Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ai7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N SER 54.A OG no hydrogen 2.746 N/A THR 4.A OG1 SER 54.A OG no hydrogen 3.334 N/A GLN 8.A N THR 4.A O no hydrogen 2.835 N/A GLN 8.A NE2 HIS 3.A O no hydrogen 2.744 N/A GLN 9.A N PRO 5.A O no hydrogen 3.274 N/A TYR 10.A N MET 6.A O no hydrogen 2.946 N/A TYR 10.A OH PHE 33.A O no hydrogen 2.875 N/A LEU 11.A N MET 7.A O no hydrogen 3.098 N/A ARG 12.A N GLN 8.A O no hydrogen 3.136 N/A LEU 13.A N GLN 9.A O no hydrogen 3.142 N/A LYS 14.A N TYR 10.A O no hydrogen 2.670 N/A LYS 14.A NZ PRO 18.A O no hydrogen 3.046 N/A LYS 14.A NZ ASP 36.A OD1 no hydrogen 3.142 N/A LYS 14.A NZ ASP 36.A OD2 no hydrogen 3.205 N/A ALA 15.A N LEU 11.A O no hydrogen 2.753 N/A LEU 22.A N ASP 36.A OD2 no hydrogen 3.418 N/A PHE 23.A N ALA 84.A O no hydrogen 2.917 N/A TYR 24.A OH MET 6.A O no hydrogen 2.925 N/A ARG 25.A N CYS 86.A O no hydrogen 3.312 N/A ARG 25.A NE GLY 27.A O no hydrogen 2.805 N/A ARG 25.A NH1 ASP 214.A OD1 no hydrogen 3.296 N/A ARG 25.A NH2 ASP 214.A OD1 no hydrogen 3.084 N/A MET 26.A N PHE 29.A O no hydrogen 3.121 N/A PHE 29.A N MET 26.A O no hydrogen 3.254 N/A TYR 30.A OH GLU 87.A OE2 no hydrogen 2.462 N/A GLU 31.A N TYR 24.A O no hydrogen 3.163 N/A LEU 32.A N ALA 62.A O no hydrogen 3.006 N/A ASP 36.A N PHE 33.A O no hydrogen 3.269 N/A LYS 38.A NZ TYR 34.A O no hydrogen 3.421 N/A ARG 39.A N ASP 35.A O no hydrogen 2.962 N/A ALA 40.A N ASP 36.A O no hydrogen 2.847 N/A SER 41.A N ALA 37.A O no hydrogen 2.738 N/A SER 41.A OG ILE 46.A O no hydrogen 3.493 N/A LEU 43.A N ALA 40.A O no hydrogen 3.345 N/A LEU 44.A N ALA 40.A O no hydrogen 2.803 N/A ASP 45.A N SER 41.A O no hydrogen 3.085 N/A THR 49.A N MET 61.A O no hydrogen 2.806 N/A ARG 51.A N ILE 59.A O no hydrogen 3.145 N/A SER 54.A OG HIS 3.A ND1 no hydrogen 3.412 N/A SER 54.A OG THR 4.A OG1 no hydrogen 3.334 N/A MET 61.A N THR 49.A O no hydrogen 2.655 N/A ALA 62.A N LEU 32.A O no hydrogen 3.119 N/A ILE 64.A N TYR 30.A O no hydrogen 2.721 N/A GLU 70.A N GLU 70.A OE2 no hydrogen 2.739 N/A TYR 72.A N ALA 68.A O no hydrogen 3.250 N/A LEU 73.A N VAL 69.A O no hydrogen 2.514 N/A ALA 74.A N GLU 70.A O no hydrogen 3.373 N/A LEU 76.A N TYR 72.A O no hydrogen 2.904 N/A VAL 77.A N LEU 73.A O no hydrogen 3.074 N/A ASN 78.A N ALA 74.A O no hydrogen 3.007 N/A GLN 79.A N LEU 76.A O no hydrogen 2.950 N/A GLY 80.A N VAL 77.A O no hydrogen 2.991 N/A SER 82.A OG VAL 107.A O no hydrogen 3.048 N/A VAL 83.A N VAL 107.A O no hydrogen 3.080 N/A ALA 84.A N LEU 21.A O no hydrogen 3.127 N/A ILE 85.A N ARG 105.A O no hydrogen 3.202 N/A CYS 86.A N PHE 23.A O no hydrogen 2.826 N/A GLY 90.A N GLU 100.A O no hydrogen 2.995 N/A ALA 93.A N ASP 91.A OD1 no hydrogen 3.034 N/A THR 94.A OG1 ALA 93.A O no hydrogen 2.597 N/A SER 95.A OG ASP 91.A O no hydrogen 2.774 N/A ARG 101.A NE VAL 99.A O no hydrogen 3.028 N/A ARG 105.A NH2 GLY 217.A O no hydrogen 3.107 N/A THR 111.A OG1 ASP 644.A OD2 no hydrogen 2.805 N/A ALA 127.A N GLU 170.A O no hydrogen 2.805 N/A ALA 128.A N ALA 139.A O no hydrogen 2.760 N/A ILE 129.A N LEU 172.A O no hydrogen 2.760 N/A TRP 130.A N GLY 137.A O no hydrogen 2.871 N/A ASP 132.A N GLY 135.A O no hydrogen 2.997 N/A LYS 134.A NZ ASP 132.A OD2 no hydrogen 3.566 N/A GLY 135.A N ASP 132.A OD1 no hydrogen 3.183 N/A PHE 136.A N PRO 153.A O no hydrogen 3.332 N/A GLY 137.A N TRP 130.A O no hydrogen 2.684 N/A TYR 138.A N SER 151.A O no hydrogen 2.637 N/A