Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ukj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N GLU 75.A O no hydrogen 3.097 N/A PRO 1.A N GLU 126.A OE1 no hydrogen 3.121 N/A PRO 1.A N GLU 126.A OE2 no hydrogen 2.906 N/A ARG 3.A NE GLN 74.A OE1 no hydrogen 2.780 N/A ARG 3.A NH2 GLY 7.A O no hydrogen 3.008 N/A ARG 3.A NH2 GLN 74.A OE1 no hydrogen 3.485 N/A SER 6.A OG GLU 673.A OE1 no hydrogen 2.856 N/A GLU 8.A N HIS 13.A O no hydrogen 2.944 N/A LEU 9.A N ILE 12.A O no hydrogen 3.326 N/A TRP 10.A N PHE 94.A O no hydrogen 3.079 N/A ILE 12.A N LEU 9.A O no hydrogen 3.378 N/A HIS 13.A ND1 ASN 677.A OD1 no hydrogen 2.808 N/A HIS 13.A NE2 GLN 684.A OE1 no hydrogen 3.314 N/A MET 15.A N GLU 8.A OE1 no hydrogen 2.802 N/A ARG 18.A NH2 GLU 34.A OE1 no hydrogen 3.408 N/A ILE 19.A N CYS 35.A O no hydrogen 2.729 N/A VAL 21.A N LEU 33.A O no hydrogen 2.817 N/A GLU 22.A N PRO 96.A O no hydrogen 3.134 N/A CYS 23.A N VAL 31.A O no hydrogen 2.820 N/A CYS 23.A SG VAL 21.A O no hydrogen 3.980 N/A LEU 24.A N LEU 98.A O no hydrogen 2.798 N/A LEU 25.A N MET 29.A O no hydrogen 2.957 N/A ASN 27.A ND2 LEU 57.A O no hydrogen 3.292 N/A GLY 28.A N LEU 25.A O no hydrogen 3.153 N/A MET 29.A N ASN 27.A OD1 no hydrogen 2.945 N/A VAL 31.A N CYS 23.A O no hydrogen 2.817 N/A THR 32.A OG1 GLU 22.A OE2 no hydrogen 2.726 N/A LEU 33.A N VAL 21.A O no hydrogen 2.844 N/A CYS 35.A N ILE 19.A O no hydrogen 2.783 N/A CYS 35.A SG LEU 33.A O no hydrogen 3.802 N/A ARG 37.A N PRO 17.A O no hydrogen 2.915 N/A ARG 37.A NE GLU 8.A OE1 no hydrogen 3.304 N/A ARG 37.A NH1 GLU 38.A OE1 no hydrogen 3.464 N/A ARG 37.A NH1 ASP 706.A OD2 no hydrogen 2.787 N/A ARG 37.A NH2 GLU 8.A OE2 no hydrogen 2.923 N/A ARG 37.A NH2 ASP 706.A OD1 no hydrogen 3.279 N/A ARG 37.A NH2 ASP 706.A OD2 no hydrogen 2.948 N/A ALA 39.A N LEU 36.A O no hydrogen 3.187 N/A THR 40.A OG1 THR 43.A OG1 no hydrogen 3.353 N/A LEU 41.A N ARG 86.A O no hydrogen 2.866 N/A THR 43.A OG1 THR 40.A OG1 no hydrogen 3.353 N/A ILE 44.A N THR 40.A O no hydrogen 3.263 N/A LYS 45.A N LEU 41.A O no hydrogen 3.108 N/A LYS 45.A NZ GLU 64.A O no hydrogen 2.915 N/A LYS 45.A NZ TYR 67.A O no hydrogen 2.804 N/A LYS 45.A NZ GLU 84.A OE1 no hydrogen 3.459 N/A LYS 45.A NZ GLU 84.A OE2 no hydrogen 2.916 N/A HIS 46.A N ILE 42.A O no hydrogen 3.193 N/A HIS 46.A N THR 43.A O no hydrogen 2.868 N/A HIS 46.A ND1 GLU 64.A OE1 no hydrogen 2.848 N/A GLU 47.A N THR 43.A O no hydrogen 3.085 N/A LEU 48.A N ILE 44.A O no hydrogen 3.023 N/A PHE 49.A N LYS 45.A O no hydrogen 3.302 N/A LYS 50.A N HIS 46.A O no hydrogen 3.281 N/A LYS 50.A NZ GLU 47.A OE1 no hydrogen 2.988 N/A GLU 51.A N GLU 47.A O no hydrogen 3.059 N/A ALA 52.A N LEU 48.A O no hydrogen 2.737 N/A ARG 53.A N LYS 50.A O no hydrogen 3.195 N/A ARG 53.A NE LYS 50.A O no hydrogen 3.508 N/A LYS 54.A N GLU 51.A O no hydrogen 3.180 N/A LYS 54.A NZ GLU 51.A OE1 no hydrogen 2.854 N/A TYR 55.A N ALA 52.A O no hydrogen 3.133 N/A HIS 58.A ND1 TYR 55.A O no hydrogen 2.788 N/A GLN 59.A N GLN 59.A OE1 no hydrogen 3.016 N/A LEU 60.A N LEU 57.A O no hydrogen 2.929 N/A LEU 61.A N HIS 58.A O no hydrogen 3.132 N/A GLN 62.A N TYR 67.A OH no hydrogen 3.126 N/A SER 66.A N ASP 63.A O no hydrogen 2.878 N/A SER 66.A OG ASP 63.A O no hydrogen 3.482 N/A TYR 67.A N GLU 64.A O no hydrogen 3.299 N/A ILE 68.A N ILE 101.A O no hydrogen 2.989 N/A VAL 70.A N LYS 99.A O no hydrogen 2.879 N/A SER 71.A N GLU 79.A O no hydrogen 3.015 N/A SER 71.A OG PHE 97.A O no hydrogen 2.727 N/A THR 73.A N GLU 77.A O no hydrogen 2.892 N/A THR 73.A OG1 GLU 77.A O no hydrogen 3.180 N/A GLN 74.A N ARG 92.A O no hydrogen 2.804 N/A GLN 74.A NE2 GLY 7.A O no hydrogen 3.021 N/A GLN 74.A NE2 LEU 93.A O no hydrogen 2.908 N/A ALA 76.A N THR 73.A O no hydrogen 3.036 N/A GLU 79.A N SER 71.A O no hydrogen 2.832 N/A PHE 81.A N PHE 69.A O no hydrogen 2.724 N/A THR 85.A N ASP 83.A OD1 no hydrogen 3.331 N/A THR 85.A OG1 ASP 83.A OD1 no hydrogen 2.684 N/A ARG 86.A N ASP 83.A O no hydrogen 3.259 N/A ARG 86.A NH1 GLU 79.A OE2 no hydrogen 2.957 N/A ARG 86.A NH2 ASP 90.A O no hydrogen 3.088 N/A ARG 87.A NH1 GLU 38.A O no hydrogen 2.998 N/A ARG 87.A NH2 ASP 709.A OD2 no hydrogen 2.836 N/A LEU 88.A N ALA 39.A O no hydrogen 3.072 N/A CYS 89.A N ARG 37.A O no hydrogen 3.035 N/A CYS 89.A SG ARG 37.A O no hydrogen 3.474 N/A CYS 89.A SG ASP 90.A OD1 no hydrogen 3.730 N/A ASP 90.A N ARG 87.A O no hydrogen 3.010 N/A LEU 91.A N LEU 88.A O no hydrogen 3.275 N/A ARG 92.A NH2 GLU 79.A OE1 no hydrogen 3.556 N/A PHE 94.A N VAL 72.A O no hydrogen 2.789 N/A GLN 95.A NE2 PHE 94.A O no hydrogen 3.007 N/A PHE 97.A N GLN 95.A O no hydrogen 2.892 N/A LEU 98.A N GLU 22.A O no hydrogen 2.852 N/A LYS 99.A N VAL 70.A O no hydrogen 2.927 N/A VAL 100.A N LEU 24.A O no hydrogen 2.980 N/A ILE 101.A N ILE 68.A O no hydrogen 2.950 N/A GLU 109.A N ASN 106.A OD1 no hydrogen 3.171 N/A LYS 110.A N ASN 106.A O no hydrogen 3.070 N/A LYS 110.A NZ GLU 80.A OE1 no hydrogen 2.892 N/A LYS 110.A NZ VAL 104.A O no hydrogen 2.807 N/A ILE 111.A N ARG 107.A O no hydrogen 3.155 N/A LEU 112.A N GLU 108.A O no hydrogen 3.160 N/A ASN 113.A N GLU 109.A O no hydrogen 2.988 N/A ARG 114.A N LYS 110.A O no hydrogen 3.109 N/A GLU 115.A N ILE 111.A O no hydrogen 3.015 N/A ILE 116.A N LEU 112.A O no hydrogen 2.823 N/A GLY 117.A N ASN 113.A O no hydrogen 2.966 N/A PHE 118.A N ARG 114.A O no hydrogen 2.982 N/A ALA 119.A N GLU 115.A O no hydrogen 3.248 N/A ILE 120.A N ILE 116.A O no hydrogen 2.984 N/A GLY 121.A N GLY 117.A O no hydrogen 2.927 N/A MET 122.A N GLY 117.A O no