Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5fi4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N GLU 75.A O no hydrogen 2.924 N/A PRO 1.A N GLU 126.A OE2 no hydrogen 2.753 N/A ARG 3.A NH1 GLN 74.A OE1 no hydrogen 3.292 N/A SER 6.A OG GLU 665.A OE1 no hydrogen 2.814 N/A GLY 7.A N SER 5.A OG no hydrogen 3.417 N/A GLU 8.A N HIS 13.A O no hydrogen 2.866 N/A LEU 9.A N ILE 12.A O no hydrogen 3.107 N/A TRP 10.A N PHE 94.A O no hydrogen 2.944 N/A ILE 12.A N LEU 9.A O no hydrogen 3.341 N/A HIS 13.A NE2 GLN 676.A OE1 no hydrogen 2.927 N/A MET 15.A N GLU 8.A OE1 no hydrogen 2.856 N/A ILE 19.A N CYS 35.A O no hydrogen 2.841 N/A VAL 21.A N LEU 33.A O no hydrogen 2.754 N/A GLU 22.A N PRO 96.A O no hydrogen 2.992 N/A CYS 23.A N VAL 31.A O no hydrogen 2.779 N/A CYS 23.A SG VAL 21.A O no hydrogen 3.815 N/A LEU 24.A N LEU 98.A O no hydrogen 2.874 N/A LEU 25.A N MET 29.A O no hydrogen 2.841 N/A ASN 27.A ND2 LEU 57.A O no hydrogen 3.049 N/A GLY 28.A N LEU 25.A O no hydrogen 3.082 N/A MET 29.A N ASN 27.A OD1 no hydrogen 3.330 N/A VAL 31.A N CYS 23.A O no hydrogen 2.903 N/A THR 32.A OG1 GLU 22.A OE2 no hydrogen 2.672 N/A LEU 33.A N VAL 21.A O no hydrogen 2.819 N/A CYS 35.A N ILE 19.A O no hydrogen 2.765 N/A CYS 35.A SG LEU 33.A O no hydrogen 3.671 N/A ARG 37.A N PRO 17.A O no hydrogen 2.966 N/A ARG 37.A NE GLU 8.A OE1 no hydrogen 3.050 N/A ARG 37.A NH1 GLU 38.A OE1 no hydrogen 3.184 N/A ARG 37.A NH1 ASP 698.A OD1 no hydrogen 2.850 N/A ARG 37.A NH2 GLU 8.A OE1 no hydrogen 3.509 N/A ARG 37.A NH2 GLU 8.A OE2 no hydrogen 2.769 N/A ARG 37.A NH2 ASP 698.A OD1 no hydrogen 3.217 N/A ARG 37.A NH2 ASP 698.A OD2 no hydrogen 3.130 N/A ALA 39.A N LEU 36.A O no hydrogen 3.060 N/A THR 40.A OG1 THR 43.A OG1 no hydrogen 3.108 N/A LEU 41.A N ARG 86.A O no hydrogen 3.118 N/A ILE 42.A N GLU 84.A O no hydrogen 3.113 N/A THR 43.A OG1 THR 40.A OG1 no hydrogen 3.108 N/A ILE 44.A N THR 40.A O no hydrogen 3.086 N/A LYS 45.A N LEU 41.A O no hydrogen 2.833 N/A LYS 45.A NZ GLU 64.A O no hydrogen 3.224 N/A LYS 45.A NZ TYR 67.A O no hydrogen 2.723 N/A LYS 45.A NZ GLU 84.A OE1 no hydrogen 2.773 N/A HIS 46.A N ILE 42.A O no hydrogen 2.969 N/A HIS 46.A ND1 GLU 64.A OE2 no hydrogen 2.754 N/A GLU 47.A N THR 43.A O no hydrogen 2.881 N/A LEU 48.A N ILE 44.A O no hydrogen 2.933 N/A PHE 49.A N LYS 45.A O no hydrogen 3.059 N/A LYS 50.A N HIS 46.A O no hydrogen 3.111 N/A LYS 50.A NZ GLU 47.A OE1 no hydrogen 3.537 N/A LYS 50.A NZ GLU 47.A OE2 no hydrogen 3.073 N/A GLU 51.A N GLU 47.A O no hydrogen 3.410 N/A ALA 52.A N LEU 48.A O no hydrogen 2.770 N/A ARG 53.A N LYS 50.A O no hydrogen 3.413 N/A LYS 54.A N GLU 51.A O no hydrogen 2.869 N/A TYR 55.A N ALA 52.A O no hydrogen 3.383 N/A LEU 60.A N LEU 57.A O no hydrogen 2.892 N/A LEU 61.A N HIS 58.A O no hydrogen 3.165 N/A GLN 62.A N TYR 67.A OH no hydrogen 2.814 N/A SER 66.A N ASP 63.A O no hydrogen 2.789 N/A SER 66.A OG ASP 63.A O no hydrogen 3.034 N/A ILE 68.A N ILE 101.A O no hydrogen 2.898 N/A VAL 70.A N LYS 99.A O no hydrogen 2.894 N/A SER 71.A N GLU 79.A O no hydrogen 3.302 N/A SER 71.A OG PHE 97.A O no hydrogen 2.691 N/A THR 73.A N GLU 77.A O no hydrogen 2.799 N/A THR 73.A OG1 GLU 77.A O no hydrogen 3.092 N/A GLN 74.A N ARG 92.A O no hydrogen 2.856 N/A GLN 74.A NE2 GLY 7.A O no hydrogen 3.085 N/A GLN 74.A NE2 LEU 93.A O no hydrogen 2.770 N/A ALA 76.A N THR 73.A O no hydrogen 2.836 N/A GLU 79.A N SER 71.A O no hydrogen 2.931 N/A PHE 81.A N PHE 69.A O no hydrogen 2.768 N/A THR 85.A N ASP 83.A OD1 no hydrogen 3.293 N/A THR 85.A OG1 ASP 83.A OD1 no hydrogen 2.710 N/A ARG 86.A N ASP 83.A O no hydrogen 3.478 N/A ARG 86.A NH1 GLU 79.A OE2 no hydrogen 2.788 N/A ARG 86.A NH2 ASP 90.A O no hydrogen 3.005 N/A ARG 87.A NH1 GLU 38.A O no hydrogen 2.857 N/A ARG 87.A NH2 ASP 701.A OD2 no hydrogen 2.821 N/A LEU 88.A N ALA 39.A O no hydrogen 2.972 N/A CYS 89.A N ARG 37.A O no hydrogen 2.887 N/A CYS 89.A SG ARG 37.A O no hydrogen 3.482 N/A CYS 89.A SG ASP 90.A OD1 no hydrogen 3.658 N/A ASP 90.A N ARG 87.A O no hydrogen 2.996 N/A LEU 91.A N LEU 88.A O no hydrogen 3.382 N/A ARG 92.A NH2 GLU 79.A OE1 no hydrogen 3.107 N/A PHE 94.A N VAL 72.A O no hydrogen 2.978 N/A GLN 95.A NE2 PHE 94.A O no hydrogen 3.383 N/A PHE 97.A N GLN 95.A O no hydrogen 2.836 N/A LEU 98.A N GLU 22.A O no hydrogen 2.795 N/A LYS 99.A N VAL 70.A O no hydrogen 2.747 N/A VAL 100.A N LEU 24.A O no hydrogen 3.048 N/A ILE 101.A N ILE 68.A O no hydrogen 3.015 N/A GLU 109.A N ASN 106.A OD1 no hydrogen 3.191 N/A LYS 110.A N ASN 106.A O no hydrogen 3.115 N/A LYS 110.A