TYR 138.A OH THR 166.A OG1 no hydrogen 3.026 N/A ALA 139.A N ALA 128.A O no hydrogen 2.788 N/A THR 140.A N ARG 149.A O no hydrogen 2.969 N/A LEU 141.A N LEU 126.A O no hydrogen 2.757 N/A ASP 142.A N ARG 147.A O no hydrogen 2.924 N/A SER 144.A OG ASP 142.A OD1 no hydrogen 3.073 N/A SER 145.A OG ASP 142.A O no hydrogen 3.509 N/A GLY 146.A N ASP 142.A O no hydrogen 2.706 N/A ARG 147.A N SER 145.A OG no hydrogen 3.398 N/A ARG 149.A N THR 140.A O no hydrogen 2.866 N/A ARG 149.A NH1 PHE 148.A O no hydrogen 3.440 N/A ARG 149.A NH1 THR 252.A OG1 no hydrogen 2.890 N/A SER 151.A N TYR 138.A O no hydrogen 2.874 N/A SER 151.A OG GLU 162.A OE2 no hydrogen 3.283 N/A THR 158.A OG1 ASP 155.A OD2 no hydrogen 3.355 N/A ALA 160.A N ARG 156.A O no hydrogen 2.861 N/A ALA 161.A N GLU 157.A O no hydrogen 2.896 N/A GLU 162.A N THR 158.A O no hydrogen 2.729 N/A LEU 163.A N MET 159.A O no hydrogen 2.929 N/A GLN 164.A N ALA 160.A O no hydrogen 2.980 N/A ARG 165.A N ALA 161.A O no hydrogen 2.733 N/A ARG 165.A NH1 GLU 254.A OE1 no hydrogen 2.865 N/A ARG 165.A NH2 GLU 254.A OE1 no hydrogen 3.061 N/A THR 166.A N GLU 162.A O no hydrogen 2.879 N/A THR 166.A OG1 TYR 138.A OH no hydrogen 3.026 N/A THR 166.A OG1 GLU 162.A O no hydrogen 2.723 N/A THR 166.A OG1 LEU 163.A O no hydrogen 2.954 N/A ASN 167.A N LEU 163.A O no hydrogen 3.006 N/A LEU 171.A N GLY 188.A O no hydrogen 2.905 N/A LEU 172.A N ALA 127.A O no hydrogen 2.587 N/A TYR 173.A N ARG 190.A O no hydrogen 2.851 N/A PHE 177.A N ALA 174.A O no hydrogen 3.510 N/A ALA 178.A N GLN 131.A OE1 no hydrogen 3.358 N/A GLU 179.A N GLN 131.A OE1 no hydrogen 3.227 N/A MET 180.A N ALA 178.A O no hydrogen 2.882 N/A SER 181.A OG GLU 179.A OE2 no hydrogen 2.943 N/A ILE 183.A N MET 180.A O no hydrogen 2.987 N/A ARG 186.A N ILE 183.A O no hydrogen 3.253 N/A ARG 187.A NE PRO 168.A O no hydrogen 3.118 N/A ARG 187.A NH2 ASN 167.A O no hydrogen 3.050 N/A ARG 190.A N LEU 171.A O no hydrogen 2.961 N/A ARG 190.A NE TYR 236.A OH no hydrogen 3.437 N/A ARG 190.A NH1 LEU 189.A O no hydrogen 3.429 N/A ARG 192.A N TYR 173.A O no hydrogen 3.183 N/A ARG 192.A NE GLU 196.A OE1 no hydrogen 3.223 N/A ARG 192.A NH2 GLU 196.A OE1 no hydrogen 3.341 N/A ARG 192.A NH2 GLU 196.A OE2 no hydrogen 2.814 N/A PHE 197.A N LEU 194.A O no hydrogen 2.970 N/A GLU 198.A N TRP 195.A O no hydrogen 3.365 N/A ASP 200.A N GLU 198.A OE2 no hydrogen 3.423 N/A ALA 202.A N GLU 198.A O no hydrogen 3.151 N/A ARG 203.A N ILE 199.A O no hydrogen 3.283 N/A GLN 204.A N ASP 200.A O no hydrogen 3.416 N/A GLN 205.A N THR 201.A O no hydrogen 2.971 N/A LEU 206.A N ALA 202.A O no hydrogen 3.010 N/A ASN 207.A N ARG 203.A O no hydrogen 3.227 N/A LEU 208.A N GLN 204.A O no hydrogen 2.798 N/A GLN 209.A N GLN 205.A O no hydrogen 3.172 N/A GLN 209.A NE2 ILE 248.A O no hydrogen 3.518 N/A PHE 210.A N LEU 206.A O no hydrogen 3.041 N/A GLY 211.A N ASN 207.A O no hydrogen 2.649 N/A THR 212.A OG1 ASN 207.A OD1 no hydrogen 2.757 N/A THR 212.A OG1 ASP 214.A O no hydrogen 3.330 N/A ARG 213.A NH1 GLY 90.A O no hydrogen 3.482 N/A ARG 213.A NH2 GLN 88.A O no hydrogen 2.928 N/A ARG 213.A NH2 GLY 90.A O no hydrogen 3.455 N/A PHE 218.A N LEU 215.A O no hydrogen 3.207 N/A GLY 219.A N LEU 215.A O no hydrogen 3.130 N/A GLY 219.A N VAL 216.A O no hydrogen 3.224 N/A VAL 220.A N LEU 215.A O no hydrogen 3.464 N/A ALA 223.A N VAL 220.A O no hydrogen 2.912 N/A ARG 225.A N GLU 152.A OE2 no hydrogen 2.976 N/A ARG 225.A NE PHE 136.A O no hydrogen 3.372 N/A