hydrogen 3.155 N/A GLU 126.A N PRO 123.A O no hydrogen 3.126 N/A PHE 127.A N VAL 124.A O no hydrogen 2.814 N/A VAL 130.A N PHE 127.A O no hydrogen 3.263 N/A GLU 134.A N ASP 132.A OD1 no hydrogen 3.139 N/A GLN 136.A N ASP 132.A O no hydrogen 3.359 N/A GLN 136.A NE2 PHE 127.A O no hydrogen 2.790 N/A GLN 136.A NE2 VAL 130.A O no hydrogen 2.776 N/A ASP 137.A N PRO 133.A O no hydrogen 2.729 N/A PHE 138.A N GLU 134.A O no hydrogen 2.782 N/A ARG 139.A N VAL 135.A O no hydrogen 3.060 N/A ARG 139.A NE GLU 652.A OE1 no hydrogen 2.821 N/A ARG 139.A NH1 GLN 136.A OE1 no hydrogen 3.209 N/A ARG 139.A NH2 GLU 652.A OE1 no hydrogen 3.242 N/A ARG 139.A NH2 GLU 652.A OE2 no hydrogen 2.777 N/A ARG 140.A N GLN 136.A O no hydrogen 2.990 N/A ASN 141.A N ASP 137.A O no hydrogen 2.705 N/A ILE 142.A N PHE 138.A O no hydrogen 3.036 N/A LEU 143.A N ARG 140.A O no hydrogen 3.289 N/A VAL 145.A N ILE 142.A O no hydrogen 3.114 N/A CYS 146.A SG ILE 142.A O no hydrogen 3.690 N/A CYS 146.A SG SER 653.A O no hydrogen 3.683 N/A LYS 147.A N LEU 143.A O no hydrogen 2.788 N/A LYS 147.A NZ ASP 151.A OD1 no hydrogen 3.197 N/A LYS 147.A NZ ASP 151.A OD2 no hydrogen 2.790 N/A GLU 148.A N ASN 144.A O no hydrogen 2.816 N/A ALA 149.A N VAL 145.A O no hydrogen 3.077 N/A VAL 150.A N CYS 146.A O no hydrogen 3.278 N/A ASP 151.A N LYS 147.A O no hydrogen 3.134 N/A LEU 152.A N GLU 148.A O no hydrogen 3.042 N/A ARG 153.A N ALA 149.A O no hydrogen 3.075 N/A ARG 153.A NH1 ALA 657.A O no hydrogen 3.216 N/A ARG 153.A NH2 LEU 621.A O no hydrogen 2.814 N/A ARG 153.A NH2 ALA 657.A O no hydrogen 3.147 N/A ASP 154.A N VAL 150.A O no hydrogen 3.297 N/A ASP 154.A N ASP 151.A O no hydrogen 3.311 N/A ASN 156.A N SER 160.A OG no hydrogen 2.875 N/A HIS 159.A ND1 TYR 285.A OH no hydrogen 3.266 N/A SER 160.A N ASN 156.A O no hydrogen 3.257 N/A SER 160.A OG ARG 153.A O no hydrogen 2.848 N/A ALA 162.A N PRO 158.A O no hydrogen 3.092 N/A MET 163.A N HIS 159.A O no hydrogen 3.017 N/A TYR 164.A N ARG 161.A O no hydrogen 3.388 N/A TYR 164.A OH CYS 658.A O no hydrogen 2.633 N/A VAL 165.A N ARG 161.A O no hydrogen 3.398 N/A TYR 166.A N ALA 162.A O no hydrogen 2.876 N/A GLU 171.A N GLN 260.A O no hydrogen 2.834 N/A SER 172.A OG THR 587.A OG1 no hydrogen 2.746 N/A SER 172.A OG ASP 589.A OD2 no hydrogen 2.829 N/A ILE 180.A N PRO 177.A O no hydrogen 2.810 N/A TYR 181.A N PRO 177.A O no hydrogen 2.961 N/A ASN 182.A N LYS 178.A O no hydrogen 3.206 N/A LYS 183.A N ILE 180.A O no hydrogen 2.926 N/A LYS 183.A NZ MET 269.A O no hydrogen 3.289 N/A LEU 184.A N TYR 181.A O no hydrogen 3.149 N/A ILE 189.A N ILE 210.A O no hydrogen 2.820 N/A VAL 191.A N LEU 208.A O no hydrogen 3.369 N/A VAL 192.A N PRO 274.A O no hydrogen 2.859 N/A ILE 193.A N TYR 206.A O no hydrogen 3.126 N/A TRP 194.A N LEU 276.A O no hydrogen 2.810 N/A TRP 194.A NE1 ASN 275.A OD1 no hydrogen 3.092 N/A VAL 195.A N GLN 204.A O no hydrogen 3.098 N/A VAL 197.A N ASP 202.A O no hydrogen 3.102 N/A TYR 206.A N ILE 193.A O no hydrogen 2.953 N/A LEU 208.A N VAL 191.A O no hydrogen 2.975 N/A CYS 214.A N ASN 211.A O no hydrogen 3.336 N/A VAL 215.A N GLN 218.A OE1 no hydrogen 3.236 N/A VAL 219.A N VAL 215.A O no hydrogen 3.230 N/A VAL 219.A N PRO 216.A O no hydrogen 2.957 N/A ILE 220.A N PRO 216.A O no hydrogen 2.914 N/A ALA 221.A N GLU 217.A O no hydrogen 2.764 N/A GLU 222.A N GLN 218.A O no hydrogen 3.108 N/A ALA 223.A N ILE 220.A O no hydrogen 2.882 N/A ILE 224.A N ILE 220.A O no hydrogen 2.973 N/A ARG 225.A N ALA 221.A O no hydrogen 2.804 N/A LYS 226.A N GLU 222.A O no hydrogen 3.046 N/A LYS 226.A NZ THR 207.A O no hydrogen 2.818 N/A LYS 227.A N ALA 223.A O no hydrogen 3.298 N/A VAL 234.A N LEU 230.A O no hydrogen 3.022 N/A LEU 235.A N LYS 231.A O no hydrogen 2.861 N/A GLU 236.A N LEU 232.A O no hydrogen 3.245 N/A TYR 237.A N CYS 233.A O no hydrogen 2.827 N/A ILE 242.A N MET 279.A O no hydrogen 2.776 N/A LYS 244.A N MET 277.A O no hydrogen 3.067 N/A LYS 244.A NZ VAL 245.A O no hydrogen 3.057 N/A LYS 244.A NZ CYS 248.A O no hydrogen 3.045 N/A LYS 244.A NZ ASP 750.A OD1 no hydrogen 3.538 N/A LYS 244.A NZ ASP 750.A OD2 no hydrogen 2.877 N/A VAL 245.A N GLU 250.A O no hydrogen 2.867 N/A CYS 246.A N ASN 275.A O no hydrogen 3.122 N/A CYS 248.A N VAL 245.A O no hydrogen 3.476 N/A ASP 249.A N ALA 721.A O no hydrogen 3.089 N/A PHE 252.A N LEU 243.A O no hydrogen 3.036 N/A LYS 255.A N GLU 254.A OE2 no hydrogen 3.020 N/A TYR 256.A N GLU 254.A O no hydrogen 2.747 N/A LEU 258.A N CYS 214.A O no hydrogen 3.188 N/A SER 259.A N HIS 212.A O no hydrogen 2.977 N/A SER 259.A OG HIS 212.A ND1 no hydrogen 3.360 N/A GLN 260.A N PRO 257.A O no hydrogen 2.822 N/A GLN 260.A NE2 GLU 171.A O no hydrogen 2.958 N/A TYR 261.A N LEU 258.A O no hydrogen 3.233 N/A TYR 261.A OH GLU 254.A O no hydrogen 2.805 N/A LYS 262.A N ASN 169.A O no hydrogen 2.902 N/A LYS 262.A NZ ASP 589.A OD1 no hydrogen 2.773 N/A ARG 265.A N TYR 261.A O no hydrogen 2.843 N/A ARG 265.A NE SER 259.A O no hydrogen 2.781 N/A ARG 265.A NH2 SER 173.A O no hydrogen 2.735 N/A ARG 265.A NH2 SER 259.A O no hydrogen 3.539 N/A SER 266.A N LYS 262.A O no hydrogen 2.812 N/A SER 266.A OG LYS 262.A O no hydrogen 3.546 N/A SER 266.A OG TYR 263.A O no hydrogen 2.992 N/A CYS 267.A N TYR 263.A O no hydrogen 3.005 N/A CYS 267.A SG TYR 263.A O no hydrogen 3.276 N/A ILE 268.A N ILE 264.A O no hydrogen 2.948 N/A MET 269.A N ARG 265.A O no hydrogen 3.300 N/A LEU 270.A N SER 266.A O no hydrogen 2.832 N/A GLY 271.A N ILE 268.A O no hydrogen 3.364 N/A ARG 272.A N CYS 267.A O no hydrogen 3.032 N/A ASN 275.A