Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ozv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N PHE 18.A O no hydrogen 2.915 N/A ALA 4.A N ASP 29.A OD1 no hydrogen 3.054 N/A PHE 5.A N ALA 16.A O no hydrogen 2.880 N/A ASP 6.A N ASP 111.A OD2 no hydrogen 3.161 N/A ILE 7.A N GLY 14.A O no hydrogen 2.914 N/A TYR 8.A OH GLU 627.A OE1 no hydrogen 2.325 N/A ASN 9.A N VAL 12.A O no hydrogen 2.921 N/A GLY 14.A N ILE 7.A O no hydrogen 2.879 N/A PHE 15.A N LEU 606.A O no hydrogen 3.082 N/A ALA 16.A N PHE 5.A O no hydrogen 2.943 N/A PHE 18.A N ARG 3.A O no hydrogen 2.876 N/A LYS 20.A N VAL 1.A O no hydrogen 3.191 N/A THR 23.A OG1 TYR 25.A O no hydrogen 2.343 N/A LYS 24.A NZ TYR 25.A OH no hydrogen 2.730 N/A LYS 24.A NZ GLU 47.A OE1 no hydrogen 3.403 N/A TYR 25.A OH GLU 47.A OE1 no hydrogen 2.315 N/A THR 26.A N ASP 29.A OD2 no hydrogen 3.381 N/A MET 27.A N GLN 113.A O no hydrogen 2.605 N/A ASP 29.A N THR 26.A O no hydrogen 3.016 N/A LEU 30.A N THR 26.A O no hydrogen 3.461 N/A VAL 31.A N MET 27.A O no hydrogen 2.969 N/A TYR 32.A N ALA 28.A O no hydrogen 2.823 N/A ALA 33.A N ASP 29.A O no hydrogen 2.895 N/A LEU 34.A N LEU 30.A O no hydrogen 2.957 N/A ARG 35.A N VAL 31.A O no hydrogen 2.891 N/A ARG 35.A NH1 LEU 143.A O no hydrogen 3.283 N/A ARG 35.A NH1 ASP 363.A OD2 no hydrogen 2.475 N/A ARG 35.A NH2 TYR 686.A OH no hydrogen 2.910 N/A HIS 36.A N TYR 32.A O no hydrogen 2.757 N/A GLU 39.A N GLU 39.A OE1 no hydrogen 2.794 N/A GLY 40.A N ASP 38.A OD1 no hydrogen 3.196 N/A CYS 42.A SG ASP 38.A O no hydrogen 3.078 N/A LYS 46.A N CYS 42.A O no hydrogen 2.761 N/A GLU 47.A N ASP 43.A O no hydrogen 2.916 N/A ILE 48.A N THR 44.A O no hydrogen 2.911 N/A LEU 49.A N LEU 45.A O no hydrogen 2.901 N/A VAL 50.A N LYS 46.A O no hydrogen 2.926 N/A THR 51.A N GLU 47.A O no hydrogen 2.895 N/A THR 51.A OG1 GLU 47.A O no hydrogen 2.397 N/A ASN 53.A N VAL 50.A O no hydrogen 3.263 N/A CYS 54.A N LEU 49.A O no hydrogen 3.101 N/A CYS 54.A SG TYR 52.A O no hydrogen 3.578 N/A CYS 55.A SG ASP 56.A O no hydrogen 3.825 N/A TYR 59.A N ASP 56.A O no hydrogen 2.771 N/A TYR 59.A OH ASP 73.A OD2 no hydrogen 3.266 N/A PHE 60.A N ASP 57.A O no hydrogen 2.913 N/A LYS 62.A NZ ASN 71.A OD1 no hydrogen 3.512 N/A VAL 69.A N ASP 67.A OD1 no hydrogen 3.054 N/A ASN 71.A N ASP 67.A O no hydrogen 3.293 N/A ASN 71.A ND2 TYR 59.A OH no hydrogen 2.568 N/A ASN 71.A ND2 TRP 65.A O no hydrogen 3.486 N/A ILE 74.A N ASN 71.A O no hydrogen 3.146 N/A LEU 75.A N PRO 72.A O no hydrogen 2.912 N/A ARG 76.A N ASP 73.A O no hydrogen 2.912 N/A ARG 76.A NE ASP 73.A OD1 no hydrogen 2.792 N/A ARG 76.A NH2 ASP 73.A OD1 no hydrogen 3.286 N/A ARG 76.A NH2 ASP 73.A OD2 no hydrogen 2.486 N/A VAL 77.A N ASP 73.A O no hydrogen 3.255 N/A TYR 78.A N ILE 74.A O no hydrogen 2.882 N/A TYR 78.A OH TYR 685.A OH no hydrogen 2.318 N/A ALA 79.A N LEU 75.A O no hydrogen 3.159 N/A ASN 80.A N ARG 76.A O no hydrogen 2.727 N/A ASN 80.A N VAL 77.A O no hydrogen 2.945 N/A LEU 81.A N TYR 78.A O no hydrogen 2.910 N/A GLY 82.A N ALA 79.A O no hydrogen 2.929 N/A VAL 85.A N LEU 81.A O no hydrogen 3.214 N/A ARG 86.A N GLY 82.A O no hydrogen 2.866 N/A ARG 86.A NE GLU 83.A OE1 no hydrogen 3.394 N/A ARG 86.A NH1 TYR 189.A OH no hydrogen 2.862 N/A ARG 86.A NH2 GLU 83.A OE2 no hydrogen 3.463 N/A GLN 87.A N GLU 83.A O no hydrogen 2.921 N/A ALA 88.A N ARG 84.A O no hydrogen 3.055 N/A LEU 89.A N VAL 85.A O no hydrogen 3.014 N/A LEU 90.A N ARG 86.A O no hydrogen 3.038 N/A LYS 91.A N GLN 87.A O no hydrogen 2.863 N/A LYS 91.A NZ ASN 118.A OD1 no hydrogen 3.251 N/A THR 92.A N ALA 88.A O no hydrogen 2.709 N/A THR 92.A OG1 ALA 88.A O no hydrogen 3.153 N/A THR 92.A OG1 TYR 140.A OH no hydrogen 2.750 N/A VAL 93.A N LEU 89.A O no hydrogen 3.103 N/A GLN 94.A N LEU 90.A O no hydrogen 3.114 N/A PHE 95.A N LYS 91.A O no hydrogen 2.815 N/A CYS 96.A