NZ GLU 80.A OE1 no hydrogen 2.971 N/A LYS 110.A NZ VAL 104.A O no hydrogen 3.148 N/A ILE 111.A N ARG 107.A O no hydrogen 2.880 N/A LEU 112.A N GLU 108.A O no hydrogen 3.071 N/A ASN 113.A N GLU 109.A O no hydrogen 2.837 N/A ARG 114.A N LYS 110.A O no hydrogen 3.023 N/A ARG 114.A N ILE 111.A O no hydrogen 3.154 N/A GLU 115.A N ILE 111.A O no hydrogen 3.036 N/A ILE 116.A N LEU 112.A O no hydrogen 2.872 N/A GLY 117.A N ASN 113.A O no hydrogen 2.963 N/A PHE 118.A N ARG 114.A O no hydrogen 2.978 N/A ALA 119.A N GLU 115.A O no hydrogen 3.256 N/A ILE 120.A N ILE 116.A O no hydrogen 2.933 N/A GLY 121.A N GLY 117.A O no hydrogen 3.186 N/A MET 122.A N GLY 117.A O no hydrogen 3.049 N/A GLU 126.A N PRO 123.A O no hydrogen 3.160 N/A PHE 127.A N VAL 124.A O no hydrogen 2.976 N/A GLU 134.A N ASP 132.A OD1 no hydrogen 3.104 N/A VAL 135.A N ASP 132.A O no hydrogen 3.176 N/A GLN 136.A N ASP 132.A O no hydrogen 3.398 N/A GLN 136.A NE2 PHE 127.A O no hydrogen 2.744 N/A GLN 136.A NE2 VAL 130.A O no hydrogen 2.810 N/A ASP 137.A N PRO 133.A O no hydrogen 3.112 N/A PHE 138.A N GLU 134.A O no hydrogen 2.995 N/A ARG 139.A N VAL 135.A O no hydrogen 3.086 N/A ARG 139.A NE GLU 644.A OE1 no hydrogen 2.973 N/A ARG 139.A NH1 ASP 128.A OD1 no hydrogen 2.921 N/A ARG 139.A NH2 GLU 644.A OE2 no hydrogen 2.761 N/A ARG 140.A N GLN 136.A O no hydrogen 3.185 N/A ASN 141.A N ASP 137.A O no hydrogen 2.926 N/A ASN 141.A ND2 ASP 137.A O no hydrogen 3.225 N/A ILE 142.A N PHE 138.A O no hydrogen 2.942 N/A LEU 143.A N ARG 140.A O no hydrogen 3.343 N/A ASN 144.A N ASN 141.A O no hydrogen 3.441 N/A ASN 144.A ND2 ASN 141.A O no hydrogen 3.399 N/A VAL 145.A N ILE 142.A O no hydrogen 2.845 N/A CYS 146.A N ILE 142.A O no hydrogen 3.251 N/A CYS 146.A SG ILE 142.A O no hydrogen 3.732 N/A CYS 146.A SG SER 645.A O no hydrogen 3.453 N/A LYS 147.A N LEU 143.A O no hydrogen 2.926 N/A GLU 148.A N ASN 144.A O no hydrogen 2.929 N/A ALA 149.A N VAL 145.A O no hydrogen 2.955 N/A VAL 150.A N CYS 146.A O no hydrogen 3.015 N/A ASP 151.A N LYS 147.A O no hydrogen 2.995 N/A LEU 152.A N GLU 148.A O no hydrogen 3.086 N/A ARG 153.A N ALA 149.A O no hydrogen 3.084 N/A ARG 153.A NE LEU 613.A O no hydrogen 3.365 N/A ARG 153.A NH1 ALA 649.A O no hydrogen 3.493 N/A ARG 153.A NH2 LEU 613.A O no hydrogen 3.035 N/A ARG 153.A NH2 ALA 649.A O no hydrogen 2.783 N/A ASP 154.A N VAL 150.A O no hydrogen 2.836 N/A HIS 159.A NE2 LEU 257.A O no hydrogen 3.030 N/A SER 160.A N ASN 156.A O no hydrogen 2.924 N/A SER 160.A OG ARG 153.A O no hydrogen 2.597 N/A ARG 161.A N PRO 158.A O no hydrogen 3.076 N/A ARG 161.A NH2 PRO 293.A O no hydrogen 3.519 N/A ALA 162.A N PRO 158.A O no hydrogen 2.935 N/A MET 163.A N HIS 159.A O no hydrogen 3.078 N/A TYR 164.A OH CYS 650.A O no hydrogen 2.710 N/A VAL 165.A N ARG 161.A O no hydrogen 3.371 N/A TYR 166.A N ALA 162.A O no hydrogen 2.749 N/A GLU 171.A N GLN 264.A O no hydrogen 2.803 N/A SER 172.A OG THR 579.A OG1 no hydrogen 2.731 N/A SER 172.A OG ASP 581.A OD2 no hydrogen 2.651 N/A GLU 175.A N SER 173.A OG no hydrogen 3.184 N/A HIS 179.A NE2 GLN 780.A OE1 no hydrogen 3.176 N/A ILE 180.A N PRO 177.A O no hydrogen 2.929 N/A TYR 181.A N PRO 177.A O no hydrogen 2.952 N/A ASN 182.A N LYS 178.A O no hydrogen 3.125 N/A LYS 183.A N ILE 180.A O no hydrogen 3.069 N/A LYS 183.A NZ MET 273.A O no hydrogen 3.213 N/A LYS 183.A NZ ASP 785.A OD2 no hydrogen 2.799 N/A LEU 184.A N TYR 181.A O no hydrogen 3.183 N/A ASP 185.A N GLN 188.A O no hydrogen 3.191 N/A GLN 188.A N ASP 185.A O no hydrogen 2.949 N/A ILE 189.A N ILE 210.A O no hydrogen 2.798 N/A VAL 191.A N LEU 208.A O no hydrogen 2.756 N/A VAL 192.A N PRO 278.A O no hydrogen 2.901 N/A ILE 193.A N TYR 206.A O no hydrogen 2.844 N/A TRP 194.A N LEU 280.A O no hydrogen 2.796 N/A TRP 194.A NE1 ASN 279.A OD1 no hydrogen 3.079 N/A VAL 195.A N GLN 204.A O no hydrogen 3.077 N/A VAL 197.A N ASP 202.A O no hydrogen 2.789 N/A ASN 200.A ND2 ASP 202.A OD2 no hydrogen 3.412 N/A ASP 202.A N VAL 197.A O no hydrogen 3.049 N/A LYS 203.A NZ ILE 743.A O no hydrogen 3.304 N/A LYS 203.A NZ GLU 746.A OE1 no hydrogen 3.338 N/A LYS 203.A NZ GLU 746.A OE2 no hydrogen 2.876 N/A GLN 204.A N VAL 195.A O no hydrogen 3.043 N/A LEU 208.A N VAL 191.A O no hydrogen 2.751 N/A LYS 209.A NZ ASP 185.A OD1 no hydrogen 2.800 N/A ILE 210.A N ILE 189.A O no hydrogen 2.984 N/A HIS 212.A N GLY 187.A O no hydrogen 3.188 N/A HIS 212.A ND1 SER 263.A OG no hydrogen 2.942 N/A CYS 214.A N ASN 211.A O no hydrogen 3.163 N/A VAL 215.A N GLN 218.A OE1 no hydrogen 3.288 N/A VAL 219.A