ARG 225.A NH2 PHE 136.A O no hydrogen 2.845 N/A CYS 228.A N PRO 224.A O no hydrogen 2.925 N/A CYS 228.A SG PRO 224.A O no hydrogen 2.919 N/A ALA 229.A N ARG 225.A O no hydrogen 3.202 N/A ALA 230.A N GLY 226.A O no hydrogen 2.788 N/A GLY 231.A N LEU 227.A O no hydrogen 2.827 N/A CYS 232.A N CYS 228.A O no hydrogen 3.284 N/A CYS 232.A SG GLU 196.A OE1 no hydrogen 3.276 N/A LEU 233.A N ALA 229.A O no hydrogen 2.891 N/A LEU 234.A N ALA 230.A O no hydrogen 2.790 N/A GLN 235.A N GLY 231.A O no hydrogen 2.978 N/A TYR 236.A N CYS 232.A O no hydrogen 2.803 N/A TYR 236.A OH GLU 170.A OE2 no hydrogen 3.284 N/A ALA 237.A N LEU 233.A O no hydrogen 2.702 N/A LYS 238.A N LEU 234.A O no hydrogen 3.147 N/A LYS 238.A NZ GLN 205.A OE1 no hydrogen 3.137 N/A LYS 238.A NZ GLN 235.A OE1 no hydrogen 3.385 N/A ASP 239.A N GLN 235.A O no hydrogen 3.097 N/A THR 240.A N TYR 236.A O no hydrogen 3.084 N/A THR 240.A OG1 TYR 236.A O no hydrogen 2.888 N/A THR 240.A OG1 ALA 237.A O no hydrogen 2.917 N/A THR 240.A OG1 GLN 241.A OE1 no hydrogen 2.649 N/A GLN 241.A N ALA 237.A O no hydrogen 2.984 N/A ARG 242.A N LYS 238.A O no hydrogen 2.623 N/A ILE 248.A N LEU 245.A O no hydrogen 3.307 N/A SER 250.A OG VAL 104.A O no hydrogen 3.496 N/A THR 252.A OG1 PHE 148.A O no hydrogen 2.726 N/A GLU 254.A N LEU 150.A O no hydrogen 3.059 N/A ARG 255.A NE GLU 152.A O no hydrogen 2.811 N/A GLN 257.A N GLN 257.A OE1 no hydrogen 3.147 N/A SER 259.A OG PRO 307.A O no hydrogen 3.068 N/A ILE 260.A N PRO 307.A O no hydrogen 2.924 N/A ILE 261.A N ASP 644.A O no hydrogen 2.800 N/A MET 262.A N ASN 78.A O no hydrogen 2.747 N/A THR 266.A OG1 ASP 263.A OD1 no hydrogen 2.895 N/A ARG 267.A N ASP 263.A O no hydrogen 3.294 N/A ARG 267.A NE MET 262.A O no hydrogen 2.769 N/A ARG 267.A NH1 HIS 305.A O no hydrogen 3.003 N/A ARG 267.A NH2 HIS 305.A O no hydrogen 3.175 N/A ARG 268.A NH1 ARG 267.A O no hydrogen 3.283 N/A ASN 269.A N ALA 265.A O no hydrogen 2.951 N/A LEU 270.A N THR 266.A O no hydrogen 2.895 N/A THR 273.A OG1 HIS 305.A NE2 no hydrogen 2.757 N/A GLY 278.A N ASN 275.A O no hydrogen 2.962 N/A GLY 278.A N ASN 275.A OD1 no hydrogen 2.702 N/A THR 283.A OG1 ALA 280.A O no hydrogen 2.780 N/A LEU 284.A N GLU 271.A O no hydrogen 3.109 N/A ALA 285.A N ILE 272.A O no hydrogen 2.990 N/A SER 286.A OG THR 283.A O no hydrogen 2.634 N/A VAL 287.A N LEU 284.A O no hydrogen 3.056 N/A LEU 288.A N LEU 284.A O no hydrogen 3.165 N/A CYS 290.A N ASN 550.A OD1 no hydrogen 3.402 N/A CYS 290.A SG VAL 287.A O no hydrogen 3.583 N/A THR 291.A OG1 ASP 289.A OD1 no hydrogen 2.841 N/A THR 291.A OG1 SER 297.A OG no hydrogen 3.094 N/A THR 293.A N ASP 546.A OD2 no hydrogen 3.063 N/A THR 293.A OG1 GLY 339.A O no hydrogen 2.799 N/A GLY 296.A N THR 293.A O no hydrogen 3.016 N/A SER 297.A N THR 293.A O no hydrogen 3.334 N/A SER 297.A OG ASP 289.A OD1 no hydrogen 3.559 N/A SER 297.A OG THR 291.A OG1 no hydrogen 3.094 N/A ARG 298.A NH1 GLU 342.A OE2 no hydrogen 3.054 N/A ARG 298.A NH2 PRO 294.A O no hydrogen 3.452 N/A LEU 300.A N GLY 296.A O no hydrogen 3.215 N/A LYS 301.A N SER 297.A O no hydrogen 3.396 N/A ARG 302.A N ARG 298.A O no hydrogen 2.877 N/A TRP 303.A N MET 299.A O no hydrogen 3.011 N/A LEU 304.A N LEU 300.A O no hydrogen 3.020 N/A MET 306.A N TRP 303.A O no hydrogen 3.134 N/A LEU 314.A N ASP 310.A O no hydrogen 3.512 N/A LEU 315.A N THR 311.A O no hydrogen 2.961 N/A ARG 317.A N VAL 313.A O no hydrogen 3.257 N/A ARG 317.A NH1 ILE 629.A O no hydrogen 3.218 