N THR 92.A O no hydrogen 2.860 N/A CYS 96.A SG THR 92.A O no hydrogen 3.663 N/A ASP 97.A N VAL 93.A O no hydrogen 2.780 N/A ALA 98.A N GLN 94.A O no hydrogen 2.871 N/A MET 99.A N PHE 95.A O no hydrogen 2.945 N/A ARG 100.A N CYS 96.A O no hydrogen 2.788 N/A ASN 101.A N ASP 97.A O no hydrogen 2.695 N/A ALA 102.A N MET 99.A O no hydrogen 2.940 N/A ILE 104.A N MET 99.A O no hydrogen 3.133 N/A VAL 105.A N ILE 126.A O no hydrogen 3.192 N/A LEU 108.A N VAL 136.A O no hydrogen 2.947 N/A THR 109.A OG1 ASP 111.A OD1 no hydrogen 2.540 N/A ASN 112.A N THR 109.A O no hydrogen 3.451 N/A GLN 113.A N LEU 110.A O no hydrogen 3.073 N/A GLN 113.A NE2 ALA 88.A O no hydrogen 3.391 N/A GLN 113.A NE2 GLY 117.A O no hydrogen 2.869 N/A ASP 114.A N ASN 118.A O no hydrogen 3.114 N/A GLY 117.A N ASP 114.A O no hydrogen 2.815 N/A TYR 120.A N ASN 112.A O no hydrogen 3.268 N/A TYR 120.A OH ASP 111.A O no hydrogen 2.770 N/A GLY 123.A N ASP 121.A OD1 no hydrogen 2.847 N/A ILE 126.A N VAL 105.A O no hydrogen 3.090 N/A GLN 127.A NE2 ALA 102.A O no hydrogen 2.782 N/A GLN 127.A NE2 THR 128.A O no hydrogen 2.755 N/A THR 128.A N GLY 103.A O no hydrogen 2.559 N/A THR 128.A OG1 ILE 126.A O no hydrogen 3.389 N/A SER 132.A N THR 129.A O no hydrogen 3.270 N/A SER 132.A OG THR 129.A O no hydrogen 2.754 N/A VAL 136.A N GLY 106.A O no hydrogen 2.879 N/A SER 139.A OG LEU 108.A O no hydrogen 3.242 N/A TYR 140.A OH GLN 113.A OE1 no hydrogen 2.278 N/A TYR 141.A N VAL 137.A O no hydrogen 3.272 N/A SER 142.A N ASP 138.A O no hydrogen 2.937 N/A SER 142.A OG ASP 363.A OD1 no hydrogen 2.670 N/A LEU 143.A N SER 139.A O no hydrogen 2.904 N/A LEU 144.A N TYR 140.A O no hydrogen 2.960 N/A ILE 147.A N LEU 144.A O no hydrogen 3.072 N/A LEU 148.A N MET 145.A O no hydrogen 3.007 N/A THR 149.A OG1 PRO 359.A O no hydrogen 3.217 N/A LEU 150.A N PRO 146.A O no hydrogen 3.453 N/A THR 151.A N ILE 147.A O no hydrogen 3.244 N/A THR 151.A OG1 ILE 147.A O no hydrogen 2.613 N/A ALA 153.A N LEU 148.A O no hydrogen 3.048 N/A THR 155.A OG1 ARG 152.A O no hydrogen 3.436 N/A SER 158.A N THR 155.A O no hydrogen 2.920 N/A SER 158.A OG THR 155.A O no hydrogen 3.503 N/A SER 158.A OG VAL 223.A O no hydrogen 3.219 N/A HIS 159.A ND1 ASP 163.A O no hydrogen 3.067 N/A VAL 160.A N PRO 167.A O no hydrogen 3.129 N/A THR 162.A N HIS 159.A O no hydrogen 3.245 N/A LYS 166.A N ASP 163.A O no hydrogen 3.159 N/A LYS 166.A NZ ASP 161.A OD2 no hydrogen 3.568 N/A LYS 166.A NZ ASP 163.A OD2 no hydrogen 3.425 N/A ILE 169.A N SER 158.A O no hydrogen 2.954 N/A TRP 171.A N ILE 169.A O no hydrogen 3.058 N/A LYS 175.A N ASP 172.A O no hydrogen 3.181 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.922 N/A ARG 182.A N PHE 178.A O no hydrogen 2.926 N/A ARG 182.A NH1 SER 221.A OG no hydrogen 3.024 N/A ARG 182.A NH2 SER 221.A OG no hydrogen 3.363 N/A ARG 182.A NH2 HIS 250.A NE2 no hydrogen 3.378 N/A LEU 183.A N THR 179.A O no hydrogen 2.916 N/A LYS 184.A N GLU 180.A O no hydrogen 2.945 N/A LEU 185.A N GLU 181.A O no hydrogen 2.882 N/A PHE 186.A N ARG 182.A O no hydrogen 2.906 N/A ASP 187.A N LEU 183.A O no hydrogen 2.893 N/A ARG 188.A N LEU 185.A O no hydrogen 3.301 N/A TYR 189.A N LEU 185.A O no hydrogen 3.223 N/A TYR 189.A OH GLU 157.A OE2 no hydrogen 2.215 N/A LYS 191.A NZ ASP 97.A OD1 no hydrogen 3.052 N/A LYS 191.A NZ ASP 97.A OD2 no hydrogen 3.433 N/A TYR 192.A OH ASP 97.A OD1 no hydrogen 2.287 N/A TRP 193.A NE1 HIS 212.A NE2 no hydrogen 2.820 N/A TYR 197.A OH ASN 217.A OD1 no hydrogen 2.751 N/A ASN 200.A ND2 THR 179.A OG1 no hydrogen 3.161 N/A CYS 201.A N LEU 254.A O no hydrogen 3.136 N/A CYS 201.A SG GLU 253.A O no hydrogen 3.950 N/A ASN 203.A N ASN 200.A O no hydrogen 3.075 N/A CYS 204.A N CYS 201.A O no hydrogen 3.427 N/A CYS 204.A SG HIS 198.A ND1 no hydrogen 3.755 N/A CYS 204.A SG CYS 209.A O no hydrogen 3.445 N/A ARG 