Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2nup_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N GLU 4.A OE1 no hydrogen 3.254 N/A PHE 5.A N THR 1.A O no hydrogen 2.877 N/A ILE 6.A N TYR 2.A O no hydrogen 3.031 N/A GLN 7.A N LEU 3.A O no hydrogen 2.868 N/A GLN 8.A N GLU 4.A O no hydrogen 2.854 N/A ASN 9.A N PHE 5.A O no hydrogen 3.072 N/A GLU 10.A N ILE 6.A O no hydrogen 3.182 N/A GLU 10.A N GLN 7.A O no hydrogen 3.190 N/A GLU 11.A N GLN 7.A O no hydrogen 2.978 N/A ARG 12.A N GLN 8.A O no hydrogen 2.975 N/A ARG 12.A NH1 ASP 13.A OD2 no hydrogen 3.099 N/A ASP 13.A N ASN 9.A O no hydrogen 2.934 N/A ARG 16.A N LEU 39.A O no hydrogen 3.161 N/A ARG 16.A NE ASP 490.A OD2 no hydrogen 3.324 N/A ARG 16.A NH1 GLU 10.A OE1 no hydrogen 2.872 N/A ARG 16.A NH2 ASP 490.A OD1 no hydrogen 3.366 N/A ARG 16.A NH2 GLU 492.A OE1 no hydrogen 2.841 N/A SER 18.A N ALA 37.A O no hydrogen 2.792 N/A SER 18.A OG PRO 35.A O no hydrogen 2.656 N/A SER 18.A OG ALA 37.A O no hydrogen 3.311 N/A TRP 19.A NE1 VAL 34.A O no hydrogen 2.799 N/A ASN 20.A N SER 488.A O no hydrogen 3.069 N/A ASN 20.A ND2 SER 488.A O no hydrogen 3.334 N/A TRP 22.A N ASN 474.A O no hydrogen 3.075 N/A TRP 22.A NE1 TRP 19.A O no hydrogen 2.795 N/A SER 24.A OG ALA 476.A O no hydrogen 2.886 N/A ALA 29.A N SER 25.A O no hydrogen 3.140 N/A THR 30.A N ARG 26.A O no hydrogen 3.490 N/A THR 30.A OG1 ARG 26.A O no hydrogen 3.267 N/A MET 32.A N ALA 29.A O no hydrogen 3.288 N/A ALA 37.A N SER 18.A OG no hydrogen 2.589 N/A ALA 38.A N ILE 440.A O no hydrogen 3.019 N/A LEU 39.A N ARG 16.A O no hydrogen 2.845 N/A PHE 40.A N LEU 438.A O no hydrogen 2.836 N/A THR 41.A N GLY 14.A O no hydrogen 2.904 N/A THR 41.A OG1 THR 437.A OG1 no hydrogen 2.582 N/A LYS 44.A N THR 41.A O no hydrogen 3.181 N/A LYS 44.A NZ GLU 10.A O no hydrogen 3.489 N/A ILE 52.A N GLU 116.A O no hydrogen 3.000 N/A TYR 54.A OH GLU 107.A OE2 no hydrogen 2.424 N/A CYS 59.A N ALA 66.A O no hydrogen 2.964 N/A CYS 59.A SG ASN 90.A OD1 no hydrogen 3.872 N/A SER 60.A N ASN 90.A OD1 no hydrogen 2.581 N/A SER 60.A OG SER 60.A O no hydrogen 2.537 N/A SER 60.A OG ASN 90.A OD1 no hydrogen 2.571 N/A ARG 61.A N CYS 59.A O no hydrogen 3.177 N/A ARG 61.A NE GLN 88.A OE1 no hydrogen 3.218 N/A VAL 67.A N GLN 452.A OE1 no hydrogen 2.953 N/A LEU 68.A N VAL 57.A O no hydrogen 3.242 N/A ASN 69.A ND2 VAL 67.A O no hydrogen 2.873 N/A ASN 69.A ND2 ASN 84.A OD1 no hydrogen 3.181 N/A CYS 72.A N ASN 69.A O no hydrogen 2.839 N/A CYS 72.A SG ASN 69.A OD1 no hydrogen 3.577 N/A CYS 72.A SG ASN 84.A OD1 no hydrogen 3.242 N/A GLN 73.A N ALA 82.A O no hydrogen 3.291 N/A ARG 77.A N ASP 75.A OD1 no hydrogen 3.073 N/A ALA 78.A N ASP 75.A OD1 no hydrogen 3.349 N/A LYS 79.A NZ TYR 76.A O no hydrogen 3.179 N/A LYS 79.A NZ ILE 99.A O no hydrogen 3.407 N/A LEU 80.A N ASP 75.A O no hydrogen 3.436 N/A TRP 81.A N ASN 90.A O no hydrogen 3.005 N/A ALA 82.A N GLN 73.A O no hydrogen 2.768 N/A CYS 83.A N GLN 88.A O no hydrogen 2.822 N/A GLN 88.A NE2 ARG 89.A O no hydrogen 2.828 N/A ASN 90.A N TRP 81.A O no hydrogen 2.527 N/A GLN 91.A NE2 PHE 92.A O no hydrogen 3.312 N/A PHE 92.A N LYS 79.A O no hydrogen 3.188 N/A TYR 96.A N PRO 93.A O no hydrogen 2.679 N/A TYR 96.A OH GLU 107.A OE1 no hydrogen 2.581 N/A ALA 97.A N PRO 94.A O no hydrogen 2.911 N/A ILE 99.A N TYR 96.A O no hydrogen 2.926 N/A SER 100.A N ASN 103.A O no hydrogen 3.381 N/A SER 100.A OG ASN 103.A O no hydrogen 2.927 N/A GLU 107.A N GLU 107.A OE2 no hydrogen 2.577 N/A LEU 