N VAL 215.A O no hydrogen 3.186 N/A ILE 220.A N PRO 216.A O no hydrogen 3.107 N/A ALA 221.A N GLU 217.A O no hydrogen 2.993 N/A GLU 222.A N GLN 218.A O no hydrogen 3.167 N/A ALA 223.A N VAL 219.A O no hydrogen 3.153 N/A ILE 224.A N ILE 220.A O no hydrogen 2.748 N/A ARG 225.A N ALA 221.A O no hydrogen 2.800 N/A LYS 226.A N GLU 222.A O no hydrogen 2.902 N/A LYS 227.A N ALA 223.A O no hydrogen 2.894 N/A THR 228.A OG1 ILE 224.A O no hydrogen 3.108 N/A SER 230.A N ARG 225.A O no hydrogen 3.509 N/A LYS 235.A N SER 231.A O no hydrogen 2.664 N/A LEU 236.A N GLU 232.A O no hydrogen 3.295 N/A VAL 238.A N LEU 234.A O no hydrogen 2.711 N/A LEU 239.A N LYS 235.A O no hydrogen 2.785 N/A GLU 240.A N LEU 236.A O no hydrogen 3.155 N/A TYR 241.A N CYS 237.A O no hydrogen 3.107 N/A GLN 242.A N VAL 238.A O no hydrogen 2.791 N/A ILE 246.A N MET 283.A O no hydrogen 2.776 N/A LYS 248.A N MET 281.A O no hydrogen 3.038 N/A LYS 248.A NZ VAL 249.A O no hydrogen 2.812 N/A LYS 248.A NZ CYS 252.A O no hydrogen 2.834 N/A LYS 248.A NZ ASP 742.A OD2 no hydrogen 2.805 N/A VAL 249.A N GLU 254.A O no hydrogen 2.796 N/A CYS 250.A N ASN 279.A O no hydrogen 3.117 N/A CYS 250.A SG ASN 279.A O no hydrogen 3.380 N/A GLY 251.A N ASP 742.A OD1 no hydrogen 3.045 N/A ASP 253.A N ALA 713.A O no hydrogen 2.915 N/A PHE 256.A N LEU 247.A O no hydrogen 2.903 N/A LYS 259.A N GLU 258.A OE2 no hydrogen 3.053 N/A TYR 260.A N GLU 258.A O no hydrogen 3.049 N/A LEU 262.A N CYS 214.A O no hydrogen 2.779 N/A SER 263.A N HIS 212.A O no hydrogen 2.985 N/A SER 263.A OG HIS 212.A ND1 no hydrogen 2.942 N/A SER 263.A OG HIS 212.A O no hydrogen 3.308 N/A GLN 264.A N PRO 261.A O no hydrogen 2.815 N/A GLN 264.A NE2 GLU 171.A O no hydrogen 2.890 N/A TYR 265.A N LEU 262.A O no hydrogen 3.217 N/A TYR 265.A OH GLU 258.A O no hydrogen 2.696 N/A LYS 266.A N ASN 169.A O no hydrogen 2.876 N/A LYS 266.A NZ ASP 581.A OD1 no hydrogen 2.744 N/A ARG 269.A N TYR 265.A O no hydrogen 2.904 N/A ARG 269.A NE SER 263.A O no hydrogen 2.776 N/A ARG 269.A NH2 SER 173.A O no hydrogen 2.767 N/A SER 270.A N LYS 266.A O no hydrogen 2.766 N/A CYS 271.A N TYR 267.A O no hydrogen 2.998 N/A CYS 271.A SG TYR 267.A O no hydrogen 3.317 N/A ILE 272.A N ILE 268.A O no hydrogen 3.124 N/A MET 273.A N ARG 269.A O no hydrogen 3.393 N/A LEU 274.A N SER 270.A O no hydrogen 3.075 N/A GLY 275.A N ILE 272.A O no hydrogen 3.221 N/A ARG 276.A N CYS 271.A O no hydrogen 2.827 N/A ASN 279.A N TYR 267.A OH no hydrogen 2.837 N/A LEU 280.A N VAL 192.A O no hydrogen 2.823 N/A MET 281.A N LYS 248.A O no hydrogen 2.749 N/A LEU 282.A N TRP 194.A O no hydrogen 2.781 N/A MET 283.A N ILE 246.A O no hydrogen 3.155 N/A LYS 285.A N LYS 244.A O no hydrogen 3.237 N/A LYS 285.A NZ TYR 289.A OH no hydrogen 3.355 N/A SER 287.A N ALA 284.A O no hydrogen 3.201 N/A TYR 289.A N LYS 285.A O no hydrogen 2.829 N/A SER 290.A N GLU 286.A O no hydrogen 3.199 N/A SER 290.A OG GLU 286.A O no hydrogen 2.676 N/A SER 290.A OG SER 287.A O no hydrogen 3.290 N/A GLN 291.A N LEU 288.A O no hydrogen 2.810 N/A LEU 292.A N TYR 289.A O no hydrogen 3.446 N/A SER 301.A N GLU 109.A OE2 no hydrogen 2.980 N/A SER 303.A N PRO 300.A O no hydrogen 3.073 N/A SER 303.A OG PRO 300.A O no hydrogen 2.711 N/A ARG 304.A N SER 301.A O no hydrogen 2.983 N/A ARG 305.A NH2 ASP 128.A OD1 no hydrogen 3.418 N/A LYS 309.A N VAL 467.A O no hydrogen 2.954 N/A LEU 311.A N LYS 469.A O no hydrogen 3.155 N/A TRP 312.A N SER 310.A OG no hydrogen 3.420 N/A VAL 313.A N SER 310.A O no hydrogen 3.350 N/A ILE 314.A N LEU 311.A O no hydrogen 3.198 N/A SER 316.A OG ALA 317.A O no hydrogen 3.537 N/A LEU 318.A N ILE 375.A O no hydrogen 2.940 N/A ARG 319.A NE ASP 462.A OD1 no hydrogen 3.424 N/A ARG 319.A NE ASP 462.A OD2 no hydrogen 3.090 N/A ARG 319.A NH2 ASP 462.A OD1 no hydrogen 3.168 N/A ILE 320.A N LEU 371.A O no hydrogen 3.002 N/A LYS 321.A N GLU 460.A O no hydrogen 2.975 N/A ILE 322.A N GLU 369.A O no hydrogen 3.009 N/A LEU 323.A N GLU 458.A O no hydrogen 2.798 N/A ALA 325.A N PRO 365.A O no hydrogen 3.060 N/A THR 326.A N CYS 456.A O no hydrogen 3.173 N/A TYR 327.A OH GLU 453.A O no hydrogen 2.912 N/A ARG 333.A NH1 ASP 334.A OD1 no hydrogen 2.861 N/A ASP 334.A N ASN 331.A O no hydrogen 3.058 N/A ASP 336.A N VAL 393.A O no hydrogen 2.984 N/A LYS 337.A N VAL 393.A O no hydrogen 3.255 N/A LYS 337.A NZ ARG 359.A O no hydrogen 2.908 N/A ILE 338.A N VAL 360.A O no hydrogen 2.782 N/A TYR 339.A N CYS 391.A O no hydrogen 3.019 N/A TYR 339.A OH HIS 403.A ND1 no hydrogen 2.676 N/A VAL 340.A N THR 357.A OG1 no