208.A NH1 GLU 372.A OE2 no hydrogen 2.670 N/A ARG 208.A NH2 ARG 633.A O no hydrogen 3.520 N/A CYS 209.A SG HIS 198.A ND1 no hydrogen 3.601 N/A ILE 210.A N ASP 206.A O no hydrogen 2.875 N/A LEU 211.A N ASP 207.A O no hydrogen 2.914 N/A HIS 212.A N ARG 208.A O no hydrogen 2.950 N/A CYS 213.A N CYS 209.A O no hydrogen 2.908 N/A CYS 213.A SG HIS 198.A ND1 no hydrogen 3.819 N/A CYS 213.A SG CYS 209.A O no hydrogen 3.117 N/A CYS 213.A SG HIS 212.A ND1 no hydrogen 3.705 N/A ALA 214.A N ILE 210.A O no hydrogen 2.861 N/A ASN 215.A N LEU 211.A O no hydrogen 2.886 N/A ASN 215.A ND2 CYS 362.A O no hydrogen 3.066 N/A PHE 216.A N HIS 212.A O no hydrogen 3.077 N/A ASN 217.A N CYS 213.A O no hydrogen 2.889 N/A ASN 217.A ND2 PRO 199.A O no hydrogen 3.168 N/A ASN 217.A ND2 GLU 253.A O no hydrogen 3.168 N/A VAL 218.A N ALA 214.A O no hydrogen 2.904 N/A PHE 220.A N PHE 216.A O no hydrogen 2.990 N/A SER 221.A N ASN 217.A O no hydrogen 2.802 N/A SER 221.A OG ASN 217.A O no hydrogen 2.868 N/A SER 221.A OG ARG 252.A O no hydrogen 2.236 N/A THR 222.A N LEU 219.A O no hydrogen 3.488 N/A THR 222.A OG1 LEU 219.A O no hydrogen 3.012 N/A SER 228.A N PRO 225.A O no hydrogen 3.351 N/A SER 228.A OG PRO 225.A O no hydrogen 2.932 N/A GLY 230.A N HIS 250.A O no hydrogen 3.137 N/A ARG 234.A N VAL 245.A O no hydrogen 2.872 N/A ILE 236.A N PHE 243.A O no hydrogen 2.874 N/A VAL 238.A N VAL 241.A O no hydrogen 2.932 N/A VAL 241.A N VAL 238.A O no hydrogen 2.908 N/A PHE 243.A N ILE 236.A O no hydrogen 2.878 N/A VAL 245.A N ARG 234.A O no hydrogen 2.939 N/A SER 246.A N ASP 275.A OD2 no hydrogen 3.237 N/A SER 246.A OG ASP 275.A OD1 no hydrogen 2.905 N/A SER 246.A OG ASP 275.A OD2 no hydrogen 2.378 N/A THR 247.A N LEU 232.A O no hydrogen 2.972 N/A TYR 249.A N VAL 257.A O no hydrogen 2.864 N/A HIS 250.A N GLY 230.A O no hydrogen 3.081 N/A PHE 251.A N GLY 255.A O no hydrogen 2.863 N/A GLY 255.A N PHE 251.A O no hydrogen 2.960 N/A VAL 256.A N ASN 200.A OD1 no hydrogen 3.047 N/A VAL 257.A N TYR 249.A O no hydrogen 2.936 N/A ASN 259.A ND2 VAL 433.A O no hydrogen 3.374 N/A GLN 260.A N ASN 432.A OD1 no hydrogen 2.650 N/A ASP 261.A N ASN 432.A OD1 no hydrogen 2.934 N/A GLU 268.A N SER 265.A OG no hydrogen 3.382 N/A LEU 269.A N SER 265.A O no hydrogen 2.836 N/A LEU 270.A N PHE 266.A O no hydrogen 2.915 N/A VAL 271.A N LYS 267.A O no hydrogen 2.934 N/A TYR 272.A N GLU 268.A O no hydrogen 2.929 N/A ALA 273.A N LEU 269.A O no hydrogen 2.861 N/A ALA 274.A N LEU 270.A O no hydrogen 2.898 N/A ASP 275.A N VAL 271.A O no hydrogen 3.356 N/A HIS 279.A NE2 ALA 273.A O no hydrogen 3.120 N/A ALA 280.A N PRO 276.A O no hydrogen 2.891 N/A ALA 281.A N MET 278.A O no hydrogen 3.261 N/A SER 282.A N MET 278.A O no hydrogen 2.935 N/A SER 282.A OG MET 278.A O no hydrogen 3.181 N/A GLY 283.A N HIS 279.A O no hydrogen 3.038 N/A ASN 284.A N ALA 298.A O no hydrogen 3.036 N/A ARG 290.A N ASP 288.A OD1 no hydrogen 3.255 N/A ARG 290.A NE ASP 288.A OD1 no hydrogen 3.056 N/A ARG 290.A NH2 ASP 288.A OD2 no hydrogen 3.336 N/A VAL 296.A N LEU 571.A O no hydrogen 2.733 N/A ALA 298.A N ASN 284.A O no hydrogen 2.659 N/A LEU 299.A N GLY 569.A O no hydrogen 3.140 N/A THR 300.A OG1 ASN 302.A O no hydrogen 2.598 N/A ALA 304.A N GLY 568.A O no hydrogen 3.148 N/A VAL 308.A N GLN 342.A O no hydrogen 3.283 N/A ASN 312.A N VAL 742.A O no hydrogen 2.991 N/A ASN 312.A ND2 VAL 742.A O no hydrogen 3.626 N/A ASN 312.A ND2 ASP 743.A O no hydrogen 3.148 N/A ASN 314.A N CYS 740.A O no hydrogen 2.569 N/A ASN 314.A ND2 GLY 739.A O no hydrogen 3.463 N/A TYR 318.A N ASN 314.A O no hydrogen 3.240 N/A ASP 319.A N LYS 315.A O no hydrogen 2.883 N/A PHE 320.A N ASP 316.A O no hydrogen 2.936 N/A ALA 321.A N PHE 317.A O no hydrogen 2.861 N/A VAL 322.A N TYR 318.A O no hydrogen 2.937 N/A SER 323.A N ASP 319.A O no hydrogen 2.919 N/A SER 323.A OG