108.A N PRO 105.A O no hydrogen 3.212 N/A LEU 109.A N ALA 106.A O no hydrogen 2.894 N/A PHE 112.A N LEU 109.A O no hydrogen 2.775 N/A SER 113.A OG ASP 13.A OD1 no hydrogen 3.295 N/A SER 113.A OG ASP 13.A OD2 no hydrogen 3.259 N/A SER 113.A OG PRO 110.A O no hydrogen 3.468 N/A SER 114.A OG ARG 12.A O no hydrogen 3.198 N/A SER 114.A OG THR 469.A OG1 no hydrogen 2.779 N/A ILE 115.A N VAL 468.A O no hydrogen 2.619 N/A TYR 117.A N ILE 466.A O no hydrogen 2.872 N/A VAL 118.A N ILE 52.A O no hydrogen 2.797 N/A VAL 119.A N ARG 464.A O no hydrogen 3.168 N/A PHE 129.A N LEU 161.A O no hydrogen 2.881 N/A LEU 130.A N ARG 266.A O no hydrogen 2.810 N/A TYR 131.A N GLY 163.A O no hydrogen 2.979 N/A TYR 131.A OH SER 152.A OG no hydrogen 2.932 N/A VAL 132.A N MET 268.A O no hydrogen 2.935 N/A VAL 133.A N ILE 165.A O no hydrogen 2.564 N/A ASP 134.A N PHE 270.A O no hydrogen 3.203 N/A THR 135.A N PHE 167.A O no hydrogen 2.937 N/A THR 135.A OG1 PHE 167.A O no hydrogen 2.748 N/A CYS 136.A N ASP 134.A OD1 no hydrogen 2.753 N/A CYS 136.A SG LEU 242.A O no hydrogen 4.035 N/A LEU 142.A N GLU 138.A O no hydrogen 2.689 N/A GLN 143.A N ASP 139.A O no hydrogen 2.691 N/A ALA 144.A N GLU 140.A O no hydrogen 3.209 N/A LEU 145.A N ASP 141.A O no hydrogen 3.105 N/A LYS 146.A N LEU 142.A O no hydrogen 2.818 N/A LYS 146.A NZ GLY 226.A O no hydrogen 2.870 N/A LYS 146.A NZ LEU 228.A O no hydrogen 2.946 N/A GLU 147.A N GLN 143.A O no hydrogen 2.953 N/A SER 148.A N ALA 144.A O no hydrogen 2.895 N/A SER 148.A OG ALA 144.A O no hydrogen 3.220 N/A MET 149.A N LEU 145.A O no hydrogen 3.089 N/A GLN 150.A N LYS 146.A O no hydrogen 3.019 N/A GLN 150.A NE2 THR 222.A O no hydrogen 2.833 N/A MET 151.A N GLU 147.A O no hydrogen 2.941 N/A SER 152.A N SER 148.A O no hydrogen 3.161 N/A SER 152.A OG TYR 131.A OH no hydrogen 2.932 N/A SER 152.A OG MET 149.A O no hydrogen 2.545 N/A LEU 153.A N MET 149.A O no hydrogen 3.159 N/A SER 154.A N MET 151.A O no hydrogen 2.976 N/A SER 154.A OG MET 151.A O no hydrogen 2.873 N/A LEU 155.A N SER 152.A O no hydrogen 3.134 N/A LEU 156.A N SER 152.A O no hydrogen 3.345 N/A LEU 161.A N LEU 127.A O no hydrogen 2.592 N/A VAL 162.A N GLN 212.A O no hydrogen 3.002 N/A GLY 163.A N PHE 129.A O no hydrogen 2.984 N/A ILE 165.A N TYR 131.A O no hydrogen 2.749 N/A THR 166.A N GLN 172.A O no hydrogen 3.043 N/A THR 166.A OG1 HIS 174.A NE2 no hydrogen 3.063 N/A PHE 167.A N VAL 133.A O no hydrogen 2.750 N/A GLY 168.A N MET 170.A O no hydrogen 2.907 N/A VAL 171.A N PHE 187.A O no hydrogen 2.711 N/A GLN 172.A N THR 166.A O no hydrogen 2.747 N/A VAL 173.A N TYR 185.A O no hydrogen 3.010 N/A HIS 174.A N LEU 164.A O no hydrogen 3.018 N/A HIS 174.A NE2 THR 166.A OG1 no hydrogen 3.063 N/A GLU 175.A N LYS 183.A O no hydrogen 2.977 N/A LEU 176.A N ARG 209.A O no hydrogen 3.216 N/A CYS 178.A SG GLU 175.A OE2 no hydrogen 3.714 N/A ILE 181.A N GLU 179.A O no hydrogen 2.162 N/A SER 182.A N GLU 179.A O no hydrogen 3.402 N/A SER 182.A OG ILE 181.A O no hydrogen 2.395 N/A SER 184.A OG GLN 172.A OE1 no hydrogen 2.914 N/A TYR 185.A N VAL 173.A O no hydrogen 2.807 N/A PHE 187.A N VAL 171.A O no hydrogen 2.835 N/A LEU 193.A N ASP 192.A OD1 no hydrogen 2.788 N/A SER 194.A N GLN 197.A OE1 no hydrogen 2.548 N/A SER 194.A OG GLN 197.A OE1 no hydrogen 3.033 N/A ALA 195.A N SER 194.A OG no hydrogen 2.621 N/A LYS 196.A N SER 194.A OG no hydrogen 3.195 N/A GLN 197.A N SER 194.A OG no hydrogen 3.167 N/A GLN 199.A N ALA 195.A O no hydrogen 2.784 N/A GLU 