N TYR 263.A OH no hydrogen 3.089 N/A LEU 276.A N VAL 192.A O no hydrogen 2.900 N/A MET 277.A N LYS 244.A O no hydrogen 2.744 N/A LEU 278.A N TRP 194.A O no hydrogen 2.958 N/A MET 279.A N ILE 242.A O no hydrogen 3.319 N/A LYS 281.A N LYS 240.A O no hydrogen 3.459 N/A LYS 281.A NZ GLY 239.A O no hydrogen 3.268 N/A SER 283.A N ALA 280.A O no hydrogen 3.333 N/A SER 283.A OG ALA 280.A O no hydrogen 2.847 N/A LEU 284.A N LYS 281.A O no hydrogen 3.220 N/A TYR 285.A N LYS 281.A O no hydrogen 2.810 N/A SER 286.A N GLU 282.A O no hydrogen 3.283 N/A SER 286.A OG GLU 282.A O no hydrogen 2.798 N/A SER 286.A OG SER 283.A O no hydrogen 3.348 N/A GLN 287.A N LEU 284.A O no hydrogen 2.868 N/A CYS 292.A SG PHE 293.A O no hydrogen 3.770 N/A SER 299.A N PRO 296.A O no hydrogen 3.253 N/A SER 299.A OG PRO 296.A O no hydrogen 2.680 N/A ARG 300.A N PRO 296.A O no hydrogen 3.459 N/A ARG 301.A NH2 ASP 128.A OD1 no hydrogen 3.221 N/A LYS 307.A N VAL 465.A O no hydrogen 3.159 N/A LEU 316.A N ILE 373.A O no hydrogen 2.930 N/A ARG 317.A NE ASP 460.A OD2 no hydrogen 3.496 N/A ILE 318.A N LEU 369.A O no hydrogen 3.016 N/A LYS 319.A N GLU 458.A O no hydrogen 2.812 N/A ILE 320.A N GLU 367.A O no hydrogen 3.048 N/A LEU 321.A N GLU 456.A O no hydrogen 3.126 N/A ALA 323.A N PRO 363.A O no hydrogen 2.836 N/A THR 324.A N CYS 454.A O no hydrogen 2.850 N/A ARG 331.A N ASN 329.A OD1 no hydrogen 3.101 N/A ASP 332.A N ASN 329.A OD1 no hydrogen 3.454 N/A ILE 333.A N ASN 329.A O no hydrogen 3.291 N/A ASP 334.A N VAL 391.A O no hydrogen 3.083 N/A LYS 335.A N VAL 391.A O no hydrogen 3.433 N/A ILE 336.A N VAL 358.A O no hydrogen 2.903 N/A TYR 337.A N CYS 389.A O no hydrogen 2.942 N/A TYR 337.A OH HIS 401.A ND1 no hydrogen 2.654 N/A VAL 338.A N THR 355.A OG1 no hydrogen 3.010 N/A ARG 339.A N SER 387.A O no hydrogen 3.004 N/A ARG 339.A NH1 ASN 354.A OD1 no hydrogen 2.798 N/A THR 340.A N VAL 353.A O no hydrogen 3.151 N/A THR 340.A OG1 VAL 353.A O no hydrogen 2.703 N/A THR 340.A OG1 TYR 371.A OH no hydrogen 2.705 N/A TYR 343.A N ARG 383.A O no hydrogen 2.953 N/A HIS 344.A N GLU 347.A O no hydrogen 3.016 N/A GLU 347.A N HIS 344.A O no hydrogen 3.309 N/A LEU 349.A N ILE 342.A O no hydrogen 2.866 N/A CYS 350.A SG ASP 351.A O no hydrogen 4.048 N/A ASN 352.A ND2 TYR 343.A OH no hydrogen 3.054 N/A VAL 353.A N THR 340.A O no hydrogen 3.213 N/A THR 355.A N VAL 338.A O no hydrogen 3.124 N/A THR 355.A OG1 GLN 356.A O no hydrogen 3.347 N/A GLN 356.A N GLU 367.A OE1 no hydrogen 3.127 N/A ARG 357.A NH1 GLU 399.A OE1 no hydrogen 2.806 N/A ARG 357.A NH2 GLU 399.A OE1 no hydrogen 3.132 N/A ARG 357.A NH2 GLU 399.A OE2 no hydrogen 3.300 N/A VAL 358.A N ILE 336.A O no hydrogen 3.102 N/A SER 361.A OG ASN 362.A OD1 no hydrogen 3.086 N/A ASN 362.A N PRO 359.A O no hydrogen 2.871 N/A ARG 364.A N ASN 362.A O no hydrogen 2.873 N/A TRP 365.A N LEU 321.A O no hydrogen 2.884 N/A ASN 366.A N LEU 321.A O no hydrogen 2.931 N/A GLU 367.A N ILE 320.A O no hydrogen 3.266 N/A LEU 369.A N ILE 318.A O no hydrogen 2.675 N/A TYR 371.A N LEU 316.A O no hydrogen 3.091 N/A TYR 371.A OH THR 340.A OG1 no hydrogen 2.705 N/A ILE 373.A N TYR 371.A O no hydrogen 2.790 N/A TYR 374.A OH ASN 313.A OD1 no hydrogen 2.692 N/A ILE 375.A N SER 314.A O no hydrogen 3.008 N/A ASP 377.A N TYR 374.A O no hydrogen 2.893 N/A LEU 378.A N ILE 375.A O no hydrogen 2.994 N/A ARG 380.A NE ASP 416.A OD1 no hydrogen 3.074 N/A ARG 380.A NH1 ARG 380.A O no hydrogen 2.779 N/A ARG 380.A NH1 TYR 607.A OH no hydrogen 2.793 N/A ARG 380.A NH2 ASP 413.A O no hydrogen 3.128 N/A ARG 380.A NH2 ASP 416.A OD1 no hydrogen 2.830 N/A ARG 380.A NH2 TYR 607.A OH no hydrogen 3.511 N/A ALA 382.A N PRO 379.A O no hydrogen 3.262 N/A ARG 383.A N TYR 343.A O no hydrogen 2.946 N/A ARG 383.A NH1 PRO 440.A O no hydrogen 2.880 N/A ARG 383.A NH2 PRO 440.A O no hydrogen 2.926 N/A LEU 384.A N ILE 409.A O no hydrogen 2.847 N/A CYS 385.A N GLY 341.A O no hydrogen 2.801 N/A LEU 386.A N GLY 407.A O no hydrogen 3.142 N/A SER 387.A N ARG 339.A O no hydrogen 2.985 N/A SER 387.A OG LEU 437.A O no hydrogen 2.606 N/A ILE 388.A N ALA 405.A O no hydrogen 2.956 N/A CYS 389.A N TYR 337.A O no hydrogen 2.931 N/A CYS 389.A SG SER 387.A OG no hydrogen 3.517 N/A CYS 389.A SG LEU 437.A O no hydrogen 3.996 N/A SER 390.A N CYS 402.A O no hydrogen 2.881 N/A SER 390.A OG CYS 402.A O no hydrogen 3.396 N/A VAL 391.A N LYS 335.A O no hydrogen 3.154 N/A LYS 392.A N GLU 400.A O no hydrogen 3.100 N/A GLY 393.A N ASP 334.A OD2 no hydrogen 3.251 N/A ARG 394.A NH2 ARG 331.A O no hydrogen 3.153 N/A GLU 400.A N LYS 392.A O no hydrogen 2.798 N/A HIS 401.A ND1 TYR 337.A OH no hydrogen 2.654 N/A CYS 402.A N SER 390.A O no hydrogen 3.317 N/A CYS 402.A SG PRO 403.A O no hydrogen 3.662 N/A LEU 404.A N ILE 388.A O no hydrogen 2.767 N/A TRP 406.A N TRP 428.A O no hydrogen 3.062 N/A TRP 406.A NE1 PRO 429.A O no hydrogen 3.038 N/A GLY 407.A N LEU 386.A O no hydrogen 3.228 N/A ASN 408.A ND2 ASN 439.A O no hydrogen 2.769 N/A ASN 408.A ND2 GLY 442.A O no hydrogen 3.038 N/A ILE 409.A N LEU 384.A O no hydrogen 2.919 N/A ASN 410.A ND2 GLN 606.A O no hydrogen 3.175 N/A LEU 411.A N ALA 382.A O no hydrogen 3.175 N/A ASP 413.A N THR 417.A O no hydrogen 2.786 N/A TYR 414.A OH ASP 137.A OD2 no hydrogen 3.118 N/A THR 415.A N ASP 413.A OD1 no hydrogen 3.063 N/A THR 415.A OG1 ASP 413.A OD1 no hydrogen 2.680 N/A THR 415.A OG1 THR 417.A OG1 no hydrogen 3.031 N/A ASP 416.A N ASP 413.A O no hydrogen 2.992 N/A THR 417.A N ASP 413.A OD1 no hydrogen 3.181 N/A THR 417.A OG1 THR 415.A OG1 no hydrogen 