N/A GLN 318.A N LEU 314.A O no hydrogen 2.844 N/A GLN 318.A NE2 PRO 563.A O no hydrogen 3.408 N/A GLN 319.A N LEU 315.A O no hydrogen 2.877 N/A THR 320.A N GLU 316.A O no hydrogen 3.077 N/A THR 320.A OG1 GLU 316.A O no hydrogen 2.912 N/A ILE 321.A N ARG 317.A O no hydrogen 2.754 N/A GLY 322.A N GLN 318.A O no hydrogen 3.132 N/A ALA 323.A N GLN 319.A O no hydrogen 2.861 N/A LEU 324.A N THR 320.A O no hydrogen 2.959 N/A THR 328.A OG1 GLN 325.A O no hydrogen 3.261 N/A LEU 331.A N PHE 327.A O no hydrogen 3.243 N/A GLN 332.A N THR 328.A O no hydrogen 3.043 N/A GLN 332.A NE2 GLU 553.A OE1 no hydrogen 2.682 N/A LEU 335.A N LEU 331.A O no hydrogen 3.054 N/A ARG 336.A N GLN 332.A O no hydrogen 3.386 N/A GLN 337.A NE2 PRO 333.A O no hydrogen 3.063 N/A VAL 338.A N LEU 335.A O no hydrogen 3.291 N/A GLY 339.A N ARG 336.A O no hydrogen 3.358 N/A ARG 343.A N ASP 340.A O no hydrogen 3.176 N/A ARG 343.A N ASP 340.A OD1 no hydrogen 3.279 N/A ILE 344.A N ASP 340.A O no hydrogen 3.179 N/A LEU 345.A N LEU 341.A O no hydrogen 3.076 N/A ALA 346.A N GLU 342.A O no hydrogen 3.138 N/A ARG 347.A N ARG 343.A O no hydrogen 3.122 N/A LEU 348.A N ILE 344.A O no hydrogen 2.939 N/A ALA 349.A N LEU 345.A O no hydrogen 2.784 N/A LEU 350.A N ALA 346.A O no hydrogen 3.196 N/A ARG 351.A N LEU 348.A O no hydrogen 2.972 N/A ARG 351.A NH2 GLU 522.A OE1 no hydrogen 3.472 N/A THR 352.A N ARG 347.A O no hydrogen 2.903 N/A THR 352.A OG1 LEU 350.A O no hydrogen 2.845 N/A ASP 357.A N ARG 354.A O no hydrogen 3.224 N/A ALA 359.A N PRO 355.A O no hydrogen 3.132 N/A ARG 360.A N ARG 356.A O no hydrogen 3.210 N/A ARG 360.A NH2 ASP 357.A OD1 no hydrogen 3.540 N/A MET 361.A N ASP 357.A O no hydrogen 3.074 N/A ARG 362.A N LEU 358.A O no hydrogen 3.011 N/A ARG 362.A NH1 ILE 404.A O no hydrogen 3.438 N/A ARG 362.A NH1 ILE 405.A O no hydrogen 3.012 N/A ARG 362.A NH2 ASP 406.A O no hydrogen 2.759 N/A HIS 363.A N ALA 359.A O no hydrogen 3.191 N/A ALA 364.A N ARG 360.A O no hydrogen 3.207 N/A PHE 365.A N MET 361.A O no hydrogen 3.201 N/A GLN 366.A N ARG 362.A O no hydrogen 3.016 N/A GLN 367.A N HIS 363.A O no hydrogen 3.248 N/A GLN 367.A N ALA 364.A O no hydrogen 2.838 N/A LEU 368.A N ALA 364.A O no hydrogen 2.667 N/A LEU 371.A N GLN 367.A O no hydrogen 3.308 N/A ARG 372.A N LEU 368.A O no hydrogen 3.074 N/A ARG 372.A NH1 ARG 387.A O no hydrogen 2.947 N/A ALA 373.A N PRO 369.A O no hydrogen 3.280 N/A GLN 374.A N GLU 370.A O no hydrogen 3.229 N/A GLN 374.A NE2 GLY 330.A O no hydrogen 3.176 N/A GLN 374.A NE2 GLU 370.A OE2 no hydrogen 3.071 N/A LEU 375.A N LEU 371.A O no hydrogen 3.175 N/A GLU 376.A N ARG 372.A O no hydrogen 2.965 N/A GLU 376.A N ALA 373.A O no hydrogen 3.243 N/A THR 377.A OG1 GLN 374.A O no hydrogen 2.532 N/A GLN 384.A N SER 380.A O no hydrogen 2.989 N/A GLN 384.A NE2 GLU 376.A O no hydrogen 3.235 N/A GLN 384.A NE2 VAL 378.A O no hydrogen 3.395 N/A LEU 386.A N PRO 382.A O no hydrogen 2.861 N/A ARG 387.A N VAL 383.A O no hydrogen 3.091 N/A ARG 387.A NE ARG 372.A O no hydrogen 3.050 N/A GLU 388.A N GLN 384.A O no hydrogen 2.986 N/A LYS 389.A N ALA 385.A O no hydrogen 2.665 N/A LYS 389.A NZ GLN 537.A O no hydrogen 3.021 N/A MET 390.A N LEU 386.A O no hydrogen 2.759 N/A LEU 396.A N PHE 393.A O no hydrogen 3.152 N/A ARG 397.A N PHE 393.A O no hydrogen 3.014 N/A ASP 398.A N ALA 394.A O no hydrogen 2.820 N/A LEU 399.A N GLU 395.A O no hydrogen 2.941 N/A LEU 400.A N LEU 396.A O no hydrogen 2.973 N/A GLU 401.A N ARG 397.A O