200.A N LYS 196.A O no hydrogen 3.120 N/A MET 201.A N GLN 197.A O no hydrogen 2.877 N/A LEU 202.A N LEU 198.A O no hydrogen 2.993 N/A GLY 203.A N GLN 199.A O no hydrogen 2.934 N/A ARG 209.A NE GLU 175.A OE1 no hydrogen 3.106 N/A ARG 209.A NH1 LEU 202.A O no hydrogen 3.283 N/A ARG 209.A NH2 LEU 202.A O no hydrogen 2.854 N/A GLN 212.A N VAL 162.A O no hydrogen 3.142 N/A VAL 214.A N ALA 160.A O no hydrogen 2.733 N/A GLN 215.A N PRO 158.A O no hydrogen 3.252 N/A LYS 216.A N PRO 213.A O no hydrogen 3.053 N/A ILE 217.A N PRO 213.A O no hydrogen 3.039 N/A ASP 218.A N VAL 214.A O no hydrogen 2.649 N/A LEU 221.A N ILE 217.A O no hydrogen 3.017 N/A THR 222.A N ASP 218.A O no hydrogen 3.004 N/A ASP 223.A N MET 219.A O no hydrogen 3.040 N/A LEU 224.A N ASN 220.A O no hydrogen 2.727 N/A LEU 225.A N LEU 221.A O no hydrogen 2.833 N/A GLY 226.A N THR 222.A O no hydrogen 3.099 N/A GLU 227.A N ASP 223.A O no hydrogen 3.035 N/A GLU 227.A N LEU 224.A O no hydrogen 2.879 N/A LEU 228.A N LEU 224.A O no hydrogen 3.081 N/A ARG 230.A NH1 ASP 139.A OD1 no hydrogen 3.556 N/A ASP 231.A N THR 135.A O no hydrogen 2.776 N/A LYS 239.A N PRO 236.A O no hydrogen 3.136 N/A LYS 239.A NZ ASP 285.A OD2 no hydrogen 2.964 N/A ARG 240.A N ASP 285.A O no hydrogen 2.711 N/A ARG 240.A NE GLY 284.A O no hydrogen 2.912 N/A ARG 243.A N THR 276.A OG1 no hydrogen 2.836 N/A ARG 243.A NE PRO 274.A O no hydrogen 2.713 N/A ARG 243.A NH1 ASP 134.A OD2 no hydrogen 3.197 N/A ARG 243.A NH2 PRO 274.A O no hydrogen 3.461 N/A SER 244.A N GLY 168.A O no hydrogen 2.863 N/A SER 244.A OG GLY 168.A O no hydrogen 3.232 N/A SER 244.A OG ARG 169.A O no hydrogen 2.575 N/A SER 244.A OG GLY 189.A O no hydrogen 3.364 N/A ALA 248.A N SER 244.A O no hydrogen 3.009 N/A LEU 249.A N SER 245.A O no hydrogen 3.163 N/A SER 250.A N GLY 246.A O no hydrogen 3.126 N/A SER 250.A OG ASP 192.A OD1 no hydrogen 3.027 N/A SER 250.A OG GLY 246.A O no hydrogen 3.140 N/A SER 250.A OG VAL 247.A O no hydrogen 2.825 N/A ILE 251.A N VAL 247.A O no hydrogen 2.814 N/A ALA 252.A N ALA 248.A O no hydrogen 3.022 N/A VAL 253.A N LEU 249.A O no hydrogen 2.888 N/A GLY 254.A N SER 250.A O no hydrogen 2.800 N/A LEU 255.A N ILE 251.A O no hydrogen 2.809 N/A LEU 256.A N ALA 252.A O no hydrogen 3.262 N/A GLU 257.A N VAL 253.A O no hydrogen 2.796 N/A CYS 258.A N GLY 254.A O no hydrogen 3.042 N/A CYS 258.A N LEU 255.A O no hydrogen 3.353 N/A CYS 258.A SG GLY 254.A O no hydrogen 3.613 N/A CYS 258.A SG LEU 255.A O no hydrogen 3.432 N/A THR 259.A N LEU 256.A O no hydrogen 3.010 N/A THR 259.A OG1 LEU 255.A O no hydrogen 2.587 N/A PHE 260.A N LEU 256.A O no hydrogen 2.846 N/A ASN 262.A N THR 322.A O no hydrogen 2.902 N/A THR 263.A OG1 ASN 262.A O no hydrogen 2.641 N/A ARG 266.A N ILE 128.A O no hydrogen 2.615 N/A ARG 266.A NE ASP 327.A OD2 no hydrogen 2.764 N/A ILE 267.A N VAL 325.A O no hydrogen 2.935 N/A MET 268.A N LEU 130.A O no hydrogen 2.983 N/A MET 269.A N ASP 327.A O no hydrogen 2.946 N/A PHE 270.A N VAL 132.A O no hydrogen 2.974 N/A ILE 271.A N TYR 329.A O no hydrogen 2.738 N/A GLY 272.A N ASP 134.A OD2 no hydrogen 2.818 N/A THR 276.A N ARG 243.A O no hydrogen 3.100 N/A THR 276.A OG1 PRO 241.A O no hydrogen 2.676 N/A GLN 277.A NE2 ARG 169.A O no hydrogen 3.338 N/A GLN 277.A NE2 GLY 189.A O no hydrogen 3.108 N/A VAL 282.A N ALA 275.A O no hydrogen 2.804 N/A VAL 283.A N ALA 275.A O no hydrogen 3.426 N/A LEU 287.A N GLY 238.A O no hydrogen 2.935 N/A THR 289.A N GLU 286.A O no hydrogen 2.921 N/A