3.031 N/A LEU 418.A N VAL 466.A O no hydrogen 2.920 N/A VAL 419.A N LEU 411.A O no hydrogen 2.831 N/A GLY 421.A N PHE 459.A O no hydrogen 2.813 N/A MET 423.A N LEU 457.A O no hydrogen 2.852 N/A LEU 425.A N LEU 455.A O no hydrogen 2.779 N/A ASN 426.A N SER 446.A OG no hydrogen 3.000 N/A ASN 426.A ND2 LYS 450.A O no hydrogen 3.566 N/A ASN 426.A ND2 THR 452.A O no hydrogen 3.159 N/A ASN 426.A ND2 THR 452.A OG1 no hydrogen 3.000 N/A LEU 427.A N PRO 453.A O no hydrogen 2.926 N/A TRP 428.A N TRP 406.A O no hydrogen 2.893 N/A TRP 428.A NE1 GLY 445.A O no hydrogen 3.098 N/A LEU 434.A N PRO 431.A O no hydrogen 3.389 N/A GLY 442.A N ASN 439.A O no hydrogen 3.194 N/A GLY 445.A N ASN 408.A O no hydrogen 2.918 N/A ASN 447.A N ASN 426.A O no hydrogen 2.868 N/A ASN 447.A ND2 LEU 427.A O no hydrogen 2.912 N/A ASN 449.A N ASN 447.A OD1 no hydrogen 2.937 N/A LYS 450.A NZ ASN 426.A OD1 no hydrogen 3.503 N/A LYS 450.A NZ ASN 447.A O no hydrogen 3.279 N/A GLU 451.A N ASN 449.A OD1 no hydrogen 2.874 N/A THR 452.A OG1 ASN 449.A O no hydrogen 3.071 N/A CYS 454.A N THR 324.A OG1 no hydrogen 2.794 N/A CYS 454.A SG ASN 426.A OD1 no hydrogen 4.036 N/A LEU 455.A N LEU 425.A O no hydrogen 2.803 N/A GLU 456.A N CYS 322.A O no hydrogen 2.811 N/A LEU 457.A N MET 423.A O no hydrogen 2.805 N/A GLU 458.A N LYS 319.A O no hydrogen 2.759 N/A PHE 459.A N GLY 421.A O no hydrogen 2.847 N/A TRP 461.A N ASP 460.A OD1 no hydrogen 2.820 N/A SER 463.A OG PHE 462.A O no hydrogen 2.683 N/A VAL 465.A N SER 305.A O no hydrogen 3.156 N/A LYS 467.A N LYS 307.A O no hydrogen 2.929 N/A LYS 467.A NZ THR 415.A O no hydrogen 2.924 N/A LYS 467.A NZ THR 417.A OG1 no hydrogen 2.933 N/A PHE 468.A N ASP 416.A O no hydrogen 2.955 N/A SER 472.A N ASP 470.A OD2 no hydrogen 3.189 N/A SER 472.A OG ASP 470.A OD2 no hydrogen 2.841 N/A VAL 473.A N ASP 470.A O no hydrogen 2.952 N/A ILE 474.A N ASP 470.A O no hydrogen 3.044 N/A GLU 475.A N MET 471.A O no hydrogen 2.948 N/A GLU 476.A N SER 472.A O no hydrogen 3.129 N/A HIS 477.A N VAL 473.A O no hydrogen 3.149 N/A HIS 477.A NE2 ASP 541.A OD1 no hydrogen 2.905 N/A ALA 478.A N ILE 474.A O no hydrogen 3.063 N/A ASN 479.A N GLU 475.A O no hydrogen 3.404 N/A TRP 480.A N GLU 476.A O no hydrogen 3.205 N/A SER 481.A N HIS 477.A O no hydrogen 3.083 N/A SER 481.A OG HIS 477.A O no hydrogen 2.793 N/A VAL 482.A N ALA 478.A O no hydrogen 2.918 N/A SER 483.A N TRP 480.A O no hydrogen 3.173 N/A SER 483.A OG ASN 479.A O no hydrogen 2.849 N/A ARG 484.A N SER 481.A O no hydrogen 3.292 N/A LYS 491.A N ARG 487.A O no hydrogen 3.321 N/A GLU 492.A N ASN 489.A O no hydrogen 2.795 N/A GLN 493.A N ASN 489.A O no hydrogen 3.011 N/A LEU 494.A N ASP 490.A O no hydrogen 3.097 N/A LYS 495.A N LYS 491.A O no hydrogen 3.265 N/A ALA 496.A N GLU 492.A O no hydrogen 3.030 N/A ILE 497.A N GLN 493.A O no hydrogen 3.040 N/A SER 498.A N LEU 494.A O no hydrogen 3.283 N/A SER 498.A OG LYS 495.A O no hydrogen 2.768 N/A THR 499.A OG1 ALA 496.A O no hydrogen 2.738 N/A ARG 500.A N ILE 497.A O no hydrogen 3.020 N/A ARG 500.A NH1 GLU 510.A OE1 no hydrogen 3.365 N/A ARG 500.A NH2 GLU 510.A OE1 no hydrogen 3.280 N/A ARG 500.A NH2 GLU 510.A OE2 no hydrogen 2.918 N/A LEU 503.A N ASP 501.A OD2 no hydrogen 3.063 N/A SER 504.A N ASP 501.A O no hydrogen 3.147 N/A SER 504.A OG ASP 501.A O no hydrogen 2.980 N/A THR 507.A N GLU 510.A OE1 no hydrogen 3.327 N/A THR 507.A OG1 GLN 509.A OE1 no hydrogen 3.523 N/A GLN 509.A N GLN 509.A OE1 no hydrogen 2.900 N/A GLU 510.A N THR 507.A OG1 no hydrogen 3.071 N/A LYS 511.A N THR 507.A O no hydrogen 2.879 N/A LYS 511.A NZ LEU 533.A O no hydrogen 3.134 N/A ASP 512.A N GLU 508.A O no hydrogen 2.892 N/A PHE 513.A N GLN 509.A O no hydrogen 2.930 N/A LEU 514.A N GLU 510.A O no hydrogen 2.993 N/A TRP 515.A N LYS 511.A O no hydrogen 2.996 N/A SER 516.A N ASP 512.A O no hydrogen 2.957 N/A SER 516.A OG ASP 512.A O no hydrogen 3.410 N/A HIS 517.A N PHE 513.A O no hydrogen 3.190 N/A HIS 517.A N LEU 514.A O no hydrogen 3.315 N/A HIS 517.A ND1 PHE 513.A O no hydrogen 2.808 N/A ARG 518.A N TRP 515.A O no hydrogen 3.216 N/A ARG 518.A NE GLN 545.A OE1 no hydrogen 3.376 N/A ARG 518.A NH1 TRP 515.A O no hydrogen 2.807 N/A ARG 518.A NH2 GLN 545.A OE1 no hydrogen 2.753 N/A TYR 520.A N HIS 517.A O no hydrogen 2.778 N/A CYS 521.A N HIS 517.A O no hydrogen 3.076 N/A CYS 521.A SG HIS 517.A O no hydrogen 3.574 N/A THR 523.A N TYR 520.A O no hydrogen 3.005 N/A THR 523.A OG1 TYR 520.A O no hydrogen 2.703 N/A ILE 524.A N CYS 521.A O no hydrogen 2.987 N/A GLU 526.A N GLU 526.A OE1 no hydrogen 2.889 N/A ILE 527.A N ILE 524.A O no hydrogen 3.272 N/A LEU 528.A N PRO 525.A O no hydrogen 3.297 N/A LYS 530.A N ILE 527.A O no hydrogen 3.013 N/A LYS 530.A NZ ARG 500.A O no hydrogen 2.822 N/A LEU 531.A N ILE 527.A O no hydrogen 3.193 N/A LEU 532.A N LEU 528.A O no hydrogen 2.902 N/A LEU 533.A N LYS 530.A O no hydrogen 3.302 N/A SER 534.A N LEU 531.A O no hydrogen 2.763 N/A SER 534.A OG LYS 511.A O no hydrogen 3.324 N/A SER 534.A OG LYS 530.A O no hydrogen 3.337 N/A TRP 537.A NE1 LEU 532.A O no hydrogen 2.853 N/A ASN 538.A ND2 LEU 349.A O no hydrogen 2.912 N/A SER 539.A N LYS 536.A O no hydrogen 3.054 N/A ARG 540.A N ASP 377.A OD1 no hydrogen 3.052 N/A VAL 543.A N SER 539.A O no hydrogen 3.217 N/A ALA 544.A N ARG 540.A O no hydrogen 2.975 N/A GLN 545.A N ASP 541.A O no hydrogen 3.388 N/A GLN 545.A NE2 ASP 541.A O no hydrogen 3.381 N/A MET 546.A N GLU 542.A O no hydrogen 3.024 N/A TYR 547.A N VAL 543.A O no hydrogen 2.973 N/A TYR 547.A OH ASP 571.A OD1 no hydrogen 