hydrogen 2.840 N/A ARG 341.A N SER 389.A O no hydrogen 2.763 N/A ARG 341.A NH1 ASN 356.A OD1 no hydrogen 2.808 N/A THR 342.A N VAL 355.A O no hydrogen 3.075 N/A THR 342.A OG1 VAL 355.A O no hydrogen 2.849 N/A THR 342.A OG1 TYR 373.A OH no hydrogen 2.726 N/A GLY 343.A N CYS 387.A O no hydrogen 2.831 N/A TYR 345.A N ARG 385.A O no hydrogen 2.806 N/A HIS 346.A N GLU 349.A O no hydrogen 2.897 N/A GLU 349.A N HIS 346.A O no hydrogen 3.192 N/A LEU 351.A N ILE 344.A O no hydrogen 2.692 N/A CYS 352.A SG ASP 353.A O no hydrogen 3.827 N/A ASN 354.A ND2 TYR 345.A OH no hydrogen 3.311 N/A VAL 355.A N THR 342.A O no hydrogen 3.070 N/A THR 357.A N VAL 340.A O no hydrogen 2.924 N/A THR 357.A OG1 GLN 358.A O no hydrogen 3.254 N/A GLN 358.A N GLU 369.A OE1 no hydrogen 2.965 N/A ARG 359.A NH1 GLU 401.A OE1 no hydrogen 3.020 N/A ARG 359.A NH1 GLU 401.A OE2 no hydrogen 3.565 N/A ARG 359.A NH2 GLU 401.A OE2 no hydrogen 2.952 N/A VAL 360.A N ILE 338.A O no hydrogen 2.835 N/A CYS 362.A SG ILE 335.A O no hydrogen 3.630 N/A ASN 364.A N PRO 361.A O no hydrogen 3.032 N/A ARG 366.A N ASN 364.A O no hydrogen 2.960 N/A TRP 367.A N LEU 323.A O no hydrogen 2.833 N/A ASN 368.A N LEU 323.A O no hydrogen 3.038 N/A GLU 369.A N ILE 322.A O no hydrogen 3.122 N/A LEU 371.A N ILE 320.A O no hydrogen 2.761 N/A TYR 373.A N LEU 318.A O no hydrogen 2.851 N/A TYR 373.A OH THR 342.A OG1 no hydrogen 2.726 N/A TYR 376.A OH ASN 315.A OD1 no hydrogen 2.836 N/A ILE 377.A N SER 316.A O no hydrogen 3.037 N/A ASP 379.A N TYR 376.A O no hydrogen 2.854 N/A LEU 380.A N ILE 377.A O no hydrogen 2.998 N/A ARG 382.A NH1 ARG 382.A O no hydrogen 2.859 N/A ARG 382.A NH1 TYR 599.A OH no hydrogen 2.723 N/A ARG 382.A NH2 ASP 415.A O no hydrogen 3.239 N/A ARG 382.A NH2 ASP 418.A OD1 no hydrogen 2.876 N/A ARG 382.A NH2 TYR 599.A OH no hydrogen 3.198 N/A ALA 384.A N PRO 381.A O no hydrogen 3.058 N/A ARG 385.A N TYR 345.A O no hydrogen 2.874 N/A ARG 385.A NH1 PRO 442.A O no hydrogen 3.258 N/A ARG 385.A NH2 PRO 442.A O no hydrogen 2.745 N/A LEU 386.A N ILE 411.A O no hydrogen 2.816 N/A CYS 387.A N GLY 343.A O no hydrogen 2.837 N/A LEU 388.A N GLY 409.A O no hydrogen 2.812 N/A SER 389.A N ARG 341.A O no hydrogen 2.844 N/A SER 389.A OG LEU 439.A O no hydrogen 2.768 N/A ILE 390.A N ALA 407.A O no hydrogen 3.070 N/A CYS 391.A N TYR 339.A O no hydrogen 2.762 N/A CYS 391.A SG SER 389.A OG no hydrogen 3.119 N/A CYS 391.A SG LEU 439.A O no hydrogen 4.025 N/A SER 392.A N CYS 404.A O no hydrogen 2.796 N/A SER 392.A OG CYS 404.A O no hydrogen 3.381 N/A VAL 393.A N LYS 337.A O no hydrogen 2.871 N/A LYS 394.A N GLU 402.A O no hydrogen 3.141 N/A GLY 395.A N ASP 336.A OD2 no hydrogen 3.097 N/A ARG 396.A NE ASP 336.A OD1 no hydrogen 2.689 N/A ARG 396.A NH1 ARG 333.A O no hydrogen 3.055 N/A ARG 396.A NH2 ARG 333.A O no hydrogen 2.833 N/A ARG 396.A NH2 ASP 336.A OD1 no hydrogen 2.801 N/A LYS 397.A N GLY 395.A O no hydrogen 2.840 N/A LYS 400.A N LYS 397.A O no hydrogen 3.203 N/A GLU 402.A N LYS 394.A O no hydrogen 2.819 N/A HIS 403.A ND1 TYR 339.A OH no hydrogen 2.676 N/A CYS 404.A N SER 392.A O no hydrogen 3.104 N/A LEU 406.A N ILE 390.A O no hydrogen 2.758 N/A TRP 408.A N TRP 430.A O no hydrogen 3.148 N/A TRP 408.A NE1 PRO 431.A O no hydrogen 2.887 N/A GLY 409.A N LEU 388.A O no hydrogen 3.070 N/A ASN 410.A ND2 ASN 441.A O no hydrogen 2.813 N/A ASN 410.A ND2 GLY 444.A O no hydrogen 2.980 N/A ILE 411.A N LEU 386.A O no hydrogen 2.890 N/A ASN 412.A ND2 GLN 598.A O no hydrogen 2.872 N/A LEU 413.A N ALA 384.A O no hydrogen 2.907 N/A ASP 415.A N THR 419.A O no hydrogen 2.843 N/A TYR 416.A OH ASP 137.A OD2 no hydrogen 3.364 N/A THR 417.A N ASP 415.A OD1 no hydrogen 3.084 N/A THR 417.A OG1 ASP 415.A OD1 no hydrogen 2.816 N/A THR 417.A OG1 ASP 415.A OD2 no hydrogen 3.387 N/A THR 417.A OG1 THR 419.A OG1 no hydrogen 3.101 N/A ASP 418.A N ASP 415.A O no hydrogen 3.090 N/A THR 419.A N ASP 415.A OD1 no hydrogen 2.912 N/A THR 419.A OG1 THR 417.A OG1 no hydrogen 3.101 N/A LEU 420.A N VAL 468.A O no hydrogen 2.870 N/A VAL 421.A N LEU 413.A O no hydrogen 2.780 N/A GLY 423.A N PHE 461.A O no hydrogen 3.118 N/A MET 425.A N LEU 459.A O no hydrogen 2.966 N/A LEU 427.A N LEU 457.A O no hydrogen 2.792 N/A ASN 428.A N SER 448.A OG no hydrogen 2.776 N/A ASN 428.A ND2 LYS 452.A O no hydrogen 3.500 N/A ASN 428.A ND2 THR 454.A O no hydrogen 3.273 N/A ASN 428.A ND2 THR 454.A OG1 no hydrogen 3.003 N/A LEU 429.A N PRO 455.A O no hydrogen 2.903 N/A TRP 430.A N TRP 408.A O no hydrogen 2.847 N/A TRP 430.A NE1 GLY 447.A O no hydrogen 