ARG 292.A NE GLU 340.A OE2 no hydrogen 2.757 N/A ARG 292.A NH1 ARG 292.A O no hydrogen 3.067 N/A ARG 292.A NH2 GLU 340.A OE1 no hydrogen 2.783 N/A ARG 292.A NH2 GLU 340.A OE2 no hydrogen 3.165 N/A ARG 292.A NH2 ASP 567.A OD1 no hydrogen 2.961 N/A SER 293.A N ASP 296.A OD2 no hydrogen 3.137 N/A SER 293.A OG ASP 296.A OD2 no hydrogen 2.810 N/A TRP 294.A NE1 SER 569.A OG no hydrogen 2.967 N/A ASP 296.A N SER 293.A OG no hydrogen 3.088 N/A ILE 297.A N SER 293.A O no hydrogen 2.952 N/A ASP 298.A N TRP 294.A O no hydrogen 2.933 N/A ASP 298.A N HIS 295.A O no hydrogen 2.993 N/A LYS 299.A N HIS 295.A O no hydrogen 2.987 N/A ASN 301.A N ASP 296.A O no hydrogen 2.862 N/A GLY 308.A N TYR 304.A O no hydrogen 2.713 N/A THR 309.A N VAL 305.A O no hydrogen 2.664 N/A THR 309.A OG1 VAL 305.A O no hydrogen 2.986 N/A LYS 310.A N LYS 306.A O no hydrogen 2.720 N/A HIS 311.A N LYS 307.A O no hydrogen 3.167 N/A HIS 311.A NE2 GLY 246.A O no hydrogen 3.044 N/A PHE 312.A N GLY 308.A O no hydrogen 3.305 N/A GLU 313.A N THR 309.A O no hydrogen 2.873 N/A ALA 314.A N LYS 310.A O no hydrogen 2.944 N/A LEU 315.A N HIS 311.A O no hydrogen 3.186 N/A ALA 316.A N PHE 312.A O no hydrogen 2.795 N/A ASN 317.A N GLU 313.A O no hydrogen 3.212 N/A ARG 318.A N ALA 314.A O no hydrogen 2.870 N/A ARG 318.A NE GLU 257.A OE1 no hydrogen 3.484 N/A ALA 319.A N LEU 315.A O no hydrogen 2.879 N/A ALA 320.A N ALA 316.A O no hydrogen 2.789 N/A THR 321.A N ASN 317.A O no hydrogen 2.700 N/A THR 321.A OG1 ASN 317.A O no hydrogen 2.342 N/A THR 322.A N ARG 318.A O no hydrogen 3.130 N/A THR 322.A OG1 ARG 318.A O no hydrogen 2.892 N/A GLY 323.A N ALA 319.A O no hydrogen 2.772 N/A HIS 324.A N ALA 319.A O no hydrogen 2.960 N/A HIS 324.A NE2 PHE 260.A O no hydrogen 2.789 N/A VAL 325.A N ALA 265.A O no hydrogen 3.241 N/A ILE 326.A N THR 348.A OG1 no hydrogen 3.171 N/A ASP 327.A N ILE 267.A O no hydrogen 2.672 N/A ILE 328.A N TYR 351.A O no hydrogen 3.127 N/A TYR 329.A N MET 269.A O no hydrogen 2.661 N/A TYR 329.A OH ASP 327.A OD2 no hydrogen 2.867 N/A ALA 330.A N VAL 353.A O no hydrogen 3.041 N/A CYS 331.A N ILE 271.A O no hydrogen 2.989 N/A ALA 332.A N GLY 355.A O no hydrogen 3.190 N/A GLN 335.A NE2 ARG 292.A O no hydrogen 2.772 N/A THR 336.A N ASP 567.A OD2 no hydrogen 2.919 N/A GLY 337.A N ASP 567.A OD2 no hydrogen 2.825 N/A LEU 338.A N ASP 567.A OD2 no hydrogen 3.050 N/A LEU 339.A N ASP 567.A OD1 no hydrogen 3.052 N/A GLU 340.A N GLY 337.A O no hydrogen 3.290 N/A GLU 340.A N GLU 340.A OE1 no hydrogen 2.769 N/A MET 341.A N GLY 337.A O no hydrogen 3.154 N/A CYS 343.A SG GLU 313.A OE2 no hydrogen 3.855 N/A CYS 344.A N MET 341.A O no hydrogen 3.136 N/A CYS 344.A SG PHE 312.A O no hydrogen 3.496 N/A ASN 346.A N LYS 342.A O no hydrogen 3.092 N/A LEU 347.A N CYS 343.A O no hydrogen 2.682 N/A THR 348.A OG1 CYS 344.A O no hydrogen 2.635 N/A GLY 350.A N THR 348.A OG1 no hydrogen 3.103 N/A TYR 351.A N ASP 327.A OD1 no hydrogen 3.014 N/A VAL 353.A N ILE 328.A O no hydrogen 3.072 N/A GLY 355.A N ALA 330.A O no hydrogen 3.154 N/A SER 357.A OG ASP 141.A OD2 no hydrogen 2.376 N/A ASN 359.A N SER 357.A OG no hydrogen 2.886 N/A THR 360.A OG1 SER 357.A O no hydrogen 2.949 N/A PHE 363.A N THR 360.A OG1 no hydrogen 3.055 N/A LYS 364.A N THR 360.A O no hydrogen 3.091 N/A GLN 365.A N SER 361.A O no hydrogen 2.711 N/A THR 366.A N LEU 362.A O no hydrogen 2.919 N/A THR 366.A OG1 LEU 362.A O no hydrogen 2.704 N/A PHE 367.A N PHE 363.A O no hydrogen 2.684 N/A GLN 368.A N LYS 