2.611 N/A TYR 547.A OH ASP 571.A OD2 no hydrogen 3.309 N/A CYS 548.A N ALA 544.A O no hydrogen 3.296 N/A CYS 548.A SG ALA 544.A O no hydrogen 3.571 N/A LEU 549.A N GLN 545.A O no hydrogen 3.326 N/A VAL 550.A N MET 546.A O no hydrogen 2.896 N/A LYS 551.A N TYR 547.A O no hydrogen 3.081 N/A TRP 553.A N VAL 550.A O no hydrogen 3.130 N/A TRP 553.A NE1 PRO 525.A O no hydrogen 3.065 N/A GLU 559.A N GLU 559.A OE1 no hydrogen 3.030 N/A GLN 560.A N LYS 557.A O no hydrogen 2.938 N/A ALA 561.A N LYS 557.A O no hydrogen 2.890 N/A MET 562.A N PRO 558.A O no hydrogen 2.814 N/A LEU 564.A N ALA 561.A O no hydrogen 3.122 N/A LEU 565.A N MET 562.A O no hydrogen 3.033 N/A ASP 566.A N GLU 563.A O no hydrogen 3.224 N/A ASN 568.A N ASP 566.A OD1 no hydrogen 3.215 N/A TYR 569.A N ASP 566.A O no hydrogen 3.226 N/A TYR 569.A OH PRO 529.A O no hydrogen 3.076 N/A TYR 569.A OH GLU 563.A OE2 no hydrogen 3.239 N/A MET 573.A N ASP 571.A OD2 no hydrogen 2.802 N/A ARG 575.A N ASP 571.A O no hydrogen 3.022 N/A ARG 575.A NE GLU 605.A OE2 no hydrogen 2.819 N/A ARG 575.A NH1 LEU 565.A O no hydrogen 2.784 N/A ARG 575.A NH1 ASP 566.A O no hydrogen 3.233 N/A ARG 575.A NH1 TYR 569.A O no hydrogen 3.231 N/A ARG 575.A NH2 LEU 565.A O no hydrogen 2.924 N/A ARG 575.A NH2 GLU 605.A OE2 no hydrogen 2.740 N/A GLY 576.A N PRO 572.A O no hydrogen 2.999 N/A PHE 577.A N MET 573.A O no hydrogen 2.911 N/A ALA 578.A N VAL 574.A O no hydrogen 2.841 N/A VAL 579.A N ARG 575.A O no hydrogen 2.801 N/A ARG 580.A N GLY 576.A O no hydrogen 3.041 N/A CYS 581.A N PHE 577.A O no hydrogen 3.026 N/A CYS 581.A SG ILE 556.A O no hydrogen 3.850 N/A CYS 581.A SG PHE 577.A O no hydrogen 3.461 N/A LEU 582.A N ALA 578.A O no hydrogen 3.315 N/A GLU 583.A N VAL 579.A O no hydrogen 2.829 N/A LYS 584.A N ARG 580.A O no hydrogen 3.082 N/A TYR 585.A N CYS 581.A O no hydrogen 2.844 N/A LEU 586.A N LEU 582.A O no hydrogen 2.918 N/A THR 587.A OG1 SER 172.A OG no hydrogen 2.746 N/A LYS 590.A N THR 587.A OG1 no hydrogen 3.066 N/A LYS 590.A NZ ASP 589.A OD2 no hydrogen 2.847 N/A LEU 591.A N THR 587.A O no hydrogen 3.032 N/A SER 592.A N ASP 588.A O no hydrogen 3.171 N/A SER 592.A OG ASP 588.A O no hydrogen 2.867 N/A GLN 593.A N ASP 589.A O no hydrogen 3.027 N/A TYR 594.A N LYS 590.A O no hydrogen 2.830 N/A TYR 594.A OH GLU 559.A OE2 no hydrogen 3.133 N/A GLN 597.A NE2 GLN 778.A OE1 no hydrogen 2.760 N/A LEU 598.A N TYR 594.A O no hydrogen 2.983 N/A VAL 599.A N LEU 595.A O no hydrogen 2.759 N/A GLN 600.A N ILE 596.A O no hydrogen 3.092 N/A GLN 600.A NE2 GLU 637.A OE1 no hydrogen 2.881 N/A VAL 601.A N GLN 597.A O no hydrogen 2.974 N/A LEU 602.A N VAL 599.A O no hydrogen 3.130 N/A LYS 603.A N GLN 600.A O no hydrogen 3.009 N/A LYS 603.A NZ GLN 600.A OE1 no hydrogen 2.857 N/A LYS 603.A NZ GLU 637.A OE1 no hydrogen 2.775 N/A LYS 603.A NZ GLU 637.A OE2 no hydrogen 3.042 N/A TYR 604.A N VAL 601.A O no hydrogen 3.235 N/A TYR 604.A OH MET 960.A O no hydrogen 3.321 N/A GLN 606.A NE2 ASN 410.A OD1 no hydrogen 2.870 N/A TYR 607.A OH PHE 412.A O no hydrogen 2.682 N/A LEU 608.A N GLU 134.A OE2 no hydrogen 3.208 N/A ASN 610.A ND2 TYR 607.A O no hydrogen 2.898 N/A VAL 613.A N ASN 610.A OD1 no hydrogen 2.758 N/A ARG 614.A N ASN 610.A O no hydrogen 3.313 N/A ARG 614.A NH1 ASN 141.A O no hydrogen 3.470 N/A ARG 614.A NH2 ASN 141.A O no hydrogen 3.117 N/A PHE 615.A N LEU 611.A O no hydrogen 2.870 N/A LEU 616.A N LEU 612.A O no hydrogen 2.815 N/A LEU 617.A N VAL 613.A O no hydrogen 2.830 N/A LYS 618.A N ARG 614.A O no hydrogen 2.885 N/A LYS 618.A NZ GLU 583.A OE2 no hydrogen 3.530 N/A LYS 619.A N PHE 615.A O no hydrogen 3.021 N/A ALA 620.A N LEU 616.A O no hydrogen 2.907 N/A LEU 621.A N LEU 617.A O no hydrogen 3.001 N/A LEU 621.A N LYS 618.A O no hydrogen 3.306 N/A THR 622.A N LYS 619.A O no hydrogen 3.243 N/A THR 622.A OG1 LYS 618.A O no hydrogen 2.845 N/A ASN 623.A N LYS 619.A O no hydrogen 2.964 N/A ASN 623.A ND2 ASP 588.A OD2 no hydrogen 3.165 N/A GLN 624.A N TYR 164.A O no hydrogen 2.956 N/A ARG 625.A N ASN 623.A OD1 no hydrogen 2.862 N/A ARG 625.A NH1 PRO 168.A O no hydrogen 3.228 N/A ARG 625.A NH2 PRO 168.A O no hydrogen 3.569 N/A ILE 626.A N ASN 623.A OD1 no hydrogen 3.094 N/A GLY 627.A N ASN 623.A O no hydrogen 2.996 N/A HIS 628.A N GLN 624.A O no hydrogen 3.079 N/A HIS 628.A ND1 TYR 661.A OH no hydrogen 2.707 N/A HIS 628.A NE2 PRO 717.A O no hydrogen 2.719 N/A PHE 630.A N ILE 626.A O no hydrogen 2.866 N/A PHE 631.A N GLY 627.A O no hydrogen 2.990 N/A TRP 632.A N HIS 628.A O no hydrogen 3.072 N/A TRP 632.A NE1 GLN 668.A OE1 no hydrogen 2.800 N/A HIS 633.A N PHE 629.A O no hydrogen 2.837 N/A LEU 634.A N PHE 630.A O no hydrogen 3.134 N/A LYS 635.A N PHE 631.A O no hydrogen 2.989 N/A SER 636.A N TRP 632.A O no hydrogen 2.912 N/A SER 636.A OG HIS 633.A O no hydrogen 2.678 N/A GLU 637.A N LEU 634.A O no hydrogen 3.332 N/A MET 638.A N LYS 635.A O no hydrogen 3.178 N/A ASN 640.A N GLU 637.A O no hydrogen 3.126 N/A ASN 640.A ND2 GLU 637.A OE2 no hydrogen 3.458 N/A THR 642.A OG1 ASN 640.A OD1 no hydrogen 2.721 N/A VAL 643.A N ASN 640.A O no hydrogen 3.100 N/A SER 644.A N ASN 640.A O no hydrogen 2.832 N/A ARG 646.A NH1 TYR 607.A O no hydrogen 3.302 N/A ARG 646.A NH2 GLU 605.A O no hydrogen 2.871 N/A PHE 647.A N VAL 643.A O no hydrogen 2.816 N/A GLY 648.A N SER 644.A O no hydrogen 2.690 N/A LEU 649.A N GLN 645.A O no hydrogen 3.035 N/A LEU 650.A N ARG 646.A O no hydrogen 3.096 N/A LEU 651.A N PHE 647.A O no hydrogen 2.804 N/A GLU 652.A N GLY 648.A O no hydrogen 2.957 N/A SER 653.A N LEU 649.A O