3.194 N/A LEU 436.A N PRO 433.A O no hydrogen 3.026 N/A GLY 444.A N ASN 441.A O no hydrogen 3.013 N/A GLY 447.A N ASN 410.A O no hydrogen 3.018 N/A ASN 449.A N ASN 428.A O no hydrogen 2.959 N/A ASN 449.A ND2 LEU 429.A O no hydrogen 3.190 N/A ASN 451.A N ASN 449.A OD1 no hydrogen 2.988 N/A LYS 452.A NZ ASN 449.A O no hydrogen 2.772 N/A GLU 453.A N ASN 451.A OD1 no hydrogen 2.853 N/A THR 454.A OG1 ASN 451.A O no hydrogen 2.693 N/A CYS 456.A N THR 326.A OG1 no hydrogen 3.106 N/A CYS 456.A SG ASN 428.A OD1 no hydrogen 3.875 N/A LEU 457.A N LEU 427.A O no hydrogen 2.821 N/A GLU 458.A N CYS 324.A O no hydrogen 2.717 N/A LEU 459.A N MET 425.A O no hydrogen 2.792 N/A GLU 460.A N LYS 321.A O no hydrogen 3.003 N/A PHE 461.A N GLY 423.A O no hydrogen 2.827 N/A LYS 469.A N LYS 309.A O no hydrogen 2.886 N/A LYS 469.A NZ THR 417.A O no hydrogen 2.921 N/A LYS 469.A NZ THR 417.A OG1 no hydrogen 3.297 N/A LYS 469.A NZ THR 419.A OG1 no hydrogen 3.027 N/A PHE 470.A N ASP 418.A O no hydrogen 2.906 N/A MET 473.A N ASP 472.A OD1 no hydrogen 3.084 N/A ILE 476.A N ASP 472.A O no hydrogen 2.902 N/A GLU 477.A N MET 473.A O no hydrogen 3.225 N/A GLU 478.A N ILE 476.A O no hydrogen 2.830 N/A LYS 483.A N ARG 479.A O no hydrogen 2.743 N/A GLU 484.A N GLU 480.A O no hydrogen 3.050 N/A GLN 485.A N ASN 481.A O no hydrogen 3.377 N/A LEU 486.A N ASP 482.A O no hydrogen 3.091 N/A LYS 487.A N LYS 483.A O no hydrogen 3.224 N/A ALA 488.A N GLU 484.A O no hydrogen 3.239 N/A ILE 489.A N GLN 485.A O no hydrogen 3.086 N/A SER 490.A N LEU 486.A O no hydrogen 2.992 N/A SER 490.A OG LEU 486.A O no hydrogen 3.448 N/A SER 490.A OG LYS 487.A O no hydrogen 2.648 N/A THR 491.A N LYS 487.A O no hydrogen 3.259 N/A THR 491.A OG1 LYS 487.A O no hydrogen 3.513 N/A THR 491.A OG1 ALA 488.A O no hydrogen 3.121 N/A ARG 492.A N ILE 489.A O no hydrogen 3.287 N/A ARG 492.A NH1 GLU 502.A OE1 no hydrogen 3.158 N/A ARG 492.A NH2 GLU 502.A OE2 no hydrogen 2.724 N/A LEU 495.A N ASP 493.A OD2 no hydrogen 3.008 N/A SER 496.A N ASP 493.A O no hydrogen 3.146 N/A SER 496.A OG ASP 493.A O no hydrogen 3.469 N/A THR 499.A N GLU 502.A OE1 no hydrogen 3.319 N/A THR 499.A OG1 GLN 501.A OE1 no hydrogen 3.535 N/A GLN 501.A N GLN 501.A OE1 no hydrogen 3.115 N/A GLU 502.A N THR 499.A OG1 no hydrogen 3.080 N/A LYS 503.A N THR 499.A O no hydrogen 2.812 N/A LYS 503.A NZ GLU 500.A OE2 no hydrogen 3.430 N/A ASP 504.A N GLU 500.A O no hydrogen 3.023 N/A PHE 505.A N GLN 501.A O no hydrogen 2.884 N/A LEU 506.A N GLU 502.A O no hydrogen 2.891 N/A TRP 507.A N LYS 503.A O no hydrogen 2.796 N/A SER 508.A N ASP 504.A O no hydrogen 2.898 N/A SER 508.A OG ASP 504.A O no hydrogen 2.703 N/A HIS 509.A N PHE 505.A O no hydrogen 3.013 N/A HIS 509.A ND1 PHE 505.A O no hydrogen 2.721 N/A HIS 509.A NE2 ASP 482.A OD2 no hydrogen 3.051 N/A ARG 510.A N TRP 507.A O no hydrogen 3.233 N/A ARG 510.A NE GLN 537.A OE1 no hydrogen 3.328 N/A ARG 510.A NH1 TRP 507.A O no hydrogen 2.763 N/A ARG 510.A NH2 GLN 537.A OE1 no hydrogen 2.764 N/A CYS 513.A N HIS 509.A O no hydrogen 2.959 N/A CYS 513.A N ARG 510.A O no hydrogen 3.310 N/A CYS 513.A SG LEU 506.A O no hydrogen 3.962 N/A CYS 513.A SG HIS 509.A O no hydrogen 3.392 N/A THR 515.A N TYR 512.A O no hydrogen 3.069 N/A THR 515.A OG1 TYR 512.A O no hydrogen 2.691 N/A ILE 516.A N CYS 513.A O no hydrogen 2.820 N/A GLU 518.A N GLU 518.A OE1 no hydrogen 2.872 N/A ILE 519.A N ILE 516.A O no hydrogen 3.340 N/A LEU 520.A N PRO 517.A O no hydrogen 3.059 N/A LYS 522.A NZ ASP 493.A O no hydrogen 2.882 N/A LYS 522.A NZ SER 496.A OG no hydrogen 3.159 N/A LEU 523.A N ILE 519.A O no hydrogen 2.958 N/A LEU 524.A N LEU 520.A O no hydrogen 2.837 N/A LEU 525.A N PRO 521.A O no hydrogen 3.237 N/A SER 526.A N LEU 523.A O no hydrogen 3.110 N/A SER 526.A OG LYS 522.A O no hydrogen 2.736 N/A LYS 528.A N GLU 534.A OE1 no hydrogen 3.026 N/A TRP 529.A NE1 LEU 524.A O no hydrogen 2.820 N/A ASN 530.A ND2 LEU 351.A O no hydrogen 3.085 N/A SER 531.A N LYS 528.A O no hydrogen 3.262 N/A ARG 532.A N ASP 379.A OD1 no hydrogen 2.798 N/A GLU 534.A N SER 531.A OG no hydrogen 3.275 N/A VAL 535.A N SER 531.A O no hydrogen 3.022 N/A ALA 536.A N ARG 532.A O no hydrogen 2.889 N/A GLN 537.A N ASP 533.A O no hydrogen 3.293 N/A MET 538.A N GLU 534.A O no hydrogen 2.987 N/A TYR 539.A N VAL 535.A O no hydrogen 2.792 N/A TYR 539.A OH ASP 563.A OD1 no hydrogen 2.628 N/A CYS 540.A N ALA 536.A O no hydrogen 3.330 N/A CYS 540.A SG ALA 536.A O no hydrogen 3.242 N/A LEU 541.A N GLN 537.A O no hydrogen 3.287 N/A VAL 542.A N MET 538.A