364.A O no hydrogen 3.258 N/A GLN 368.A N GLN 365.A O no hydrogen 3.244 N/A ARG 369.A N GLN 365.A O no hydrogen 3.304 N/A ARG 369.A N THR 366.A O no hydrogen 3.331 N/A ARG 369.A NH1 HIS 654.A ND1 no hydrogen 3.192 N/A ARG 369.A NH2 HIS 654.A ND1 no hydrogen 2.862 N/A PHE 371.A N GLN 368.A O no hydrogen 3.066 N/A THR 372.A N ARG 369.A O no hydrogen 2.689 N/A THR 372.A OG1 ARG 369.A O no hydrogen 2.704 N/A LYS 373.A NZ LEU 155.A O no hydrogen 3.001 N/A ASP 374.A N GLN 378.A O no hydrogen 2.962 N/A HIS 376.A N ASP 374.A O no hydrogen 2.396 N/A GLY 377.A N ASP 374.A O no hydrogen 2.687 N/A LYS 380.A N THR 372.A O no hydrogen 3.295 N/A LYS 380.A NZ LYS 373.A O no hydrogen 3.379 N/A GLY 382.A N LEU 432.A O no hydrogen 2.673 N/A PHE 383.A N GLN 458.A O no hydrogen 2.756 N/A GLY 384.A N CYS 430.A O no hydrogen 2.737 N/A GLY 385.A N ILE 429.A O no hydrogen 2.798 N/A THR 386.A N GLN 456.A O no hydrogen 2.657 N/A LEU 387.A N TRP 427.A O no hydrogen 2.772 N/A GLU 388.A N VAL 454.A O no hydrogen 3.016 N/A ILE 389.A N CYS 425.A O no hydrogen 3.059 N/A LYS 390.A N GLN 452.A O no hydrogen 2.813 N/A LYS 390.A NZ CYS 64.A O no hydrogen 2.379 N/A LYS 390.A NZ GLU 388.A OE2 no hydrogen 3.069 N/A THR 391.A OG1 SER 392.A O no hydrogen 2.993 N/A THR 391.A OG1 ILE 395.A O no hydrogen 2.640 N/A SER 392.A OG ALA 450.A O no hydrogen 3.288 N/A ILE 395.A N SER 392.A O no hydrogen 2.939 N/A LYS 396.A N GLU 443.A O no hydrogen 2.763 N/A ILE 397.A N CYS 413.A O no hydrogen 2.567 N/A SER 398.A N TYR 441.A O no hydrogen 2.766 N/A SER 398.A OG ASN 417.A O no hydrogen 3.305 N/A SER 398.A OG GLU 443.A OE1 no hydrogen 3.330 N/A GLY 399.A N TYR 441.A O no hydrogen 3.415 N/A ALA 400.A N THR 421.A O no hydrogen 3.065 N/A ILE 401.A N ALA 439.A O no hydrogen 2.988 N/A CYS 404.A SG GLY 402.A O no hydrogen 3.598 N/A VAL 405.A N LYS 428.A O no hydrogen 2.913 N/A LEU 407.A N GLN 426.A O no hydrogen 3.149 N/A ASN 408.A N SER 406.A OG no hydrogen 2.606 N/A SER 409.A N THR 424.A OG1 no hydrogen 3.171 N/A SER 409.A OG THR 424.A OG1 no hydrogen 3.100 N/A LYS 410.A NZ ASN 408.A OD1 no hydrogen 3.120 N/A LYS 410.A NZ GLY 423.A O no hydrogen 2.969 N/A CYS 413.A SG THR 391.A OG1 no hydrogen 3.696 N/A VAL 414.A N GLY 411.A O no hydrogen 2.777 N/A SER 415.A N ILE 397.A O no hydrogen 3.046 N/A SER 415.A OG ASN 417.A O no hydrogen 3.248 N/A SER 415.A OG GLU 443.A OE2 no hydrogen 3.508 N/A ILE 419.A N SER 398.A O no hydrogen 2.735 N/A THR 421.A N ALA 400.A O no hydrogen 2.827 N/A THR 424.A OG1 SER 409.A OG no hydrogen 3.100 N/A THR 424.A OG1 GLN 426.A O no hydrogen 2.649 N/A CYS 425.A N SER 409.A OG no hydrogen 3.237 N/A GLN 426.A N THR 424.A OG1 no hydrogen 3.054 N/A TRP 427.A N LEU 387.A O no hydrogen 2.711 N/A TRP 427.A NE1 THR 421.A O no hydrogen 3.122 N/A LYS 428.A N VAL 405.A O no hydrogen 2.680 N/A LYS 428.A NZ THR 321.A O no hydrogen 2.788 N/A ILE 429.A N GLY 385.A O no hydrogen 2.654 N/A CYS 430.A SG ALA 320.A O no hydrogen 3.440 N/A CYS 430.A SG HIS 324.A O no hydrogen 3.833 N/A LEU 432.A N GLY 382.A O no hydrogen 3.029 N/A SER 433.A N THR 436.A OG1 no hydrogen 2.927 N/A THR 435.A N SER 433.A OG no hydrogen 3.185 N/A THR 436.A OG1 SER 433.A O no hydrogen 3.565 N/A THR 437.A OG1 THR 41.A OG1 no hydrogen 2.582 N/A THR 437.A OG1 THR 435.A O no hydrogen 3.137 N/A LEU 438.A N PHE 40.A O no hydrogen 2.960 N/A ALA 439.A N ILE 401.A O no hydrogen 2.875 N/A ILE 440.A N ALA 38.A O no hydrogen 2.777 N/A TYR 441.A N GLY 399.A O no hydrogen 2.786 N/A TYR 