no hydrogen 3.323 N/A SER 653.A OG LEU 649.A O no hydrogen 2.952 N/A SER 653.A OG LEU 650.A O no hydrogen 2.898 N/A TYR 654.A N LEU 650.A O no hydrogen 2.985 N/A CYS 655.A N LEU 651.A O no hydrogen 2.826 N/A CYS 655.A SG LEU 651.A O no hydrogen 3.232 N/A ARG 656.A N GLU 652.A O no hydrogen 2.854 N/A ARG 656.A NH1 ASN 113.A OD1 no hydrogen 3.315 N/A ARG 656.A NH2 ASN 113.A OD1 no hydrogen 3.039 N/A ARG 656.A NH2 GLU 652.A OE2 no hydrogen 3.008 N/A ALA 657.A N TYR 654.A O no hydrogen 3.266 N/A CYS 658.A SG CYS 655.A O no hydrogen 3.862 N/A CYS 658.A SG GLY 659.A O no hydrogen 3.923 N/A MET 660.A N ASP 291.A OD1 no hydrogen 3.011 N/A TYR 661.A OH HIS 628.A ND1 no hydrogen 2.707 N/A LEU 662.A N GLY 659.A O no hydrogen 3.340 N/A LYS 663.A N MET 660.A O no hydrogen 3.073 N/A LYS 663.A NZ GLU 115.A OE1 no hydrogen 3.244 N/A LYS 663.A NZ GLU 115.A OE2 no hydrogen 2.943 N/A LEU 665.A N TYR 661.A O no hydrogen 2.820 N/A ASN 666.A N LEU 662.A O no hydrogen 2.804 N/A ASN 666.A ND2 GLU 115.A O no hydrogen 3.066 N/A ARG 667.A N LYS 663.A O no hydrogen 3.198 N/A ARG 667.A NE GLY 713.A O no hydrogen 3.297 N/A ARG 667.A NH2 ASP 709.A O no hydrogen 2.868 N/A GLN 668.A N HIS 664.A O no hydrogen 3.147 N/A GLN 668.A NE2 TYR 661.A OH no hydrogen 3.071 N/A VAL 669.A N LEU 665.A O no hydrogen 2.792 N/A GLU 670.A N ASN 666.A O no hydrogen 2.844 N/A ALA 671.A N ARG 667.A O no hydrogen 2.978 N/A MET 672.A N GLN 668.A O no hydrogen 2.984 N/A GLU 673.A N VAL 669.A O no hydrogen 3.051 N/A LYS 674.A NZ ASP 90.A OD1 no hydrogen 2.814 N/A LEU 675.A N ALA 671.A O no hydrogen 3.262 N/A ILE 676.A N MET 672.A O no hydrogen 2.830 N/A ASN 677.A N GLU 673.A O no hydrogen 3.049 N/A ASN 677.A ND2 HIS 13.A O no hydrogen 3.263 N/A LEU 678.A N LYS 674.A O no hydrogen 2.886 N/A THR 679.A N LEU 675.A O no hydrogen 2.914 N/A THR 679.A OG1 LEU 675.A O no hydrogen 2.895 N/A THR 679.A OG1 ILE 676.A O no hydrogen 3.085 N/A ASP 680.A N ILE 676.A O no hydrogen 2.978 N/A ASP 680.A N ASN 677.A O no hydrogen 3.229 N/A ILE 681.A N ASN 677.A O no hydrogen 3.213 N/A LEU 682.A N LEU 678.A O no hydrogen 3.432 N/A LYS 683.A N THR 679.A O no hydrogen 3.163 N/A LYS 683.A NZ ASN 766.A O no hydrogen 3.557 N/A GLN 684.A N ILE 681.A O no hydrogen 3.144 N/A LYS 686.A N ILE 681.A O no hydrogen 3.150 N/A LYS 687.A N GLN 684.A O no hydrogen 3.331 N/A LYS 687.A NZ ASP 688.A OD1 no hydrogen 3.497 N/A LYS 687.A NZ ASP 688.A OD2 no hydrogen 2.862 N/A GLN 691.A NE2 ILE 734.A O no hydrogen 2.795 N/A GLN 694.A N THR 690.A O no hydrogen 2.810 N/A GLN 694.A NE2 LYS 686.A O no hydrogen 2.743 N/A MET 695.A N GLN 691.A O no hydrogen 3.304 N/A LYS 696.A N LYS 692.A O no hydrogen 3.331 N/A PHE 697.A N VAL 693.A O no hydrogen 2.930 N/A LEU 698.A N GLN 694.A O no hydrogen 2.922 N/A VAL 699.A N MET 695.A O no hydrogen 2.851 N/A GLU 700.A N LYS 696.A O no hydrogen 3.273 N/A GLN 701.A N PHE 697.A O no hydrogen 2.992 N/A MET 702.A N LEU 698.A O no hydrogen 2.824 N/A ARG 703.A N GLU 700.A O no hydrogen 3.211 N/A ARG 704.A NE GLN 701.A OE1 no hydrogen 2.814 N/A ARG 704.A NH1 ASP 706.A OD2 no hydrogen 3.430 N/A MET 708.A N ARG 704.A O no hydrogen 3.078 N/A ASP 709.A N PRO 705.A O no hydrogen 3.135 N/A LEU 711.A N PHE 707.A O no hydrogen 2.800 N/A GLN 712.A NE2 MET 708.A O no hydrogen 3.455 N/A GLY 713.A N GLY 725.A O no hydrogen 3.138 N/A PHE 714.A N LEU 724.A O no hydrogen 3.003 N/A SER 716.A N HIS 722.A O no hydrogen 2.857 N/A LEU 718.A N SER 716.A OG no hydrogen 3.191 N/A ASN 719.A N SER 716.A O no hydrogen 3.108 N/A ALA 721.A N ASN 719.A OD1 no hydrogen 3.385 N/A HIS 722.A N ASN 719.A O no hydrogen 2.991 N/A GLN 723.A NE2 ASP 249.A OD2 no hydrogen 2.774 N/A LEU 724.A N PHE 714.A O no hydrogen 2.751 N/A GLY 725.A N GLU 747.A O no hydrogen 2.999 N/A LEU 727.A N GLN 712.A OE1 no hydrogen 2.930 N/A ARG 728.A N ASN 745.A O no hydrogen 2.813 N/A ARG 728.A NH2 GLU 747.A OE2 no hydrogen 2.918 N/A GLU 731.A N ARG 728.A O no hydrogen 2.860 N/A CYS 732.A N LEU 729.A O no hydrogen 3.350 N/A CYS 732.A SG ARG 728.A O no hydrogen 3.794 N/A GLU 733.A N LYS 743.A O no hydrogen 2.816 N/A MET 735.A N PRO 741.A O no hydrogen 2.900 N/A ARG 740.A N SER 737.A O no hydrogen 3.003 N/A ARG 740.A NE SER 736.A O no hydrogen 3.565 N/A LEU 742.A N PHE 764.A O no hydrogen 3.047 N/A LYS 743.A N GLU 733.A O no hydrogen 2.754 N/A LYS 743.A NZ GLU 731.A O no hydrogen 3.177 N/A LEU 744.A N ILE 762.A O no hydrogen 2.910 N/A TRP 746.A N ASN 760.A O no hydrogen 2.958 N/A TRP 746.A NE1 LEU 711.A O no hydrogen 2.835 N/A GLU 747.A N ASN 726.A O no hydrogen 3.108 N/A ASN 748.A N GLN 758.A O no hydrogen 2.763 N/A ASN 748.A ND2 GLY 247.A O no hydrogen 2.840 N/A ASN 748.A ND2 PHE 757.A O no hydrogen 2.851 N/A ASP 750.A N ASN 748.A OD1 no hydrogen 3.422 N/A MET 752.A N ASP 750.A OD1 no hydrogen 3.138 N/A SER 753.A OG ASP 750.A O no hydrogen 3.461 N/A LEU 756.A N SER 753.A O no hydrogen 2.972 N/A PHE 757.A N SER 753.A O no hydrogen 2.929 N/A ASN 759.A ND2 TRP 746.A O no hydrogen 3.618 N/A ASN 760.A N TRP 746.A O no hydrogen 2.796 N/A ASN 760.A ND2 HIS 722.A ND1 no hydrogen 3.642 N/A ILE 762.A N LEU 744.A O no hydrogen 2.935 N/A MET 763.A N ILE 811.A O no hydrogen 2.770 N/A PHE 764.A N LEU 742.A O no hydrogen 2.729 N/A LYS 765.A N GLY 809.A O no hydrogen 3.026 N/A ASN 766.A ND2 THR 679.A OG1 no hydrogen 2.816 N/A ASN 766.A ND2 ASP 680.A OD1 no hydrogen 2.899 N/A GLY 767.A N CYS 807.A O no hydrogen 2.848 N/A ARG 771.A NE ASP 769.A OD1 no hydrogen 2.911 N/A ARG 771.A NE ASP 769.A OD2 no hydrogen 3.218 N/A ARG 771.A NH1 SER 