no hydrogen 3.105 N/A ARG 402.A N ASP 398.A O no hydrogen 2.919 N/A ALA 403.A N LEU 399.A O no hydrogen 2.733 N/A ILE 405.A N VAL 417.A O no hydrogen 3.440 N/A LEU 411.A N ASP 414.A OD2 no hydrogen 3.044 N/A GLY 416.A N GLU 517.A OE2 no hydrogen 3.177 N/A ALA 419.A N ALA 403.A O no hydrogen 3.117 N/A GLU 428.A N GLU 424.A O no hydrogen 3.283 N/A TRP 429.A N GLU 425.A O no hydrogen 3.119 N/A ARG 430.A N LEU 426.A O no hydrogen 2.768 N/A ALA 431.A N ASP 427.A O no hydrogen 2.749 N/A LEU 432.A N GLU 428.A O no hydrogen 3.136 N/A ALA 433.A N TRP 429.A O no hydrogen 3.185 N/A ASP 434.A N ARG 430.A O no hydrogen 2.703 N/A GLY 435.A N ALA 431.A O no hydrogen 2.726 N/A ALA 436.A N ALA 433.A O no hydrogen 3.190 N/A THR 437.A N ASP 434.A O no hydrogen 3.308 N/A THR 437.A OG1 ASP 434.A O no hydrogen 2.674 N/A TYR 439.A N GLY 435.A O no hydrogen 3.250 N/A LEU 440.A N ALA 436.A O no hydrogen 2.604 N/A ARG 442.A N ASP 438.A O no hydrogen 2.816 N/A ARG 442.A NH2 ASP 438.A OD1 no hydrogen 3.044 N/A LEU 443.A N TYR 439.A O no hydrogen 2.976 N/A GLU 444.A N GLU 441.A O no hydrogen 3.164 N/A VAL 445.A N GLU 441.A O no hydrogen 2.859 N/A ARG 446.A N ARG 442.A O no hydrogen 3.261 N/A ARG 446.A NE GLU 447.A OE2 no hydrogen 3.218 N/A ARG 446.A NH2 GLU 447.A OE2 no hydrogen 3.098 N/A GLU 447.A N LEU 443.A O no hydrogen 3.191 N/A GLU 449.A N VAL 445.A O no hydrogen 2.991 N/A ARG 450.A N ARG 446.A O no hydrogen 2.908 N/A ARG 450.A NH2 GLU 447.A OE1 no hydrogen 3.356 N/A THR 451.A N GLU 447.A O no hydrogen 2.808 N/A THR 451.A OG1 GLU 447.A O no hydrogen 2.501 N/A THR 451.A OG1 ARG 448.A O no hydrogen 3.387 N/A GLY 452.A N ARG 448.A O no hydrogen 2.932 N/A LEU 453.A N THR 451.A OG1 no hydrogen 3.395 N/A THR 455.A N GLN 474.A OE1 no hydrogen 3.314 N/A THR 455.A OG1 SER 471.A OG no hydrogen 3.307 N/A THR 455.A OG1 GLN 474.A OE1 no hydrogen 2.536 N/A LEU 456.A N LEU 453.A O no hydrogen 3.300 N/A LYS 457.A N GLN 469.A O no hydrogen 2.922 N/A LYS 457.A NZ THR 455.A O no hydrogen 3.033 N/A GLY 459.A N TYR 467.A O no hydrogen 3.115 N/A ASN 461.A N GLY 465.A O no hydrogen 2.848 N/A ASN 461.A ND2 GLN 486.A OE1 no hydrogen 3.257 N/A VAL 463.A N ASN 461.A OD1 no hydrogen 3.249 N/A TYR 467.A N GLY 459.A O no hydrogen 2.724 N/A ILE 468.A N TYR 494.A O no hydrogen 3.192 N/A ILE 470.A N GLU 492.A O no hydrogen 2.960 N/A SER 471.A OG THR 455.A OG1 no hydrogen 3.307 N/A ARG 472.A N ASN 490.A O no hydrogen 3.195 N/A ARG 472.A NH1 LEU 488.A O no hydrogen 2.934 N/A GLN 474.A N SER 471.A O no hydrogen 3.103 N/A SER 475.A N ARG 472.A O no hydrogen 3.398 N/A SER 475.A OG SER 471.A O no hydrogen 2.542 N/A ALA 478.A N SER 475.A O no hydrogen 3.209 N/A TYR 482.A N PRO 479.A O no hydrogen 3.206 N/A TYR 482.A OH GLU 447.A OE1 no hydrogen 2.957 N/A MET 483.A N ILE 495.A O no hydrogen 3.226 N/A ARG 485.A N ARG 493.A O no hydrogen 3.095 N/A ARG 485.A NH1 HIS 464.A O no hydrogen 3.005 N/A THR 487.A OG1 GLU 492.A OE1 no hydrogen 3.168 N/A THR 487.A OG1 GLU 492.A OE2 no hydrogen 3.267 N/A LEU 488.A N ALA 491.A O no hydrogen 3.239 N/A GLU 492.A N ILE 470.A O no hydrogen 2.737 N/A ARG 493.A N GLN 486.A O no hydrogen 3.090 N/A ARG 493.A NH1 GLN 486.A OE1 no hydrogen 3.139 N/A TYR 494.A N ILE 468.A O no hydrogen 3.278 N/A LEU 499.A N ILE 496.A O no hydrogen 2.720 N/A LYS 500.A N ILE 496.A O no hydrogen 3.226 N/A LYS 500.A N PRO 497.A O no hydrogen 3.171 N/A GLU 501.A N PRO 497.A O no hydrogen 3.184 N/A TYR 502.A N GLU 498.A O no hydrogen 