O no hydrogen 2.863 N/A LYS 543.A N TYR 539.A O no hydrogen 3.103 N/A LYS 543.A NZ GLU 477.A OE1 no hydrogen 2.854 N/A TRP 545.A N VAL 542.A O no hydrogen 3.114 N/A TRP 545.A NE1 PRO 517.A O no hydrogen 3.013 N/A LYS 549.A N GLN 552.A OE1.A no hydrogen 3.260 N/A GLU 551.A N GLU 551.A OE1 no hydrogen 2.968 N/A GLN 552.A N LYS 549.A O no hydrogen 2.901 N/A GLN 552.A NE2.B GLU 518.A O no hydrogen 2.796 N/A ALA 553.A N LYS 549.A O no hydrogen 3.072 N/A MET 554.A N PRO 550.A O no hydrogen 3.193 N/A GLU 555.A N GLN 552.A O no hydrogen 3.301 N/A LEU 556.A N ALA 553.A O no hydrogen 2.962 N/A LEU 557.A N MET 554.A O no hydrogen 3.139 N/A ASP 558.A N GLU 555.A O no hydrogen 3.276 N/A ASN 560.A N ASP 558.A OD1 no hydrogen 2.826 N/A TYR 561.A N ASP 558.A O no hydrogen 3.245 N/A TYR 561.A OH PRO 521.A O no hydrogen 3.202 N/A TYR 561.A OH GLU 555.A OE2 no hydrogen 3.329 N/A MET 565.A N ASP 563.A OD2 no hydrogen 3.019 N/A VAL 566.A N ASP 563.A OD2 no hydrogen 3.277 N/A ARG 567.A N ASP 563.A O no hydrogen 2.887 N/A ARG 567.A NE GLU 597.A OE2 no hydrogen 2.843 N/A ARG 567.A NH1 LEU 557.A O no hydrogen 2.831 N/A ARG 567.A NH1 ASP 558.A O no hydrogen 3.248 N/A ARG 567.A NH1 TYR 561.A O no hydrogen 3.101 N/A ARG 567.A NH2 LEU 557.A O no hydrogen 2.958 N/A ARG 567.A NH2 GLU 597.A OE2 no hydrogen 2.899 N/A GLY 568.A N PRO 564.A O no hydrogen 2.797 N/A PHE 569.A N MET 565.A O no hydrogen 2.843 N/A ALA 570.A N VAL 566.A O no hydrogen 2.970 N/A VAL 571.A N ARG 567.A O no hydrogen 2.989 N/A ARG 572.A N GLY 568.A O no hydrogen 3.189 N/A CYS 573.A N PHE 569.A O no hydrogen 3.179 N/A CYS 573.A SG ILE 548.A O no hydrogen 3.962 N/A CYS 573.A SG PHE 569.A O no hydrogen 3.698 N/A LEU 574.A N ALA 570.A O no hydrogen 3.226 N/A GLU 575.A N VAL 571.A O no hydrogen 2.787 N/A LYS 576.A N ARG 572.A O no hydrogen 3.129 N/A TYR 577.A N CYS 573.A O no hydrogen 3.066 N/A LEU 578.A N LEU 574.A O no hydrogen 2.961 N/A THR 579.A OG1 SER 172.A OG no hydrogen 2.731 N/A LYS 582.A N THR 579.A OG1 no hydrogen 3.160 N/A LEU 583.A N THR 579.A O no hydrogen 3.022 N/A SER 584.A N ASP 580.A O no hydrogen 2.950 N/A SER 584.A OG ASP 580.A O no hydrogen 3.527 N/A GLN 585.A N ASP 581.A O no hydrogen 3.073 N/A TYR 586.A N LYS 582.A O no hydrogen 2.816 N/A GLN 589.A NE2 GLN 770.A OE1 no hydrogen 2.784 N/A LEU 590.A N TYR 586.A O no hydrogen 3.005 N/A VAL 591.A N LEU 587.A O no hydrogen 2.892 N/A GLN 592.A N ILE 588.A O no hydrogen 3.191 N/A GLN 592.A NE2 GLU 629.A OE1 no hydrogen 2.760 N/A VAL 593.A N GLN 589.A O no hydrogen 3.010 N/A LEU 594.A N VAL 591.A O no hydrogen 3.195 N/A LYS 595.A N GLN 592.A O no hydrogen 3.139 N/A LYS 595.A NZ GLU 629.A OE1 no hydrogen 3.202 N/A LYS 595.A NZ GLU 629.A OE2 no hydrogen 2.907 N/A LYS 595.A NZ GLY 954.A O no hydrogen 3.547 N/A LYS 595.A NZ SER 955.A O no hydrogen 3.438 N/A TYR 596.A N VAL 593.A O no hydrogen 3.082 N/A TYR 596.A OH SER 950.A O no hydrogen 3.364 N/A GLN 598.A NE2 ASN 412.A OD1 no hydrogen 2.770 N/A TYR 599.A OH PHE 414.A O no hydrogen 2.604 N/A LEU 600.A N GLU 134.A OE2 no hydrogen 3.152 N/A ASN 602.A ND2 TYR 599.A O no hydrogen 2.857 N/A VAL 605.A N ASN 602.A OD1 no hydrogen 2.761 N/A ARG 606.A N ASN 602.A O no hydrogen 3.167 N/A ARG 606.A NH1 ASP 601.A OD1 no hydrogen 2.767 N/A PHE 607.A N LEU 603.A O no hydrogen 2.841 N/A LEU 608.A N LEU 604.A O no hydrogen 2.831 N/A LEU 609.A N VAL 605.A O no hydrogen 2.940 N/A LYS 610.A N ARG 606.A O no hydrogen 3.098 N/A LYS 611.A N PHE 607.A O no hydrogen 3.106 N/A LYS 611.A NZ ASP 580.A OD1 no hydrogen 3.012 N/A ALA 612.A N LEU 608.A O no hydrogen 2.865 N/A LEU 613.A N LEU 609.A O no hydrogen 2.932 N/A THR 614.A N LYS 611.A O no hydrogen 3.169 N/A THR 614.A OG1 LYS 610.A O no hydrogen 2.871 N/A THR 614.A OG1 LYS 611.A O no hydrogen 3.507 N/A ASN 615.A ND2 ASP 580.A OD2 no hydrogen 3.221 N/A GLN 616.A N TYR 164.A O no hydrogen 2.786 N/A ARG 617.A N ASN 615.A OD1 no hydrogen 2.908 N/A ARG 617.A NE SER 584.A OG no hydrogen 3.079 N/A ARG 617.A NH2 SER 584.A OG no hydrogen 3.271 N/A ILE 618.A N ASN 615.A OD1 no hydrogen 3.289 N/A GLY 619.A N ASN 615.A O no hydrogen 2.992 N/A HIS 620.A N GLN 616.A O no hydrogen 2.973 N/A HIS 620.A ND1 TYR 653.A OH no hydrogen 2.668 N/A HIS 620.A NE2 PRO 709.A O no hydrogen 2.812 N/A PHE 622.A N ILE 618.A O no hydrogen 2.766 N/A PHE 623.A N GLY 619.A O no hydrogen 2.843 N/A TRP 624.A N HIS 620.A O no hydrogen 3.095 N/A TRP 624.A NE1 GLN 660.A OE1 no hydrogen 2.865 N/A HIS 625.A N PHE 621.A O no hydrogen 2.841 N/A LEU 626.A N PHE 622.A O no hydrogen 