ASP 319.A O no hydrogen 3.441 N/A SER 323.A OG PHE 320.A O no hydrogen 2.632 N/A LYS 324.A N ALA 321.A O no hydrogen 3.162 N/A PHE 326.A N ALA 321.A O no hydrogen 3.113 N/A GLU 329.A N GLU 329.A OE1 no hydrogen 2.747 N/A SER 331.A N LYS 328.A O no hydrogen 3.404 N/A SER 331.A OG LYS 328.A O no hydrogen 3.335 N/A SER 331.A OG VAL 333.A O no hydrogen 2.900 N/A LYS 336.A NZ GLU 334.A OE1 no hydrogen 2.980 N/A PHE 338.A N SER 447.A O no hydrogen 3.122 N/A GLN 342.A N VAL 308.A O no hydrogen 3.131 N/A GLN 342.A NE2 ASN 450.A O no hydrogen 2.434 N/A ALA 346.A N ASP 343.A O no hydrogen 3.367 N/A SER 349.A N ASN 345.A O no hydrogen 3.139 N/A ASP 350.A N ALA 346.A O no hydrogen 2.898 N/A TYR 351.A N ALA 347.A O no hydrogen 2.917 N/A ASP 352.A N ILE 348.A O no hydrogen 2.908 N/A TYR 353.A N ASP 350.A O no hydrogen 3.143 N/A TYR 354.A N TYR 351.A O no hydrogen 3.286 N/A ARG 355.A N ASP 352.A O no hydrogen 3.108 N/A ARG 355.A NH1 ASP 352.A O no hydrogen 2.847 N/A TYR 356.A N TYR 353.A O no hydrogen 3.097 N/A ASN 357.A N TYR 354.A O no hydrogen 3.052 N/A ASN 357.A ND2 ARG 522.A O no hydrogen 2.652 N/A ASN 357.A ND2 MET 524.A O no hydrogen 2.750 N/A THR 360.A OG1 LEU 358.A O no hydrogen 3.221 N/A MET 361.A N THR 149.A OG1 no hydrogen 3.019 N/A CYS 362.A N ASN 215.A OD1 no hydrogen 2.966 N/A ARG 365.A N SER 142.A OG no hydrogen 3.402 N/A ARG 365.A NE ASP 138.A OD1 no hydrogen 2.497 N/A ARG 365.A NE ASP 138.A OD2 no hydrogen 3.091 N/A ARG 365.A NH1 GLN 195.A OE1 no hydrogen 3.347 N/A ARG 365.A NH2 GLN 195.A OE1 no hydrogen 3.482 N/A GLN 366.A N ASP 363.A OD1 no hydrogen 3.213 N/A GLN 366.A NE2 TYR 686.A OH no hydrogen 2.718 N/A LEU 367.A N ASP 363.A O no hydrogen 2.670 N/A LEU 368.A N ILE 364.A O no hydrogen 2.875 N/A PHE 369.A N ARG 365.A O no hydrogen 3.009 N/A VAL 370.A N GLN 366.A O no hydrogen 2.859 N/A VAL 371.A N LEU 367.A O no hydrogen 2.863 N/A GLU 372.A N LEU 368.A O no hydrogen 2.999 N/A VAL 373.A N PHE 369.A O no hydrogen 2.949 N/A VAL 374.A N VAL 370.A O no hydrogen 2.824 N/A ASP 375.A N VAL 371.A O no hydrogen 2.926 N/A LYS 376.A N VAL 373.A O no hydrogen 3.037 N/A LYS 376.A NZ ASN 641.A OD1 no hydrogen 2.572 N/A TYR 377.A N VAL 374.A O no hydrogen 2.921 N/A PHE 378.A N ASP 375.A O no hydrogen 3.113 N/A ASP 382.A N SER 476.A OG no hydrogen 3.220 N/A CYS 385.A SG HIS 540.A ND1 no hydrogen 3.613 N/A ILE 386.A N GLN 468.A O no hydrogen 3.407 N/A ASN 387.A N GLN 390.A OE1 no hydrogen 3.406 N/A ALA 388.A N ASP 423.A OD1 no hydrogen 2.994 N/A GLN 390.A N ASN 387.A O no hydrogen 3.400 N/A VAL 391.A N ALA 388.A O no hydrogen 3.436 N/A ILE 392.A N GLN 471.A OE1 no hydrogen 2.852 N/A ASN 405.A ND2 GLN 439.A OE1 no hydrogen 2.772 N/A LYS 406.A N PRO 403.A O no hydrogen 3.202 N/A ALA 410.A N LYS 398.A O no hydrogen 3.200 N/A ARG 411.A NE ASP 397.A OD1 no hydrogen 3.378 N/A ARG 411.A NH2 ASP 397.A OD1 no hydrogen 3.492 N/A ARG 411.A NH2 ASP 397.A OD2 no hydrogen 3.454 N/A TYR 413.A OH PHE 404.A O no hydrogen 3.278 N/A TYR 414.A N ALA 410.A O no hydrogen 2.948 N/A ASP 415.A N ARG 411.A O no hydrogen 2.891 N/A SER 416.A N LEU 412.A O no hydrogen 2.905 N/A SER 416.A OG LEU 412.A O no hydrogen 3.247 N/A SER 416.A OG TYR 413.A O no hydrogen 2.876 N/A MET 417.A N TYR 413.A O no hydrogen 3.308 N/A GLN 422.A N SER 418.A O no hydrogen 3.057 N/A GLN 422.A NE2 MET 417.A O no hydrogen 3.581 N/A ASP 423.A N TYR 419.A O no hydrogen 2.934 N/A ALA 424.A N GLU 420.A O no hydrogen 2.882 N/A LEU 425.A N ASP 421.A O no hydrogen 2.909 N/A PHE 426.A N GLN 422.A O no hydrogen 2.911 N/A ALA 427.A N ASP 423.A O no hydrogen 2.906 N/A TYR 428.A N ALA 424.A O no hydrogen 2.883 N/A THR 429.A N LEU 425.A O no hydrogen 2.943 N/A THR 429.A OG1 PHE 426.A O no hydrogen 2.574 N/A LYS 430.A N PHE 426.A O no hydrogen 3.254 N/A LYS 430.A N ALA 427.A O no hydrogen 3.214 N/A ARG 431.A