441.A OH LEU 497.A O no hydrogen 2.681 N/A PHE 442.A N VAL 36.A O no hydrogen 2.898 N/A GLU 443.A N LYS 396.A O no hydrogen 2.703 N/A VAL 445.A N GLU 394.A O no hydrogen 2.970 N/A ARG 448.A NH1 ALA 472.A O no hydrogen 2.586 N/A GLY 449.A N ARG 473.A O no hydrogen 2.576 N/A ALA 450.A N SER 392.A OG no hydrogen 2.716 N/A ILE 451.A N ILE 471.A O no hydrogen 3.295 N/A GLN 452.A N LYS 390.A O no hydrogen 2.635 N/A GLN 452.A NE2 VAL 67.A O no hydrogen 2.755 N/A GLN 452.A NE2 THR 470.A OG1 no hydrogen 3.150 N/A PHE 453.A N THR 469.A O no hydrogen 2.672 N/A VAL 454.A N GLU 388.A O no hydrogen 2.905 N/A THR 455.A N ARG 467.A O no hydrogen 2.774 N/A GLN 456.A N THR 386.A O no hydrogen 3.081 N/A TYR 457.A N ARG 465.A O no hydrogen 3.032 N/A TYR 457.A OH GLU 116.A OE2 no hydrogen 2.586 N/A GLN 458.A N PHE 383.A O no hydrogen 2.697 N/A HIS 459.A N GLN 463.A O no hydrogen 2.873 N/A SER 460.A OG PHE 379.A O no hydrogen 2.535 N/A SER 460.A OG MET 381.A O no hydrogen 3.012 N/A SER 461.A N HIS 459.A ND1 no hydrogen 2.998 N/A SER 461.A OG HIS 459.A ND1 no hydrogen 3.042 N/A GLY 462.A N HIS 459.A O no hydrogen 2.978 N/A GLN 463.A N SER 461.A OG no hydrogen 3.012 N/A ARG 465.A N TYR 457.A O no hydrogen 3.044 N/A ARG 465.A NH1 GLU 116.A OE1 no hydrogen 3.181 N/A ARG 465.A NH2 GLN 463.A OE1 no hydrogen 3.424 N/A ILE 466.A N TYR 117.A O no hydrogen 2.969 N/A ARG 467.A N THR 455.A O no hydrogen 2.676 N/A ARG 467.A NH2 LYS 44.A O no hydrogen 2.684 N/A VAL 468.A N ILE 115.A O no hydrogen 2.731 N/A THR 469.A N PHE 453.A O no hydrogen 2.955 N/A THR 469.A OG1 SER 114.A OG no hydrogen 2.779 N/A ILE 471.A N ILE 451.A O no hydrogen 3.091 N/A ARG 473.A N GLY 449.A O no hydrogen 2.963 N/A ARG 473.A NE ASN 20.A OD1 no hydrogen 3.192 N/A ARG 473.A NH1 ALA 472.A O no hydrogen 3.127 N/A ALA 476.A N TRP 22.A O no hydrogen 2.800 N/A THR 480.A N ASP 477.A O no hydrogen 2.623 N/A GLN 481.A NE2 SER 25.A OG no hydrogen 2.948 N/A ASN 484.A N THR 480.A O no hydrogen 3.251 N/A ALA 486.A N ILE 482.A O no hydrogen 2.737 N/A ALA 487.A N GLN 483.A O no hydrogen 3.139 N/A SER 488.A N ASN 484.A O no hydrogen 2.872 N/A SER 488.A OG ASN 484.A O no hydrogen 3.390 N/A SER 488.A OG ILE 485.A O no hydrogen 2.996 N/A ASP 490.A N SER 18.A O no hydrogen 3.236 N/A ALA 493.A N ASP 490.A OD1 no hydrogen 3.063 N/A ALA 494.A N ASP 490.A O no hydrogen 2.777 N/A ALA 495.A N GLN 491.A O no hydrogen 2.878 N/A ILE 496.A N GLU 492.A O no hydrogen 3.075 N/A LEU 497.A N ALA 493.A O no hydrogen 3.022 N/A MET 498.A N ALA 494.A O no hydrogen 2.650 N/A ALA 499.A N ALA 495.A O no hydrogen 2.969 N/A ARG 500.A N ILE 496.A O no hydrogen 2.846 N/A LEU 501.A N LEU 497.A O no hydrogen 3.461 N/A ALA 502.A N MET 498.A O no hydrogen 3.244 N/A ILE 503.A N ALA 499.A O no hydrogen 2.981 N/A TYR 504.A N ARG 500.A O no hydrogen 2.967 N/A ARG 505.A N LEU 501.A O no hydrogen 3.062 N/A ALA 506.A N ALA 502.A O no hydrogen 2.835 N/A GLU 507.A N ILE 503.A O no hydrogen 2.698 N/A THR 508.A N ARG 505.A O no hydrogen 3.087 N/A THR 508.A OG1 TYR 504.A O no hydrogen 3.111 N/A GLU 509.A N ALA 506.A O no hydrogen 3.133 N/A LEU 512.A N ASP 510.A OD1 no hydrogen 3.229 N/A LEU 515.A N VAL 511.A O no hydrogen 3.085 N/A ASP 516.A N LEU 512.A O no hydrogen 2.949 N/A ARG 517.A N ARG 513.A O no hydrogen 3.133 N/A LEU 519.A N LEU 515.A O no hydrogen 3.255 N/A ILE 520.A N ASP 516.A O no hydrogen 2.717 N/A ARG 521.A N ARG 517.A O no hydrogen 3.186 N/A LEU 522.A N GLN 518.A O no hydrogen 2.872 N/A CYS 