.A N ALA 767.A O no hydrogen 2.779 N/A TYR 772.A N GLN 768.A O no hydrogen 2.658 N/A LEU 773.A N CYS 769.A O no hydrogen 2.593 N/A ALA 774.A N GLY 771.A O no hydrogen 2.563 N/A ARG 775.A N GLY 771.A O no hydrogen 2.975 N/A LYS 776.A N TYR 772.A O no hydrogen 3.281 N/A PHE 778.A N ALA 774.A O no hydrogen 3.107 N/A ALA 779.A N ARG 775.A O no hydrogen 3.209 N/A GLN 782.A N PHE 778.A O no hydrogen 3.284 N/A GLN 783.A N LYS 780.A O no hydrogen 2.648 N/A GLN 784.A N GLN 784.A OE1 no hydrogen 3.096 N/A GLY 786.A N GLN 782.A O no hydrogen 2.767 N/A SER 787.A OG GLN 783.A O no hydrogen 2.732 N/A