964.A O no hydrogen 2.787 N/A ARG 771.A NH2 ASP 769.A OD2 no hydrogen 2.958 N/A ARG 771.A NH2 GLY 965.A O no hydrogen 3.275 N/A GLN 772.A NE2 GLY 891.A O no hydrogen 2.784 N/A MET 774.A N LEU 770.A O no hydrogen 2.772 N/A LEU 775.A N ARG 771.A O no hydrogen 2.919 N/A THR 776.A N GLN 772.A O no hydrogen 3.062 N/A THR 776.A OG1 GLN 772.A O no hydrogen 2.747 N/A LEU 777.A N ASP 773.A O no hydrogen 3.160 N/A GLN 778.A N MET 774.A O no hydrogen 3.047 N/A GLN 778.A NE2 GLN 593.A O no hydrogen 2.732 N/A GLN 778.A NE2 GLN 597.A OE1 no hydrogen 2.747 N/A ILE 779.A N LEU 775.A O no hydrogen 2.947 N/A ILE 780.A N THR 776.A O no hydrogen 2.802 N/A ARG 781.A N LEU 777.A O no hydrogen 2.994 N/A ARG 781.A NH1 TYR 799.A O no hydrogen 3.133 N/A ILE 782.A N GLN 778.A O no hydrogen 3.025 N/A MET 783.A N ILE 779.A O no hydrogen 2.801 N/A MET 783.A N ILE 780.A O no hydrogen 3.006 N/A GLU 784.A N ILE 780.A O no hydrogen 2.934 N/A ASN 785.A N ARG 781.A O no hydrogen 2.913 N/A ILE 786.A N MET 783.A O no hydrogen 3.164 N/A TRP 787.A N MET 783.A O no hydrogen 3.148 N/A TRP 787.A NE1 ALA 943.A O no hydrogen 2.912 N/A GLN 788.A N GLU 784.A O no hydrogen 2.881 N/A GLN 788.A NE2 ASP 793.A OD1 no hydrogen 3.369 N/A ASN 789.A N ASN 785.A O no hydrogen 3.405 N/A ASN 789.A ND2 ASN 785.A OD1 no hydrogen 3.247 N/A GLN 790.A N ILE 786.A O no hydrogen 3.076 N/A GLN 790.A N TRP 787.A O no hydrogen 3.155 N/A GLN 790.A NE2 GLN 949.A OE1 no hydrogen 3.494 N/A GLY 791.A N GLN 788.A O no hydrogen 2.997 N/A MET 796.A N GLU 784.A OE1 no hydrogen 3.287 N/A TYR 799.A OH HIS 887.A O no hydrogen 3.333 N/A GLY 800.A N GLU 812.A OE1 no hydrogen 2.897 N/A CYS 801.A SG LEU 810.A O no hydrogen 4.027 N/A LEU 802.A N LEU 810.A O no hydrogen 2.845 N/A SER 803.A OG GLY 805.A O no hydrogen 3.535 N/A ILE 804.A N VAL 808.A O no hydrogen 2.798 N/A GLY 805.A N VAL 808.A O no hydrogen 3.159 N/A CYS 807.A SG ASP 806.A OD1 no hydrogen 3.819 N/A GLY 809.A N LYS 765.A O no hydrogen 3.160 N/A LEU 810.A N LEU 802.A O no hydrogen 2.862 N/A ILE 811.A N MET 763.A O no hydrogen 2.946 N/A GLU 812.A N GLY 800.A O no hydrogen 2.817 N/A TRP 813.A N ILE 761.A O no hydrogen 3.045 N/A ARG 815.A NH1 ASN 759.A O no hydrogen 2.904 N/A SER 817.A OG VAL 814.A O no hydrogen 2.767 N/A HIS 818.A N VAL 879.A O no hydrogen 2.806 N/A ILE 820.A N ILE 877.A O no hydrogen 3.107 N/A MET 821.A N ASN 874.A O no hydrogen 3.010 N/A GLN 822.A N THR 819.A OG1 no hydrogen 3.141 N/A GLN 822.A NE2 LYS 826.A O no hydrogen 3.238 N/A ILE 823.A N THR 819.A O no hydrogen 3.074 N/A GLN 824.A N ILE 820.A O no hydrogen 2.803 N/A CYS 825.A N GLN 822.A O no hydrogen 3.185 N/A CYS 825.A SG MET 821.A O no hydrogen 3.200 N/A ASN 829.A N THR 832.A OG1 no hydrogen 3.177 N/A THR 832.A OG1 ASN 829.A O no hydrogen 2.742 N/A HIS 834.A NE2 TYR 846.A OH no hydrogen 2.719 N/A GLN 835.A N HIS 831.A O no hydrogen 2.743 N/A TRP 836.A N THR 832.A O no hydrogen 2.985 N/A LEU 837.A N LEU 833.A O no hydrogen 3.135 N/A LYS 838.A N HIS 834.A O no hydrogen 2.867 N/A ASP 839.A N GLN 835.A O no hydrogen 2.809 N/A LYS 840.A N TRP 836.A O no hydrogen 2.837 N/A ASN 841.A N LEU 837.A O no hydrogen 3.240 N/A ASN 841.A ND2 LEU 837.A O no hydrogen 3.367 N/A ASN 841.A ND2 ASP 881.A O no hydrogen 2.751 N/A LYS 842.A NZ LYS 838.A O no hydrogen 3.475 N/A LYS 842.A NZ ASP 839.A OD1 no hydrogen 3.156 N/A TYR 846.A OH HIS 834.A NE2 no hydrogen 2.719 N/A ILE 850.A N TYR 846.A O no hydrogen 3.211 N/A ASP 851.A N ASP 847.A O no hydrogen 2.810 N/A LEU 852.A N ALA 848.A O no hydrogen 3.334 N/A PHE 853.A N ALA 849.A O no hydrogen 2.765 N/A THR 854.A N ILE 850.A O no hydrogen 2.989 N/A THR 854.A OG1 ILE 850.A O no hydrogen 2.742 N/A ARG 855.A N ASP 851.A O no hydrogen 2.981 N/A ARG 855.A NE ASP 851.A OD1 no hydrogen 3.010 N/A ARG 855.A NE ASP 851.A OD2 no hydrogen 3.270 N/A SER 856.A N LEU 852.A O no hydrogen 3.149 N/A SER 856.A OG LEU 852.A O no hydrogen 2.943 N/A SER 856.A OG PHE 853.A O no hydrogen 3.183 N/A CYS 857.A N PHE 853.A O no hydrogen 2.924 N/A CYS 857.A SG PHE 853.A O no hydrogen 3.226 N/A ALA 858.A N THR 854.A O no hydrogen 3.146 N/A GLY 859.A N ARG 855.A O no hydrogen 3.148 N/A TYR 860.A N SER 856.A O no hydrogen 3.028 N/A CYS 861.A N CYS 857.A O no hydrogen 2.783 N/A VAL 862.A N ALA 858.A O no hydrogen 3.154 N/A ALA 863.A N GLY 859.A O no hydrogen 2.858 N/A THR 864.A N TYR 860.A O no hydrogen 2.915 N/A THR 864.A OG1 TYR 860.A O no hydrogen 2.672 N/A THR 864.A OG1 CYS 861.A O no hydrogen 3.447 N/A PHE 865.A N CYS 861.A O no hydrogen 3.428 N/A ILE 866.A N VAL 862.A O no hydrogen 3.012 N/A LEU 867.A N ALA 863.A O no hydrogen 3.120 N/A GLY 868.A N THR 864.A O no hydrogen 2.882 N/A ILE 869.A N THR 864.A O no hydrogen 3.319 N/A GLY 870.A N HIS 892.A O no hydrogen 3.010 N/A ARG 872.A N PRO 909.A O no hydrogen 3.439 N/A ARG 872.A NE GLY 870.A O no hydrogen 3.050 N/A ARG 872.A NH1 ILE 888.A O no hydrogen 2.900 N/A ARG 872.A NH2 GLY 870.A O no hydrogen 3.317 N/A ARG 872.A NH2 ASP 889.A O no hydrogen 2.845 N/A ASN 874.A ND2 GLN 824.A OE1 no hydrogen 3.667 N/A SER 875.A N HIS 873.A ND1 no hydrogen 3.254 N/A SER 875.A OG ASN 874.A OD1 no hydrogen 3.372 N/A ASN 876.A N HIS 873.A O no hydrogen 3.138 N/A ILE 877.A N HIS 873.A O no hydrogen 3.074 N/A MET 878.A N VAL 886.A O no hydrogen 2.798 N/A VAL 879.A N HIS 818.A O no hydrogen 2.795 N/A LYS 880.A N GLN 884.A O no hydrogen 2.822 N/A LYS 880.A NZ ASP 882.A OD2 no hydrogen 3.206 N/A ASP 881.A N ASN 816.A O no hydrogen 3.169 N/A GLY 883.A N LYS 880.A O no hydrogen 3.202 N/A GLN 884.A NE2 ARG 