523.A N LEU 519.A O no hydrogen 2.818 N/A CYS 523.A SG LEU 519.A O no hydrogen 3.358 N/A GLN 524.A N ILE 520.A O no hydrogen 3.004 N/A GLN 524.A NE2 ALA 695.A O no hydrogen 3.036 N/A GLN 524.A NE2 SER 698.A O no hydrogen 3.181 N/A LYS 525.A N ARG 521.A O no hydrogen 2.932 N/A LYS 525.A NZ ARG 31.A O no hydrogen 2.793 N/A PHE 526.A N LEU 522.A O no hydrogen 3.144 N/A GLY 527.A N CYS 523.A O no hydrogen 2.957 N/A GLU 528.A N ARG 538.A O no hydrogen 3.030 N/A TYR 529.A OH GLN 524.A O no hydrogen 3.112 N/A HIS 530.A N SER 536.A OG no hydrogen 2.657 N/A ASP 532.A N VAL 696.A O no hydrogen 2.573 N/A ASP 533.A N HIS 530.A O no hydrogen 2.936 N/A SER 536.A N ASP 533.A O no hydrogen 2.974 N/A SER 536.A OG HIS 530.A O no hydrogen 3.441 N/A SER 536.A OG ASP 533.A O no hydrogen 2.542 N/A PHE 537.A N PRO 534.A O no hydrogen 2.977 N/A ARG 538.A N GLU 528.A O no hydrogen 3.082 N/A ARG 538.A NE SER 536.A O no hydrogen 2.946 N/A PHE 543.A N SER 540.A O no hydrogen 2.820 N/A SER 544.A N SER 540.A O no hydrogen 2.710 N/A LEU 545.A N GLN 491.A OE1 no hydrogen 3.445 N/A TYR 546.A N PHE 543.A O no hydrogen 2.896 N/A PHE 549.A N LEU 545.A O no hydrogen 3.073 N/A MET 550.A N TYR 546.A O no hydrogen 3.008 N/A PHE 551.A N PRO 547.A O no hydrogen 2.772 N/A HIS 552.A N GLN 548.A O no hydrogen 2.947 N/A LEU 553.A N PHE 549.A O no hydrogen 2.879 N/A ARG 554.A N MET 550.A O no hydrogen 2.930 N/A ARG 554.A NE ASP 516.A OD1 no hydrogen 3.288 N/A ARG 554.A NH2 ASP 516.A OD1 no hydrogen 3.477 N/A ARG 554.A NH2 ASP 516.A OD2 no hydrogen 2.672 N/A ARG 555.A N HIS 552.A O no hydrogen 3.146 N/A SER 556.A OG LEU 553.A O no hydrogen 3.144 N/A PHE 558.A N SER 556.A OG no hydrogen 2.886 N/A GLN 560.A N SER 556.A O no hydrogen 3.308 N/A GLN 560.A NE2 ARG 554.A O no hydrogen 3.275 N/A SER 565.A N GLU 568.A OE1 no hydrogen 3.242 N/A ASP 567.A N GLN 335.A OE1 no hydrogen 3.056 N/A GLU 568.A N SER 565.A OG no hydrogen 3.176 N/A SER 569.A N SER 565.A O no hydrogen 2.879 N/A SER 569.A OG SER 565.A O no hydrogen 3.034 N/A SER 570.A N PRO 566.A O no hydrogen 2.811 N/A SER 570.A OG PRO 566.A O no hydrogen 2.980 N/A TYR 571.A N ASP 567.A O no hydrogen 3.019 N/A TYR 572.A N GLU 568.A O no hydrogen 3.051 N/A ARG 573.A N SER 569.A O no hydrogen 3.070 N/A ARG 573.A NE PHE 558.A O no hydrogen 3.105 N/A HIS 574.A N SER 570.A O no hydrogen 2.997 N/A HIS 574.A ND1 ASN 346.A OD1 no hydrogen 2.628 N/A HIS 575.A N TYR 571.A O no hydrogen 3.315 N/A HIS 575.A NE2 MET 352.A O no hydrogen 3.049 N/A PHE 576.A N TYR 572.A O no hydrogen 3.003 N/A MET 577.A N ARG 573.A O no hydrogen 2.973 N/A ARG 578.A N HIS 575.A O no hydrogen 3.180 N/A ARG 578.A NH1 PRO 345.A O no hydrogen 3.377 N/A ARG 578.A NH2 PRO 345.A O no hydrogen 3.564 N/A GLN 579.A N HIS 575.A O no hydrogen 3.206 N/A ASP 580.A N GLN 579.A OE1 no hydrogen 3.450 N/A THR 582.A OG1 ASP 580.A OD2 no hydrogen 3.458 N/A GLN 583.A N ASP 580.A OD2 no hydrogen 3.167 N/A SER 584.A N ASP 580.A O no hydrogen 3.063 N/A SER 584.A OG ASP 580.A O no hydrogen 3.141 N/A LEU 585.A N LEU 581.A O no hydrogen 3.075 N/A ILE 586.A N THR 582.A O no hydrogen 3.189 N/A MET 587.A N GLN 583.A O no hydrogen 2.976 N/A ILE 588.A N SER 584.A O no hydrogen 3.056 N/A GLN 589.A N LEU 585.A O no hydrogen 2.675 N/A ILE 591.A N ASP 620.A O no hydrogen 3.396 N/A TYR 593.A N LEU 618.A O no hydrogen 2.817 N/A ALA 594.A N GLU 602.A O no hydrogen 2.643 N/A TYR 595.A N ILE 616.A O no hydrogen 2.726 N/A TYR 595.A OH ASP 648.A OD2 no hydrogen 3.026 