3.186 N/A TYR 502.A OH ALA 436.A O no hydrogen 2.560 N/A LYS 505.A N GLU 501.A O no hydrogen 3.253 N/A VAL 506.A N TYR 502.A O no hydrogen 2.813 N/A LEU 507.A N GLU 503.A O no hydrogen 2.783 N/A THR 508.A N ASP 504.A O no hydrogen 2.944 N/A SER 509.A N LYS 505.A O no hydrogen 2.911 N/A SER 509.A OG LYS 505.A O no hydrogen 2.846 N/A SER 509.A OG VAL 506.A O no hydrogen 3.086 N/A LYS 510.A N VAL 506.A O no hydrogen 3.201 N/A GLY 511.A N LEU 507.A O no hydrogen 3.407 N/A LYS 512.A N THR 508.A O no hydrogen 3.295 N/A ALA 513.A N SER 509.A O no hydrogen 2.952 N/A LEU 514.A N LYS 510.A O no hydrogen 3.232 N/A ALA 515.A N GLY 511.A O no hydrogen 2.893 N/A LEU 516.A N LYS 512.A O no hydrogen 2.955 N/A GLU 517.A N ALA 513.A O no hydrogen 3.164 N/A LYS 518.A N LEU 514.A O no hydrogen 3.307 N/A GLN 519.A N ALA 515.A O no hydrogen 3.057 N/A LEU 520.A N LEU 516.A O no hydrogen 2.889 N/A TYR 521.A N GLU 517.A O no hydrogen 2.697 N/A TYR 521.A OH ALA 353.A O no hydrogen 2.617 N/A GLU 522.A N LYS 518.A O no hydrogen 3.020 N/A GLU 522.A N GLN 519.A O no hydrogen 3.204 N/A GLU 523.A N GLN 519.A O no hydrogen 2.974 N/A LEU 524.A N LEU 520.A O no hydrogen 2.750 N/A ASP 526.A N GLU 522.A O no hydrogen 3.216 N/A LEU 527.A N GLU 523.A O no hydrogen 3.079 N/A LEU 528.A N LEU 524.A O no hydrogen 2.897 N/A LEU 532.A N LEU 529.A O no hydrogen 3.065 N/A LEU 535.A N HIS 531.A O no hydrogen 2.741 N/A GLN 536.A N LEU 532.A O no hydrogen 2.665 N/A GLN 537.A N GLU 533.A O no hydrogen 3.235 N/A SER 538.A N ALA 534.A O no hydrogen 2.832 N/A SER 538.A OG MET 390.A O no hydrogen 2.546 N/A ALA 539.A N LEU 535.A O no hydrogen 2.813 N/A SER 540.A N GLN 536.A O no hydrogen 2.979 N/A SER 540.A OG GLN 536.A O no hydrogen 3.497 N/A SER 540.A OG GLN 537.A O no hydrogen 2.481 N/A ALA 541.A N GLN 537.A O no hydrogen 3.022 N/A LEU 542.A N SER 538.A O no hydrogen 2.890 N/A ALA 543.A N ALA 539.A O no hydrogen 2.856 N/A GLU 544.A N SER 540.A O no hydrogen 3.022 N/A LEU 545.A N ALA 541.A O no hydrogen 2.864 N/A ASP 546.A N LEU 542.A O no hydrogen 3.115 N/A VAL 547.A N ALA 543.A O no hydrogen 3.151 N/A LEU 548.A N GLU 544.A O no hydrogen 3.064 N/A VAL 549.A N LEU 545.A O no hydrogen 2.925 N/A ASN 550.A N ASP 546.A O no hydrogen 2.964 N/A LEU 551.A N VAL 547.A O no hydrogen 2.787 N/A ALA 552.A N LEU 548.A O no hydrogen 2.754 N/A GLU 553.A N VAL 549.A O no hydrogen 2.611 N/A ARG 554.A N ASN 550.A O no hydrogen 2.759 N/A ARG 554.A NE VAL 287.A O no hydrogen 3.315 N/A ALA 555.A N LEU 551.A O no hydrogen 2.767 N/A TYR 556.A N ALA 552.A O no hydrogen 3.151 N/A THR 557.A N GLU 553.A O no hydrogen 2.709 N/A THR 557.A OG1 GLU 553.A O no hydrogen 2.667 N/A LEU 558.A N ARG 554.A O no hydrogen 2.854 N/A TYR 560.A N ALA 555.A O no hydrogen 2.647 N/A THR 561.A N VAL 633.A O no hydrogen 3.236 N/A THR 561.A OG1 ALA 635.A O no hydrogen 3.294 N/A THR 561.A OG1 GLN 636.A O no hydrogen 3.365 N/A THR 564.A N VAL 638.A O no hydrogen 2.738 N/A ILE 571.A N LEU 596.A O no hydrogen 3.250 N/A ARG 572.A NE GLU 639.A OE2 no hydrogen 3.053 N/A ARG 572.A NH1 ASN 595.A OD1 no hydrogen 2.856 N/A ILE 573.A N LEU 594.A O no hydrogen 2.895 N/A THR 574.A N LYS 637.A O no hydrogen 3.064 N/A GLY 576.A N ASN 592.A O no hydrogen 3.402 N/A ARG 577.A N PRO 634.A O no hydrogen 3.377 N/A ARG 577.A NE GLU 582.A OE1 no hydrogen 2.792 N/A ARG 577.A NH2 GLU 582.A OE2 no hydrogen 3.466 N/A GLU 582.A N HIS 578.A O no hydrogen 3.477 N/A VAL 584.A N VAL 580.A O no hydrogen 