795.A O no hydrogen 2.797 N/A GLN 884.A NE2 LEU 885.A O no hydrogen 3.146 N/A LEU 885.A N SER 856.A OG no hydrogen 3.045 N/A VAL 886.A N MET 878.A O no hydrogen 2.781 N/A HIS 887.A N TYR 860.A OH no hydrogen 3.365 N/A ILE 888.A N ASN 876.A O no hydrogen 2.807 N/A PHE 890.A N ASP 773.A OD2 no hydrogen 2.833 N/A LEU 894.A N LEU 867.A O no hydrogen 2.701 N/A HIS 896.A NE2 GLY 868.A O no hydrogen 2.847 N/A LYS 898.A N ASP 895.A O no hydrogen 3.255 N/A LYS 898.A NZ GLY 902.A O no hydrogen 3.083 N/A LYS 900.A NZ HIS 896.A O no hydrogen 2.803 N/A PHE 901.A N LYS 897.A O no hydrogen 3.347 N/A ARG 907.A N TYR 977.A OH no hydrogen 3.169 N/A ARG 907.A NH2 GLY 868.A O no hydrogen 3.016 N/A ARG 907.A NH2 ILE 869.A O no hydrogen 2.713 N/A LEU 912.A N HIS 1003.A NE2 no hydrogen 2.861 N/A LEU 917.A N THR 913.A O no hydrogen 2.950 N/A ILE 918.A N GLN 914.A O no hydrogen 2.880 N/A ILE 920.A N PHE 916.A O no hydrogen 3.409 N/A SER 921.A N LEU 917.A O no hydrogen 2.916 N/A SER 921.A OG LEU 917.A O no hydrogen 3.366 N/A SER 921.A OG CYS 927.A O no hydrogen 2.908 N/A SER 921.A OG THR 930.A OG1 no hydrogen 2.977 N/A LYS 922.A NZ GLU 932.A OE1 no hydrogen 3.405 N/A LYS 922.A NZ GLU 932.A OE2 no hydrogen 3.425 N/A GLY 923.A N ILE 918.A O no hydrogen 2.957 N/A ALA 924.A N SER 921.A O no hydrogen 3.087 N/A CYS 927.A SG ALA 924.A O no hydrogen 3.578 N/A THR 930.A OG1 SER 921.A OG no hydrogen 2.977 N/A THR 930.A OG1 CYS 927.A O no hydrogen 2.764 N/A PHE 933.A N THR 930.A OG1 no hydrogen 3.326 N/A ARG 935.A N ARG 931.A O no hydrogen 3.189 N/A ARG 935.A NH1 ASP 851.A OD1 no hydrogen 3.399 N/A ARG 935.A NH2 ASP 851.A OD1 no hydrogen 2.850 N/A PHE 936.A N GLU 932.A O no hydrogen 3.312 N/A GLN 937.A N PHE 933.A O no hydrogen 2.837 N/A GLN 937.A NE2 THR 1008.A OG1 no hydrogen 3.404 N/A GLU 938.A N GLU 934.A O no hydrogen 3.090 N/A MET 939.A N ARG 935.A O no hydrogen 3.114 N/A CYS 940.A N PHE 936.A O no hydrogen 3.207 N/A CYS 940.A SG PHE 936.A O no hydrogen 3.557 N/A TYR 941.A N GLN 937.A O no hydrogen 3.035 N/A TYR 941.A OH GLN 937.A OE1 no hydrogen 2.754 N/A LYS 942.A N GLU 938.A O no hydrogen 3.017 N/A ALA 943.A N MET 939.A O no hydrogen 2.901 N/A TYR 944.A N CYS 940.A O no hydrogen 2.957 N/A TYR 944.A OH THR 981.A O no hydrogen 2.622 N/A TYR 944.A OH ALA 991.A O no hydrogen 3.389 N/A LEU 945.A N TYR 941.A O no hydrogen 3.422 N/A ALA 946.A N LYS 942.A O no hydrogen 2.886 N/A ILE 947.A N ALA 943.A O no hydrogen 3.163 N/A ARG 948.A N TYR 944.A O no hydrogen 2.794 N/A ARG 948.A NE LEU 982.A O no hydrogen 2.846 N/A ARG 948.A NE ALA 983.A O no hydrogen 3.486 N/A ARG 948.A NH2 ALA 983.A O no hydrogen 3.034 N/A GLN 949.A N LEU 945.A O no hydrogen 2.810 N/A GLN 949.A NE2 GLU 988.A OE2 no hydrogen 3.143 N/A HIS 950.A N ALA 946.A O no hydrogen 3.205 N/A HIS 950.A N ILE 947.A O no hydrogen 2.847 N/A HIS 950.A ND1 ALA 946.A O no hydrogen 2.868 N/A ALA 951.A N ARG 948.A O no hydrogen 3.317 N/A LEU 953.A N HIS 950.A O no hydrogen 3.016 N/A ILE 955.A N ALA 951.A O no hydrogen 2.945 N/A ASN 956.A N ASN 952.A O no hydrogen 3.009 N/A ASN 956.A ND2 GLU 559.A O no hydrogen 3.201 N/A LEU 957.A N LEU 953.A O no hydrogen 2.884 N/A PHE 958.A N PHE 954.A O no hydrogen 3.050 N/A SER 959.A N ILE 955.A O no hydrogen 2.958 N/A SER 959.A OG ILE 955.A O no hydrogen 2.772 N/A MET 960.A N ASN 956.A O no hydrogen 2.913 N/A MET 961.A N PHE 958.A O no hydrogen 2.984 N/A GLY 963.A N TYR 604.A OH no hydrogen 2.789 N/A SER 964.A N MET 961.A O no hydrogen 3.281 N/A SER 964.A OG MET 961.A O no hydrogen 2.640 N/A LEU 969.A N MET 966.A O no hydrogen 3.060 N/A GLN 970.A N ASP 974.A OD2 no hydrogen 2.712 N/A GLN 970.A NE2 HIS 432.A O no hydrogen 2.768 N/A SER 971.A N ASP 974.A OD2 no hydrogen 3.000 N/A ASP 974.A N SER 971.A O no hydrogen 2.863 N/A ILE 975.A N PHE 972.A O no hydrogen 3.039 N/A ALA 976.A N ASP 973.A O no hydrogen 3.257 N/A ILE 978.A N ILE 975.A O no hydrogen 3.142 N/A ARG 979.A N ALA 976.A O no hydrogen 3.171 N/A ARG 979.A NE ASP 501.A OD1 no hydrogen 3.427 N/A ARG 979.A NE ASP 501.A OD2 no hydrogen 2.724 N/A ARG 979.A NH2 ASP 501.A OD1 no hydrogen 2.797 N/A ARG 979.A NH2 ASP 985.A OD1 no hydrogen 2.823 N/A LYS 980.A N TYR 977.A O no hydrogen 3.026 N/A THR 981.A N TYR 977.A O no hydrogen 3.040 N/A THR 981.A OG1 ILE 866.A O no hydrogen 2.951 N/A THR 981.A OG1 ILE 978.A O no hydrogen 3.529 N/A LEU 982.A N ILE 978.A O no hydrogen 3.069 N/A ALA 983.A N LYS 980.A O no hydrogen 3.113 N/A LEU 984.A N ARG 979.A O no hydrogen 3.140 N/A LYS 986.A N ALA 983.A O no hydrogen 3.413 N/A THR 987.A OG1 GLU 990.A OE1 no hydrogen 2.863 N/A GLU 990.A N THR 987.A OG1 no hydrogen 3.423 N/A ALA 991.A N THR 987.A O no hydrogen 2.796 N/A LEU 992.A N GLU 988.A O no hydrogen 3.257 N/A GLU 993.A N GLN 989.A O no hydrogen 3.050 N/A TYR 994.A N GLU 990.A O no hydrogen 2.914 N/A TYR 994.A OH GLU 906.A OE1 no hydrogen 2.735 N/A PHE 995.A N ALA 991.A O no hydrogen 2.999 N/A MET 996.A N LEU 992.A O no hydrogen 3.115 N/A LYS 997.A N GLU 993.A O no hydrogen 2.878 N/A LYS 997.A NZ ASP 1001.A OD2 no hydrogen 3.390 N/A GLN 998.A N TYR 994.A O no hydrogen 2.858 N/A MET 999.A N PHE 995.A O no hydrogen 2.862 N/A ASN 1000.A N MET 996.A O no hydrogen 2.911 N/A ASN 1000.A ND2 TRP 1007.A O no hydrogen 2.799 N/A ASP 1001.A N LYS 997.A O no hydrogen 2.902 N/A ALA 1002.A N GLN 998.A O no hydrogen 3.278 N/A HIS 1003.A N MET 999.A O no hydrogen 3.061 N/A HIS 1003.A ND1 MET 999.A O no hydrogen 2.783 N/A GLY 1005.A N ASN 1000.A O no hydrogen 3.177 N/A TRP 1007.A N ASN 1000.A OD1 no hydrogen 2.807 N/A