N/A SER 596.A OG SER 598.A OG no hydrogen 3.093 N/A SER 598.A OG SER 596.A OG no hydrogen 3.093 N/A GLY 599.A N PHE 597.A O no hydrogen 2.756 N/A GLU 602.A N ALA 594.A O no hydrogen 3.052 N/A VAL 604.A N LEU 592.A O no hydrogen 2.780 N/A SER 610.A N ASP 607.A O no hydrogen 2.804 N/A SER 610.A OG LEU 605.A O no hydrogen 2.862 N/A ILE 611.A N SER 608.A O no hydrogen 2.709 N/A LEU 612.A N SER 610.A O no hydrogen 3.047 N/A ARG 615.A NH2 SER 610.A O no hydrogen 2.779 N/A ILE 616.A N TYR 595.A O no hydrogen 2.776 N/A LEU 617.A N TYR 628.A O no hydrogen 2.910 N/A LEU 618.A N TYR 593.A O no hydrogen 2.848 N/A MET 619.A N LEU 626.A O no hydrogen 2.724 N/A ASP 620.A N ILE 591.A O no hydrogen 2.973 N/A THR 621.A N GLN 624.A O no hydrogen 2.823 N/A GLN 624.A N THR 621.A O no hydrogen 2.597 N/A ILE 625.A N ARG 661.A O no hydrogen 2.880 N/A LEU 626.A N MET 619.A O no hydrogen 2.877 N/A ILE 627.A N ILE 663.A O no hydrogen 2.957 N/A TYR 628.A N LEU 617.A O no hydrogen 2.751 N/A GLY 630.A N ARG 615.A O no hydrogen 3.365 N/A ILE 633.A N ALA 613.A O no hydrogen 3.431 N/A ALA 634.A N GLY 630.A O no hydrogen 3.021 N/A ALA 634.A N GLU 631.A O no hydrogen 3.250 N/A GLN 635.A N THR 632.A O no hydrogen 3.377 N/A HIS 640.A N GLU 636.A O no hydrogen 3.145 N/A LEU 641.A N ASN 637.A O no hydrogen 3.305 N/A LEU 642.A N PHE 638.A O no hydrogen 2.922 N/A GLN 643.A N ARG 639.A O no hydrogen 2.864 N/A ALA 644.A N LEU 641.A O no hydrogen 2.657 N/A ASP 647.A N GLN 643.A O no hydrogen 2.929 N/A ASP 648.A N ALA 644.A O no hydrogen 3.291 N/A ALA 649.A N PRO 645.A O no hydrogen 2.855 N/A GLN 650.A N VAL 646.A O no hydrogen 3.345 N/A LEU 653.A N ALA 649.A O no hydrogen 2.744 N/A HIS 654.A N ILE 652.A O no hydrogen 2.481 N/A SER 655.A OG ILE 652.A O no hydrogen 3.449 N/A ARG 656.A NH1 ASP 620.A OD1 no hydrogen 2.896 N/A ARG 656.A NH1 ASP 620.A OD2 no hydrogen 3.502 N/A ARG 656.A NH2 GLN 583.A OE1 no hydrogen 3.516 N/A ARG 656.A NH2 ASP 620.A OD1 no hydrogen 3.526 N/A ARG 656.A NH2 ASP 620.A OD2 no hydrogen 3.034 N/A MET 659.A N THR 366.A OG1 no hydrogen 3.270 N/A ARG 661.A N PHE 623.A O no hydrogen 3.075 N/A ILE 663.A N ILE 625.A O no hydrogen 2.955 N/A THR 665.A N ILE 627.A O no hydrogen 3.227 N/A THR 665.A OG1 GLU 666.A O no hydrogen 3.517 N/A GLU 666.A N THR 665.A OG1 no hydrogen 2.558 N/A HIS 667.A N HIS 629.A O no hydrogen 3.152 N/A GLY 669.A N GLU 666.A O no hydrogen 2.672 N/A ALA 672.A N GLY 669.A O no hydrogen 3.384 N/A ARG 673.A N SER 670.A O no hydrogen 3.375 N/A PHE 674.A N GLN 671.A O no hydrogen 3.273 N/A LEU 675.A N ALA 672.A O no hydrogen 3.107 N/A LEU 676.A N ALA 672.A O no hydrogen 3.260 N/A SER 677.A N ARG 673.A O no hydrogen 3.067 N/A SER 677.A OG ARG 673.A O no hydrogen 2.944 N/A SER 677.A OG PHE 674.A O no hydrogen 3.148 N/A LYS 678.A N LEU 675.A O no hydrogen 3.143 N/A VAL 679.A N LEU 675.A O no hydrogen 3.099 N/A GLN 685.A N GLN 685.A OE1 no hydrogen 2.660 N/A PHE 687.A N SER 683.A O no hydrogen 2.846 N/A MET 688.A N LEU 684.A O no hydrogen 2.658 N/A ASP 689.A N GLN 685.A O no hydrogen 3.063 N/A HIS 690.A N VAL 686.A O no hydrogen 3.049 N/A HIS 690.A ND1 ASP 681.A OD2 no hydrogen 3.172 N/A LEU 691.A N PHE 687.A O no hydrogen 3.050 N/A LYS 692.A N MET 688.A O no hydrogen 2.917 N/A LYS 693.A N ASP 689.A O no hydrogen 2.909 N/A LEU 694.A N HIS 690.A O no hydrogen 3.163 N/A ALA 695.A N LEU 691.A O no hydrogen 2.760 N/A VAL 696.A N LYS 692.A O no hydrogen 2.998 N/A SER 697.A OG LEU 694.A O no hydrogen 3.283 N/A