3.039 N/A GLU 587.A N ASN 586.A OD1 no hydrogen 2.724 N/A ASN 592.A N GLY 576.A O no hydrogen 3.093 N/A ASN 592.A ND2 HIS 753.A O no hydrogen 2.881 N/A LEU 594.A N ILE 573.A O no hydrogen 2.953 N/A SER 597.A N ARG 600.A O no hydrogen 2.875 N/A GLN 599.A N SER 597.A OG no hydrogen 3.230 N/A ARG 600.A N SER 597.A OG no hydrogen 3.338 N/A ARG 600.A NE ASN 595.A O no hydrogen 3.526 N/A ARG 601.A N GLY 734.A O no hydrogen 2.901 N/A ARG 601.A NE PRO 598.A O no hydrogen 3.458 N/A ARG 601.A NH2 PRO 598.A O no hydrogen 3.251 N/A ARG 601.A NH2 GLU 733.A OE1 no hydrogen 2.996 N/A MET 602.A N GLY 734.A O no hydrogen 3.164 N/A LEU 603.A N THR 716.A O no hydrogen 3.186 N/A ILE 604.A N ALA 736.A O no hydrogen 3.186 N/A THR 606.A N VAL 738.A O no hydrogen 3.232 N/A THR 606.A OG1 THR 720.A O no hydrogen 3.245 N/A LYS 613.A NZ PRO 608.A O no hydrogen 3.297 N/A LYS 613.A NZ HIS 721.A NE2 no hydrogen 3.424 N/A SER 614.A OG ASP 686.A OD2 no hydrogen 3.187 N/A THR 615.A OG1 GLY 612.A O no hydrogen 3.113 N/A TYR 616.A N GLY 612.A O no hydrogen 3.129 N/A TYR 616.A OH PRO 593.A O no hydrogen 3.412 N/A MET 617.A N LYS 613.A O no hydrogen 3.144 N/A ARG 618.A N SER 614.A O no hydrogen 3.026 N/A ARG 618.A NE ASN 269.A O no hydrogen 2.942 N/A ARG 618.A NH2 ASN 269.A O no hydrogen 3.492 N/A GLN 619.A N THR 615.A O no hydrogen 2.653 N/A GLN 619.A NE2 ASN 592.A OD1 no hydrogen 3.159 N/A THR 620.A OG1 TYR 616.A O no hydrogen 3.190 N/A LEU 622.A N ARG 618.A O no hydrogen 2.894 N/A ILE 623.A N GLN 619.A O no hydrogen 3.050 N/A ALA 624.A N THR 620.A O no hydrogen 3.083 N/A LEU 625.A N ALA 621.A O no hydrogen 2.629 N/A MET 626.A N LEU 622.A O no hydrogen 3.064 N/A ALA 627.A N ILE 623.A O no hydrogen 3.028 N/A TYR 628.A N ALA 624.A O no hydrogen 3.305 N/A TYR 628.A N LEU 625.A O no hydrogen 2.841 N/A TYR 628.A OH GLY 641.A O no hydrogen 2.704 N/A ILE 629.A N MET 626.A O no hydrogen 3.388 N/A GLY 630.A N ALA 627.A O no hydrogen 3.415 N/A SER 631.A N MET 626.A O no hydrogen 3.136 N/A SER 631.A OG TYR 632.A O no hydrogen 3.289 N/A TYR 632.A OH GLN 318.A O no hydrogen 3.082 N/A VAL 633.A N THR 561.A O no hydrogen 3.240 N/A GLN 636.A N THR 574.A O no hydrogen 3.142 N/A LYS 637.A N THR 574.A O no hydrogen 3.480 N/A LYS 637.A NZ GLU 639.A OE2 no hydrogen 3.266 N/A GLU 639.A N ARG 572.A O no hydrogen 3.235 N/A ILE 640.A N THR 564.A O no hydrogen 2.912 N/A GLY 641.A N GLY 570.A O no hydrogen 2.716 N/A ILE 646.A N ILE 261.A O no hydrogen 3.127 N/A PHE 647.A N LEU 682.A O no hydrogen 3.058 N/A THR 648.A OG1 THR 266.A OG1 no hydrogen 3.307 N/A ARG 649.A N LEU 684.A O no hydrogen 3.099 N/A VAL 665.A N SER 661.A O no hydrogen 3.289 N/A MET 667.A N PHE 663.A O no hydrogen 2.991 N/A THR 668.A N MET 664.A O no hydrogen 2.948 N/A THR 668.A OG1 MET 664.A O no hydrogen 2.762 N/A GLU 669.A N VAL 665.A O no hydrogen 2.963 N/A THR 670.A N GLU 666.A O no hydrogen 2.878 N/A THR 670.A OG1 GLU 666.A O no hydrogen 3.430 N/A THR 670.A OG1 MET 667.A O no hydrogen 2.791 N/A ALA 671.A N MET 667.A O no hydrogen 2.795 N/A ASN 672.A N THR 668.A O no hydrogen 3.037 N/A ILE 673.A N GLU 669.A O no hydrogen 3.291 N/A LEU 674.A N THR 670.A O no hydrogen 2.789 N/A HIS 675.A N ALA 671.A O no hydrogen 3.009 N/A HIS 675.A ND1 ALA 671.A O no hydrogen 2.615 N/A ASN 676.A N ASN 672.A O no hydrogen 2.955 N/A ALA 677.A N ILE 673.A O no hydrogen 2.914 N/A THR 678.A N SER 681.A OG no hydrogen 3.032 N/A THR 678.A OG1 ASP 644.A OD1 no hydrogen 3.350 N/A