N TYR 428.A O no hydrogen 3.000 N/A ASN 432.A N TYR 428.A O no hydrogen 3.039 N/A ASN 432.A ND2 ASP 261.A OD2 no hydrogen 2.722 N/A VAL 433.A N ASN 259.A OD1 no hydrogen 2.607 N/A ILE 434.A N ASN 555.A OD1 no hydrogen 3.334 N/A THR 438.A N MET 564.A O no hydrogen 3.054 N/A THR 438.A OG1 GLU 563.A OE2 no hydrogen 2.488 N/A GLN 439.A N GLY 457.A O no hydrogen 2.922 N/A MET 440.A N MET 566.A O no hydrogen 3.429 N/A ASN 441.A N VAL 455.A O no hydrogen 2.916 N/A LYS 443.A N ARG 453.A O no hydrogen 2.593 N/A TYR 444.A OH PRO 310.A O no hydrogen 2.877 N/A SER 447.A N PHE 338.A O no hydrogen 3.088 N/A SER 447.A OG LYS 449.A O no hydrogen 3.330 N/A LYS 449.A N SER 447.A OG no hydrogen 3.265 N/A ARG 451.A NH1 TYR 353.A OH no hydrogen 3.060 N/A THR 454.A OG1 ASP 350.A OD1 no hydrogen 3.550 N/A VAL 455.A N ASN 441.A O no hydrogen 2.882 N/A ALA 456.A N SER 580.A OG no hydrogen 3.267 N/A THR 463.A OG1 SER 459.A O no hydrogen 2.775 N/A MET 464.A N ILE 460.A O no hydrogen 2.892 N/A THR 465.A N CYS 461.A O no hydrogen 2.998 N/A THR 465.A OG1 CYS 461.A O no hydrogen 3.083 N/A THR 465.A OG1 SER 462.A O no hydrogen 3.337 N/A ASN 466.A N SER 462.A O no hydrogen 2.886 N/A ARG 467.A N THR 463.A O no hydrogen 2.898 N/A ARG 467.A NH1 TYR 414.A OH no hydrogen 3.021 N/A GLN 468.A N MET 464.A O no hydrogen 3.003 N/A PHE 469.A N THR 465.A O no hydrogen 2.919 N/A HIS 470.A N ASN 466.A O no hydrogen 2.884 N/A HIS 470.A N ARG 467.A O no hydrogen 3.251 N/A GLN 471.A N ARG 467.A O no hydrogen 2.902 N/A GLN 471.A NE2 ILE 392.A O no hydrogen 2.311 N/A LEU 474.A N HIS 470.A O no hydrogen 2.949 N/A LYS 475.A N GLN 471.A O no hydrogen 2.877 N/A SER 476.A N LYS 472.A O no hydrogen 2.938 N/A SER 476.A OG ASP 382.A OD1 no hydrogen 3.476 N/A ILE 477.A N LEU 473.A O no hydrogen 2.913 N/A ALA 478.A N LEU 474.A O no hydrogen 2.921 N/A ALA 479.A N SER 476.A O no hydrogen 3.374 N/A THR 480.A OG1 SER 476.A O no hydrogen 2.848 N/A ARG 481.A NH1 ALA 478.A O no hydrogen 3.228 N/A VAL 486.A N ILE 655.A O no hydrogen 3.086 N/A THR 489.A N VAL 486.A O no hydrogen 3.205 N/A LYS 491.A NZ ASP 763.A OD1 no hydrogen 2.920 N/A PHE 492.A N SER 490.A OG no hydrogen 3.016 N/A TYR 493.A N MET 809.A O no hydrogen 2.904 N/A GLY 495.A N PHE 492.A O no hydrogen 2.626 N/A TRP 496.A N LYS 491.A O no hydrogen 3.202 N/A TRP 496.A NE1 THR 715.A OG1 no hydrogen 2.785 N/A ASN 498.A N GLY 494.A O no hydrogen 3.143 N/A MET 499.A N GLY 495.A O no hydrogen 2.902 N/A LEU 500.A N TRP 496.A O no hydrogen 2.940 N/A LYS 501.A N HIS 497.A O no hydrogen 2.908 N/A THR 502.A N ASN 498.A O no hydrogen 2.892 N/A THR 502.A OG1 ASN 498.A O no hydrogen 2.527 N/A VAL 503.A N MET 499.A O no hydrogen 2.971 N/A TYR 504.A N LEU 500.A O no hydrogen 2.927 N/A SER 505.A N THR 502.A O no hydrogen 3.451 N/A SER 505.A OG THR 502.A O no hydrogen 2.862 N/A ASN 509.A N ASN 665.A OD1 no hydrogen 2.993 N/A HIS 511.A N PHE 664.A O no hydrogen 2.951 N/A LEU 512.A N GLU 700.A O no hydrogen 2.933 N/A MET 513.A N VAL 662.A O no hydrogen 2.888 N/A GLY 514.A N TRP 698.A O no hydrogen 2.906 N/A TYR 517.A OH ASN 593.A OD1 no hydrogen 2.332 N/A CYS 520.A SG ASP 658.A OD1 no hydrogen 3.126 N/A ARG 522.A N LYS 519.A O no hydrogen 3.294 N/A ARG 522.A NH2 THR 454.A OG1 no hydrogen 2.638 N/A ALA 523.A N LYS 519.A O no hydrogen 2.806 N/A ASN 526.A ND2 PRO 575.A O no hydrogen 3.421 N/A ARG 529.A N PRO 525.A O no hydrogen 3.479 N/A ARG 529.A NH1 ARG 529.A O no hydrogen 3.030 N/A ARG 529.A NH1 SER 533.A OG no hydrogen 2.260 N/A ARG 529.A NH2 ASP 582.A OD1 no hydrogen 3.144 N/A ILE 530.A N ASN 526.A O no hydrogen 2.925 N/A MET 531.A N MET 527.A O no hydrogen 2.891 N/A ALA 532.A N LEU 528.A O no hydrogen 2.898 N/A SER 533.A N ARG 529.A O no hydrogen 2.984 N/A SER 533.A OG ARG 529.A O no hydrogen 3.416 N/A LEU 534.A N ILE 530.A O no hydrogen 2.896 N/A VAL 