3.236 N/A LYS 627.A N PHE 623.A O no hydrogen 2.882 N/A SER 628.A N TRP 624.A O no hydrogen 2.966 N/A SER 628.A OG TRP 624.A O no hydrogen 3.372 N/A SER 628.A OG HIS 625.A O no hydrogen 2.997 N/A GLU 629.A N LEU 626.A O no hydrogen 3.271 N/A MET 630.A N LYS 627.A O no hydrogen 2.995 N/A ASN 632.A N GLU 629.A O no hydrogen 3.006 N/A ASN 632.A ND2 GLU 629.A OE2 no hydrogen 3.265 N/A THR 634.A N ASN 632.A OD1 no hydrogen 3.488 N/A THR 634.A OG1 ASN 632.A OD1 no hydrogen 2.734 N/A VAL 635.A N ASN 632.A O no hydrogen 3.064 N/A SER 636.A N ASN 632.A O no hydrogen 2.933 N/A ARG 638.A NH1 TYR 599.A O no hydrogen 3.249 N/A PHE 639.A N VAL 635.A O no hydrogen 2.884 N/A GLY 640.A N SER 636.A O no hydrogen 2.807 N/A LEU 641.A N GLN 637.A O no hydrogen 2.948 N/A LEU 642.A N ARG 638.A O no hydrogen 3.091 N/A LEU 643.A N PHE 639.A O no hydrogen 2.811 N/A GLU 644.A N GLY 640.A O no hydrogen 2.841 N/A SER 645.A N LEU 641.A O no hydrogen 3.295 N/A SER 645.A OG LEU 641.A O no hydrogen 3.486 N/A SER 645.A OG LEU 642.A O no hydrogen 2.847 N/A TYR 646.A N LEU 642.A O no hydrogen 3.071 N/A CYS 647.A N LEU 643.A O no hydrogen 2.809 N/A CYS 647.A SG LEU 643.A O no hydrogen 3.301 N/A ARG 648.A N GLU 644.A O no hydrogen 2.840 N/A ARG 648.A NH1 ASN 113.A OD1 no hydrogen 3.244 N/A ARG 648.A NH2 ASN 113.A OD1 no hydrogen 2.796 N/A ARG 648.A NH2 GLU 644.A OE2 no hydrogen 3.059 N/A ALA 649.A N SER 645.A O no hydrogen 3.294 N/A ALA 649.A N TYR 646.A O no hydrogen 3.122 N/A CYS 650.A SG CYS 647.A O no hydrogen 3.655 N/A MET 652.A N ASP 295.A OD1 no hydrogen 2.781 N/A TYR 653.A OH HIS 620.A ND1 no hydrogen 2.668 N/A LEU 654.A N GLY 651.A O no hydrogen 3.410 N/A LYS 655.A N MET 652.A O no hydrogen 3.010 N/A LEU 657.A N TYR 653.A O no hydrogen 2.838 N/A ASN 658.A N LEU 654.A O no hydrogen 2.928 N/A ASN 658.A ND2 GLU 115.A O no hydrogen 2.906 N/A ARG 659.A N LYS 655.A O no hydrogen 3.306 N/A ARG 659.A NE GLY 705.A O no hydrogen 3.102 N/A ARG 659.A NH2 ASP 701.A O no hydrogen 2.769 N/A GLN 660.A N HIS 656.A O no hydrogen 3.154 N/A GLN 660.A NE2 TYR 653.A OH no hydrogen 3.392 N/A VAL 661.A N LEU 657.A O no hydrogen 2.818 N/A GLU 662.A N ASN 658.A O no hydrogen 2.916 N/A ALA 663.A N ARG 659.A O no hydrogen 3.045 N/A MET 664.A N GLN 660.A O no hydrogen 2.972 N/A GLU 665.A N VAL 661.A O no hydrogen 3.051 N/A LYS 666.A N GLU 662.A O no hydrogen 3.275 N/A LYS 666.A NZ ASP 90.A OD1 no hydrogen 2.783 N/A LYS 666.A NZ ASP 698.A OD2 no hydrogen 3.147 N/A LEU 667.A N ALA 663.A O no hydrogen 3.327 N/A ILE 668.A N MET 664.A O no hydrogen 2.919 N/A ASN 669.A N GLU 665.A O no hydrogen 2.976 N/A ASN 669.A ND2 HIS 13.A O no hydrogen 2.806 N/A LEU 670.A N LYS 666.A O no hydrogen 2.946 N/A THR 671.A N LEU 667.A O no hydrogen 3.111 N/A THR 671.A OG1 LEU 667.A O no hydrogen 2.830 N/A THR 671.A OG1 ILE 668.A O no hydrogen 3.065 N/A ASP 672.A N ILE 668.A O no hydrogen 2.957 N/A ILE 673.A N ASN 669.A O no hydrogen 3.095 N/A LEU 674.A N LEU 670.A O no hydrogen 3.333 N/A LYS 675.A N THR 671.A O no hydrogen 2.946 N/A LYS 675.A NZ ASN 758.A O no hydrogen 3.061 N/A GLN 676.A N ASP 672.A O no hydrogen 2.814 N/A GLN 676.A N ILE 673.A O no hydrogen 3.212 N/A LYS 678.A N ILE 673.A O no hydrogen 2.993 N/A LYS 679.A N GLN 676.A O no hydrogen 3.166 N/A GLU 681.A N LYS 678.A O no hydrogen 3.180 N/A VAL 685.A N THR 682.A OG1 no hydrogen 3.402 N/A GLN 686.A N THR 682.A O no hydrogen 2.970 N/A GLN 686.A NE2 LEU 674.A O no hydrogen 2.856 N/A GLN 686.A NE2 LYS 678.A O no hydrogen 2.719 N/A MET 687.A N GLN 683.A O no hydrogen 2.804 N/A LYS 688.A N LYS 684.A O no hydrogen 3.001 N/A PHE 689.A N VAL 685.A O no hydrogen 3.099 N/A LEU 690.A N GLN 686.A O no hydrogen 2.938 N/A VAL 691.A N MET 687.A O no hydrogen 3.056 N/A GLU 692.A N LYS 688.A O no hydrogen 3.202 N/A GLN 693.A N PHE 689.A O no hydrogen 3.027 N/A MET 694.A N LEU 690.A O no hydrogen 2.866 N/A ARG 696.A N GLN 693.A O no hydrogen 3.199 N/A MET 700.A N ARG 696.A O no hydrogen 2.892 N/A ASP 701.A N PRO 697.A O no hydrogen 2.794 N/A ALA 702.A N ASP 698.A O no hydrogen 3.374 N/A LEU 703.A N PHE 699.A O no hydrogen 2.852 N/A GLN 704.A NE2 MET 700.A O no hydrogen 3.479 N/A GLY 705.A N GLY 717.A O no hydrogen 3.235 N/A PHE 706.A N LEU 716.A O no hydrogen 3.113 N/A SER 708.A N HIS 714.A O no hydrogen 3.030 N/A LEU 710.A N SER 708.A OG no hydrogen 3.193 N/A ALA 713.A N ASN 711.A OD1 no hydrogen 3.090 N/A HIS 714.A N ASN 711.A O no hydrogen 2.988 N/A LEU 716.A N PHE 706.A O no hydrogen 2.768 N/A GLY 717.A N GLU 739.A O no hydrogen 2.980 N/A LEU 