THR 678.A OG1 ASP 644.A OD2 no hydrogen 3.120 N/A GLU 679.A N GLU 679.A OE1 no hydrogen 2.708 N/A TYR 680.A N THR 678.A OG1 no hydrogen 3.244 N/A SER 681.A N THR 678.A O no hydrogen 3.314 N/A SER 681.A N THR 678.A OG1 no hydrogen 3.275 N/A SER 681.A OG THR 678.A O no hydrogen 2.602 N/A LEU 682.A N ARG 645.A O no hydrogen 3.034 N/A VAL 683.A N LEU 715.A O no hydrogen 3.105 N/A LEU 684.A N PHE 647.A O no hydrogen 3.213 N/A MET 685.A N LEU 717.A O no hydrogen 3.343 N/A GLU 687.A N ALA 719.A O no hydrogen 2.693 N/A GLY 697.A N SER 693.A O no hydrogen 3.035 N/A LEU 698.A N THR 694.A O no hydrogen 3.190 N/A SER 699.A N TYR 695.A O no hydrogen 3.210 N/A SER 699.A OG TYR 695.A O no hydrogen 2.864 N/A LEU 700.A N ASP 696.A O no hydrogen 3.263 N/A ALA 701.A N GLY 697.A O no hydrogen 3.044 N/A TRP 702.A N LEU 698.A O no hydrogen 2.940 N/A ALA 703.A N SER 699.A O no hydrogen 3.199 N/A CYS 704.A N LEU 700.A O no hydrogen 2.921 N/A CYS 704.A SG LEU 700.A O no hydrogen 2.957 N/A ALA 705.A N ALA 701.A O no hydrogen 3.041 N/A GLU 706.A N TRP 702.A O no hydrogen 3.217 N/A ASN 707.A N ALA 703.A O no hydrogen 3.039 N/A LEU 708.A N CYS 704.A O no hydrogen 3.053 N/A ALA 709.A N GLU 706.A O no hydrogen 3.212 N/A ASN 710.A N GLU 706.A O no hydrogen 2.631 N/A LYS 711.A N ASN 707.A O no hydrogen 3.373 N/A ILE 712.A N ASN 707.A O no hydrogen 2.853 N/A LYS 713.A NZ ASN 710.A O no hydrogen 3.457 N/A ALA 714.A N LEU 708.A O no hydrogen 3.217 N/A THR 716.A N ARG 601.A O no hydrogen 2.748 N/A THR 716.A OG1 ALA 714.A O no hydrogen 2.832 N/A LEU 717.A N VAL 683.A O no hydrogen 3.272 N/A PHE 718.A N LEU 603.A O no hydrogen 2.963 N/A ALA 719.A N MET 685.A O no hydrogen 3.027 N/A THR 720.A OG1 TYR 722.A O no hydrogen 3.002 N/A TYR 722.A OH GLY 689.A O no hydrogen 2.758 N/A THR 726.A OG1 PHE 723.A O no hydrogen 2.520 N/A GLN 727.A N GLU 724.A O no hydrogen 3.420 N/A LEU 728.A N LEU 725.A O no hydrogen 3.226 N/A GLU 730.A N GLN 727.A O no hydrogen 3.272 N/A MET 732.A N LEU 728.A O no hydrogen 3.094 N/A ALA 736.A N MET 602.A O no hydrogen 2.999 N/A ASN 737.A ND2 THR 726.A O no hydrogen 3.106 N/A VAL 738.A N ILE 604.A O no hydrogen 3.401 N/A HIS 739.A N GLN 756.A O no hydrogen 2.765 N/A ALA 742.A N ASP 741.A OD1 no hydrogen 2.959 N/A LEU 743.A N ALA 750.A O no hydrogen 2.783 N/A THR 748.A OG1 HIS 745.A O no hydrogen 3.508 N/A ALA 750.A N LEU 743.A O no hydrogen 2.863 N/A MET 752.A N ASP 741.A O no hydrogen 3.102 N/A VAL 768.A N TYR 764.A O no hydrogen 3.254 N/A ALA 769.A N GLY 765.A O no hydrogen 2.852 N/A LEU 771.A N ALA 767.A O no hydrogen 3.422 N/A GLY 773.A N ALA 769.A O no hydrogen 2.999 N/A VAL 774.A N ALA 769.A O no hydrogen 3.189 N/A VAL 778.A N PRO 775.A O no hydrogen 3.125 N/A ILE 779.A N PRO 775.A O no hydrogen 3.143 N/A LYS 780.A N LYS 776.A O no hydrogen 2.772 N/A ARG 781.A N GLU 777.A O no hydrogen 3.323 N/A ARG 781.A NH1 ARG 781.A O no hydrogen 3.413 N/A ALA 782.A N VAL 778.A O no hydrogen 3.058 N/A ARG 783.A N ILE 779.A O no hydrogen 2.894 N/A GLN 784.A N LYS 780.A O no hydrogen 2.988 N/A LYS 785.A N ARG 781.A O no hydrogen 2.794 N/A LEU 786.A N ALA 782.A O no hydrogen 2.819 N/A ARG 787.A N ARG 783.A O no hydrogen 2.975 N/A GLU 788.A N GLN 784.A O no hydrogen 3.398 N/A LEU 789.A N LYS 785.A O no hydrogen 2.758 N/A GLU 790.A N LEU 786.A O no hydrogen 2.846 N/A SER 791.A N ARG 787.A O no hydrogen 3.122 N/A SER 791.A OG ARG 787.A O no hydrogen 3.024 N/A SER 791.A OG GLU 788.A O no hydrogen 2.695 N/A