535.A N MET 531.A O no hydrogen 2.880 N/A LEU 536.A N ALA 532.A O no hydrogen 2.965 N/A ALA 537.A N SER 533.A O no hydrogen 2.892 N/A ARG 538.A N VAL 535.A O no hydrogen 3.386 N/A ARG 538.A NH1 ASP 375.A OD2 no hydrogen 3.126 N/A ARG 538.A NH2 GLU 372.A OE2 no hydrogen 3.098 N/A LYS 539.A NZ PHE 378.A O no hydrogen 2.563 N/A LYS 539.A NZ TYR 381.A O no hydrogen 2.678 N/A HIS 540.A N ALA 537.A O no hydrogen 3.324 N/A CYS 543.A SG HIS 540.A ND1 no hydrogen 3.156 N/A CYS 544.A SG HIS 540.A ND1 no hydrogen 3.945 N/A ARG 549.A N SER 545.A O no hydrogen 3.207 N/A ARG 549.A NH1 HIS 540.A O no hydrogen 3.222 N/A PHE 550.A N LEU 546.A O no hydrogen 2.924 N/A TYR 551.A N SER 547.A O no hydrogen 2.910 N/A TYR 551.A OH HIS 258.A O no hydrogen 2.690 N/A ARG 552.A N HIS 548.A O no hydrogen 2.929 N/A ARG 552.A NH1 THR 429.A OG1 no hydrogen 3.235 N/A ARG 552.A NH2 ASN 466.A OD1 no hydrogen 2.725 N/A ARG 552.A NH2 GLU 556.A OE2 no hydrogen 3.300 N/A LEU 553.A N ARG 549.A O no hydrogen 2.911 N/A ALA 554.A N PHE 550.A O no hydrogen 2.881 N/A ASN 555.A N TYR 551.A O no hydrogen 2.929 N/A ASN 555.A ND2 ASN 432.A O no hydrogen 3.095 N/A ASN 555.A ND2 TYR 551.A O no hydrogen 2.752 N/A GLU 556.A N ARG 552.A O no hydrogen 2.989 N/A GLU 556.A N GLU 556.A OE1 no hydrogen 3.030 N/A CYS 557.A N LEU 553.A O no hydrogen 2.911 N/A CYS 557.A SG GLU 253.A OE2 no hydrogen 3.546 N/A CYS 557.A SG LEU 553.A O no hydrogen 3.584 N/A ALA 558.A N ALA 554.A O no hydrogen 2.879 N/A GLN 559.A N ASN 555.A O no hydrogen 2.943 N/A GLN 559.A N GLU 556.A O no hydrogen 3.295 N/A GLN 559.A NE2 ASN 555.A O no hydrogen 2.983 N/A VAL 560.A N GLU 556.A O no hydrogen 2.751 N/A LEU 561.A N GLU 556.A O no hydrogen 3.394 N/A SER 562.A N CYS 557.A O no hydrogen 3.022 N/A GLU 563.A N GLU 563.A OE1 no hydrogen 2.778 N/A VAL 565.A N TYR 572.A O no hydrogen 2.861 N/A MET 566.A N THR 438.A O no hydrogen 3.040 N/A CYS 567.A N SER 570.A O no hydrogen 2.910 N/A SER 570.A N CYS 567.A O no hydrogen 2.928 N/A LEU 571.A N ALA 297.A O no hydrogen 2.902 N/A TYR 572.A N VAL 565.A O no hydrogen 2.890 N/A TYR 572.A OH ASP 288.A OD2 no hydrogen 2.372 N/A VAL 573.A N PHE 294.A O no hydrogen 3.132 N/A LYS 574.A N GLU 563.A O no hydrogen 3.263 N/A LYS 574.A NZ VAL 560.A O no hydrogen 2.722 N/A LYS 574.A NZ GLU 563.A OE1 no hydrogen 3.137 N/A LYS 574.A NZ GLU 563.A OE2 no hydrogen 3.271 N/A THR 578.A N ASP 521.A O no hydrogen 3.406 N/A THR 578.A OG1 ASP 521.A O no hydrogen 3.483 N/A ASP 582.A N SER 579.A O no hydrogen 3.041 N/A ALA 583.A N ASP 582.A OD2 no hydrogen 2.477 N/A THR 585.A OG1 SER 579.A O no hydrogen 2.964 N/A THR 585.A OG1 ASP 582.A O no hydrogen 3.095 N/A ALA 588.A N THR 584.A O no hydrogen 3.180 N/A ASN 589.A N THR 585.A O no hydrogen 2.920 N/A SER 590.A N ALA 586.A O no hydrogen 2.867 N/A SER 590.A OG ALA 586.A O no hydrogen 2.727 N/A VAL 591.A N TYR 587.A O no hydrogen 2.948 N/A PHE 592.A N ALA 588.A O no hydrogen 2.932 N/A ASN 593.A N ASN 589.A O no hydrogen 2.868 N/A ILE 594.A N SER 590.A O no hydrogen 2.944 N/A CYS 595.A N VAL 591.A O no hydrogen 2.888 N/A GLN 596.A N PHE 592.A O no hydrogen 2.932 N/A ALA 597.A N ASN 593.A O no hydrogen 2.967 N/A VAL 598.A N ILE 594.A O no hydrogen 2.901 N/A THR 599.A N CYS 595.A O no hydrogen 2.883 N/A THR 599.A OG1 CYS 595.A O no hydrogen 2.621 N/A ALA 600.A N GLN 596.A O no hydrogen 2.905 N/A ASN 601.A N ALA 597.A O no hydrogen 2.959 N/A ASN 601.A ND2 ALA 597.A O no hydrogen 2.503 N/A VAL 602.A N VAL 598.A O no hydrogen 2.898 N/A ASN 603.A N THR 599.A O no hydrogen 2.915 N/A ALA 604.A N ALA 600.A O no hydrogen 2.884 N/A LEU 605.A N ASN 601.A O no hydrogen 2.926 N/A LEU 606.A N VAL 602.A O no hydrogen 2.911 N/A SER 607.A N ASN 603.A O no hydrogen 2.930 N/A SER 607.A OG ASN 603.A O no hydrogen 2.580 N/A SER 607.A OG ALA 604.A O no hydrogen 3.514 N/A THR 608.A OG1 ALA 604.A O no hydrogen 2.753 N/A THR 608.A OG1 GLY 672.A O no hydrogen 2.210 N/A ASN 611.A N ASP 609.A O no hydrogen 2.713 N/A ILE 613.A N GLY 610.A O no hydrogen 3.282 N/A ARG 619.A N ASP 615.A O no hydrogen 3.076 N/A ASN 620.A N LYS 616.A O no hydrogen 2.944 N/A LEU 621.A N TYR 617.A O no hydrogen 2.887 N/A GLN 622.A N VAL 618.A O no hydrogen 2.894 N/A GLN 622.A NE2 ALA 13.A O no hydrogen 2.329 N/A HIS 623.A N ARG 619.A O no hydrogen 2.975 N/A HIS 623.A NE2 ASN 9.A O no hydrogen 2.526 N/A ARG 624.A N ASN 620.A O no hydrogen 2.923 N/A ARG 624.A NE ASN 620.A O no hydrogen 3.498 N/A ARG 624.A NH1 GLU 642.A OE1 no hydrogen 2.267 N/A ARG 624.A NH2 GLU 642.A OE2 no hydrogen 2.359 N/A LEU 625.A N LEU 621.A O no hydrogen 2.826 N/A TYR 626.A N GLN 622.A O no hydrogen 2.997 N/A TYR 626.A OH ASP 6.A OD1 no hydrogen 2.982 N/A GLU 627.A N HIS 623.A O no hydrogen 2.970 N/A CYS 628.A N ARG 624.A O no hydrogen 2.851 N/A LEU 629.A N TYR 626.A O no hydrogen 3.183 N/A TYR 630.A N TYR 626.A O no hydrogen 2.950 N/A TYR 630.A OH ASP 363.A OD1 no hydrogen 3.386 N/A ARG 631.A N GLU 627.A O no hydrogen 3.053 N/A ASN 632.A N GLU 627.A O no hydrogen 3.110 N/A ARG 633.A NH2 ASP 194.A OD2 no hydrogen 2.427 N/A VAL 640.A N ASP 636.A O no hydrogen 3.038 N/A ASN 641.A N THR 637.A O no hydrogen 2.916 N/A GLU 642.A N ASP 638.A O no hydrogen 2.925 N/A PHE 643.A N PHE 639.A O no hydrogen 2.875 N/A TYR 644.A N VAL 640.A O no hydrogen 2.898 N/A ALA 645.A N ASN 641.A O no hydrogen 2.928 N/A TYR 646.A N GLU 642.A O no hydrogen 2.885 N/A TYR 646.A OH LEU 673.A O no hydrogen 3.423 N/A LEU 647.A N PHE 643.A O no hydrogen 2.923 N/A ARG 648.A N TYR 644.A O no hydrogen 2.886 N/A LYS 649.A N ALA 645.A O no hydrogen 2.938 N/A LYS 649.A NZ ASP 506.A OD1 no hydrogen 2.511 N/A HIS 650.A N TYR 646.A O no hydrogen 2.951 N/A PHE 651.A N LEU 647.A O no hydrogen 2.498 N/A SER 652.A N CYS 663.A O no hydrogen 2.898 N/A SER 652.A OG ARG 648.A O no hydrogen 3.471 N/A MET 654.A N VAL 661.A O no hydrogen 2.892 N/A ILE 655.A N THR 484.A O no hydrogen 3.276 N/A LEU 656.A N ASP 659.A O no hydrogen 2.944 N/A ASP 658.A N LEU 656.A O no hydrogen 2.400 N/A ASP 659.A N LEU 656.A O no hydrogen 2.993 N/A VAL 661.A N MET 654.A O no hydrogen 2.937 N/A VAL 662.A N MET 513.A O no hydrogen 2.935 N/A CYS 663.A N SER 652.A O no hydrogen 2.893 N/A CYS 663.A SG HIS 511.A O no hydrogen 3.882 N/A PHE 664.A N HIS 511.A O no hydrogen 2.906 N/A ASN 665.A ND2 GLU 508.A OE1 no hydrogen 3.344 N/A ASN 665.A ND2 HIS 650.A ND1 no hydrogen 3.674 N/A SER 666.A N ASN 509.A O no hydrogen 2.637 N/A SER 666.A OG HIS 511.A ND1 no hydrogen 2.897 N/A THR 667.A OG1 ASN 509.A OD1 no hydrogen 2.804 N/A ALA 669.A N ASN 665.A O no hydrogen 3.212 N/A SER 670.A N SER 666.A O no hydrogen 2.897 N/A GLN 671.A N THR 667.A O no hydrogen 2.928 N/A GLY 672.A N ALA 669.A O no hydrogen 3.012 N/A LEU 673.A N TYR 668.A O no hydrogen 2.874 N/A ALA 675.A N ASN 601.A OD1 no hydrogen 3.519 N/A SER 676.A N ASN 679.A OD1 no hydrogen 2.836 N/A PHE 680.A N SER 676.A O no hydrogen 3.347 N/A LYS 681.A N ILE 677.A O no hydrogen 2.923 N/A LYS 681.A NZ GLU 39.A OE1 no hydrogen 2.693 N/A LYS 681.A NZ GLU 694.A OE2 no hydrogen 2.717 N/A SER 682.A N LYS 678.A O no hydrogen 2.946 N/A SER 682.A OG PHE 37.A O no hydrogen 3.103 N/A SER 682.A OG LYS 678.A O no hydrogen 2.884 N/A VAL 683.A N ASN 679.A O no hydrogen 2.928 N/A LEU 684.A N PHE 680.A O no hydrogen 2.929 N/A TYR 685.A N LYS 681.A O no hydrogen 2.933 N/A TYR 685.A OH TYR 66.A O no hydrogen 3.352 N/A TYR 685.A OH TYR 78.A OH no hydrogen 2.318 N/A TYR 686.A N SER 682.A O no hydrogen 2.986 N/A GLN 687.A N VAL 683.A O no hydrogen 2.990 N/A VAL 690.A N LEU 684.A O no hydrogen 3.258 N/A GLU 694.A N GLU 694.A OE1 no hydrogen 2.685 N/A LYS 696.A N SER 693.A O no hydrogen 3.364 N/A CYS 697.A SG SER 693.A O no hydrogen 3.397 N/A TRP 698.A N GLY 514.A O no hydrogen 2.929 N/A THR 699.A OG1 LEU 512.A O no hydrogen 3.129 N/A GLU 700.A N LEU 512.A O no hydrogen 2.863 N/A PHE 710.A N GLN 713.A O no hydrogen 2.889 N/A CYS 711.A N ASP 659.A OD2 no hydrogen 2.306 N/A GLN 713.A N PHE 710.A O no hydrogen 2.978 N/A HIS 714.A N TYR 729.A O no hydrogen 2.881 N/A THR 715.A OG1 LEU 727.A O no hydrogen 3.271 N/A MET 716.A N LEU 727.A O no hydrogen 2.963 N/A VAL 718.A N VAL 725.A O no hydrogen 2.889 N/A GLN 720.A N ASP 723.A O no hydrogen 2.900 N/A ASP 723.A N GLN 720.A O no hydrogen 2.917 N/A VAL 725.A N VAL 718.A O no hydrogen 2.901 N/A TYR 726.A OH LEU 703.A O no hydrogen 3.306 N/A LEU 727.A N MET 716.A O no hydrogen 2.900 N/A TYR 729.A N HIS 714.A O no hydrogen 2.854 N/A SER 733.A OG HIS 337.A ND1 no hydrogen 3.332 N/A SER 733.A OG ASP 731.A OD2 no hydrogen 2.541 N/A ARG 734.A N ASP 731.A O no hydrogen 2.995 N/A ARG 734.A NH1 ARG 734.A O no hydrogen 3.362 N/A LEU 736.A N PRO 732.A O no hydrogen 2.904 N/A GLY 737.A N SER 733.A O no hydrogen 2.863 N/A ALA 738.A N ARG 734.A O no hydrogen 2.908 N/A GLY 739.A N ILE 735.A O no hydrogen 2.947 N/A CYS 740.A N LEU 736.A O no hydrogen 2.893 N/A CYS 740.A SG LEU 736.A O no hydrogen 3.428 N/A PHE 741.A N GLY 737.A O no hydrogen 2.762 N/A VAL 742.A N ASN 312.A O no hydrogen 3.260 N/A LYS 747.A N ASP 744.A O no hydrogen 3.327 N/A THR 748.A N ILE 745.A O no hydrogen 2.913 N/A THR 748.A OG1 ILE 745.A O no hydrogen 3.013 N/A ASP 749.A N VAL 746.A O no hydrogen 3.431 N/A ILE 754.A N THR 751.A O no hydrogen 2.935 N/A ARG 756.A N LEU 752.A O no hydrogen 3.061 N/A ARG 756.A NH1 ALA 738.A O no hydrogen 2.315 N/A ARG 756.A NH2 ALA 738.A O no hydrogen 3.230 N/A PHE 757.A N MET 753.A O no hydrogen 2.626 N/A VAL 758.A N ILE 754.A O no hydrogen 2.731 N/A SER 759.A N GLU 755.A O no hydrogen 2.887 N/A SER 759.A OG GLU 755.A O no hydrogen 3.290 N/A LEU 760.A N PHE 757.A O no hydrogen 2.956 N/A ALA 761.A N PHE 757.A O no hydrogen 2.634 N/A ILE 762.A N VAL 758.A O no hydrogen 2.778 N/A ALA 764.A N ALA 761.A O no hydrogen 3.315 N/A TYR 765.A OH GLU 807.A OE1 no hydrogen 2.462 N/A THR 768.A N TYR 765.A O no hydrogen 2.891 N/A THR 768.A OG1 TYR 765.A O no hydrogen 2.723 N/A LYS 769.A N PRO 766.A O no hydrogen 2.900 N/A LYS 769.A NZ TYR 765.A OH no hydrogen 2.665 N/A HIS 770.A N LEU 767.A O no hydrogen 3.196 N/A HIS 770.A NE2 TYR 729.A OH no hydrogen 2.962 N/A ALA 776.A N ASN 772.A O no hydrogen 3.291 N/A ASP 777.A N GLN 773.A O no hydrogen 2.874 N/A VAL 778.A N GLU 774.A O no hydrogen 2.963 N/A VAL 778.A N TYR 775.A O no hydrogen 3.215 N/A LEU 781.A N ASP 777.A O no hydrogen 2.841 N/A TYR 782.A N VAL 778.A O no hydrogen 2.978 N/A LEU 783.A N PHE 779.A O no hydrogen 2.949 N/A GLN 784.A N HIS 780.A O no hydrogen 2.872 N/A TYR 785.A N LEU 781.A O no hydrogen 2.872 N/A ILE 786.A N TYR 782.A O no hydrogen 2.909 N/A ARG 787.A N LEU 783.A O no hydrogen 2.931 N/A LYS 788.A N GLN 784.A O no hydrogen 2.882 N/A LEU 789.A N TYR 785.A O no hydrogen 2.892 N/A HIS 790.A N ILE 786.A O no hydrogen 2.945 N/A ASP 791.A N ARG 787.A O no hydrogen 2.887 N/A GLU 792.A N LYS 788.A O no hydrogen 2.891 N/A LEU 793.A N LEU 789.A O no hydrogen 2.900 N/A THR 794.A N HIS 790.A O no hydrogen 3.234 N/A THR 794.A OG1 HIS 790.A O no hydrogen 3.151 N/A THR 794.A OG1 ASP 791.A O no hydrogen 2.694 N/A ASP 795.A N ASP 795.A OD1 no hydrogen 2.650 N/A THR 797.A OG1 HIS 790.A NE2 no hydrogen 2.670 N/A SER 798.A OG GLU 802.A OE2 no hydrogen 3.275 N/A TYR 800.A N THR 797.A O no hydrogen 2.940 N/A TRP 801.A N SER 798.A O no hydrogen 3.207 N/A TYR 806.A OH TYR 800.A O no hydrogen 2.202 N/A GLU 807.A N PRO 803.A O no hydrogen 2.892 N/A ALA 808.A N GLU 804.A O no hydrogen 2.903 N/A TYR 810.A N GLU 807.A O no hydrogen 3.197 N/A THR 811.A OG1 ALA 808.A O no hydrogen 2.864 N/A