719.A N GLN 704.A OE1 no hydrogen 2.935 N/A ARG 720.A N ASN 737.A O no hydrogen 3.056 N/A ARG 720.A NH1 GLN 750.A O no hydrogen 3.033 N/A GLU 723.A N ARG 720.A O no hydrogen 2.930 N/A CYS 724.A N LEU 721.A O no hydrogen 3.292 N/A CYS 724.A SG ARG 720.A O no hydrogen 3.392 N/A CYS 724.A SG ASN 737.A O no hydrogen 4.022 N/A ARG 725.A N TRP 735.A O no hydrogen 3.039 N/A MET 727.A N PRO 733.A O no hydrogen 2.873 N/A ARG 732.A N SER 729.A O no hydrogen 3.261 N/A ARG 732.A NE GLN 686.A OE1 no hydrogen 2.992 N/A ARG 732.A NH2 LYS 679.A O no hydrogen 2.734 N/A LEU 734.A N PHE 756.A O no hydrogen 2.897 N/A TRP 735.A N ARG 725.A O no hydrogen 2.839 N/A LEU 736.A N ILE 754.A O no hydrogen 2.891 N/A ASN 737.A ND2 GLU 723.A OE1 no hydrogen 2.782 N/A ASN 737.A ND2 ASN 751.A OD1 no hydrogen 2.892 N/A TRP 738.A NE1 LEU 703.A O no hydrogen 2.703 N/A GLU 739.A N ASN 718.A O no hydrogen 2.729 N/A ASN 740.A ND2 GLY 251.A O no hydrogen 2.786 N/A ASN 740.A ND2 PHE 749.A O no hydrogen 2.885 N/A ASP 742.A N ASN 740.A OD1 no hydrogen 3.093 N/A MET 744.A N ASP 742.A OD1 no hydrogen 3.134 N/A SER 745.A N ASP 742.A O no hydrogen 2.858 N/A SER 745.A OG ASN 740.A O no hydrogen 3.518 N/A SER 745.A OG ASP 742.A O no hydrogen 3.079 N/A LEU 747.A N MET 744.A O no hydrogen 3.259 N/A ASN 752.A N ASN 737.A OD1 no hydrogen 2.809 N/A ASN 752.A ND2.B TRP 738.A O no hydrogen 2.956 N/A ILE 754.A N LEU 736.A O no hydrogen 2.918 N/A ILE 755.A N ILE 803.A O no hydrogen 2.815 N/A PHE 756.A N LEU 734.A O no hydrogen 2.776 N/A LYS 757.A N GLY 801.A O no hydrogen 2.819 N/A ASN 758.A ND2 ILE 668.A O no hydrogen 3.297 N/A ASN 758.A ND2 THR 671.A OG1 no hydrogen 2.788 N/A ASN 758.A ND2 ASP 672.A OD1 no hydrogen 2.807 N/A GLY 759.A N CYS 799.A O no hydrogen 2.783 N/A ARG 763.A N ASP 761.A OD1 no hydrogen 3.060 N/A ARG 763.A NE ASP 761.A OD1 no hydrogen 3.145 N/A ARG 763.A NE ASP 761.A OD2 no hydrogen 3.201 N/A ARG 763.A NH2 ASP 761.A OD2 no hydrogen 2.959 N/A MET 766.A N LEU 762.A O no hydrogen 3.001 N/A LEU 767.A N ARG 763.A O no hydrogen 2.833 N/A THR 768.A N GLN 764.A O no hydrogen 2.875 N/A THR 768.A OG1 GLN 764.A O no hydrogen 3.074 N/A LEU 769.A N ASP 765.A O no hydrogen 2.872 N/A GLN 770.A N MET 766.A O no hydrogen 3.133 N/A GLN 770.A NE2 GLN 585.A O no hydrogen 2.643 N/A GLN 770.A NE2 GLN 589.A OE1 no hydrogen 2.730 N/A ILE 771.A N LEU 767.A O no hydrogen 3.067 N/A ILE 772.A N THR 768.A O no hydrogen 2.923 N/A ARG 773.A N LEU 769.A O no hydrogen 3.198 N/A ARG 773.A NH2 PRO 790.A O no hydrogen 2.866 N/A ILE 774.A N GLN 770.A O no hydrogen 2.959 N/A MET 775.A N ILE 771.A O no hydrogen 2.757 N/A GLU 776.A N ILE 772.A O no hydrogen 2.959 N/A ASN 777.A N ARG 773.A O no hydrogen 3.000 N/A ILE 778.A N ILE 774.A O no hydrogen 2.917 N/A TRP 779.A N MET 775.A O no hydrogen 3.036 N/A TRP 779.A NE1 ALA 934.A O no hydrogen 3.073 N/A GLN 780.A N GLU 776.A O no hydrogen 3.053 N/A GLN 780.A NE2 LEU 786.A O no hydrogen 3.490 N/A ASN 781.A N ASN 777.A O no hydrogen 3.140 N/A GLN 782.A N ILE 778.A O no hydrogen 3.210 N/A GLN 782.A N TRP 779.A O no hydrogen 3.084 N/A GLN 782.A NE2 GLN 940.A OE1 no hydrogen 3.425 N/A GLY 783.A N GLN 780.A O no hydrogen 2.944 N/A LEU 784.A N TRP 779.A O no hydrogen 2.746 N/A MET 788.A N GLU 776.A OE2 no hydrogen 2.914 N/A LEU 789.A N TYR 851.A OH no hydrogen 2.927 N/A TYR 791.A N LEU 789.A O no hydrogen 2.907 N/A GLY 792.A N GLU 804.A OE1 no hydrogen 2.793 N/A CYS 793.A SG LEU 802.A O no hydrogen 3.748 N/A LEU 794.A N LEU 802.A O no hydrogen 3.072 N/A SER 795.A OG GLY 797.A O no hydrogen 3.464 N/A ILE 796.A N VAL 800.A O no hydrogen 2.924 N/A CYS 799.A SG ASP 798.A OD1 no hydrogen 3.668 N/A GLY 801.A N LYS 757.A O no hydrogen 2.891 N/A LEU 802.A N LEU 794.A O no hydrogen 2.946 N/A ILE 803.A N ILE 755.A O no hydrogen 2.949 N/A GLU 804.A N GLY 792.A O no hydrogen 2.790 N/A VAL 805.A N GLU 753.A O no hydrogen 3.092 N/A ARG 807.A NH1 GLU 753.A OE1 no hydrogen 2.814 N/A SER 809.A OG VAL 806.A O no hydrogen 3.047 N/A HIS 810.A N VAL 870.A O no hydrogen 2.984 N/A THR 811.A N GLN 814.A OE1 no hydrogen 3.394 N/A THR 811.A OG1 GLN 814.A OE1 no hydrogen 3.289 N/A ILE 812.A N ILE 868.A O no hydrogen 3.039 N/A MET 813.A N ASN 865.A O no hydrogen 3.012 N/A GLN 814.A N THR 811.A O no hydrogen 3.190 N/A GLN 814.A N THR 811.A OG1 no hydrogen 3.212 N/A ILE 815.A N THR 811.A O no hydrogen 3.164 N/A GLN 816.A N ILE 812.A O no hydrogen 2.896 N/A GLN 816.A NE2 ASN 865.A OD1 no hydrogen 3.636 N/A GLN 816.A NE2 ASP 906.A OD2 no hydrogen 3.373 N/A CYS 817.A N GLN 814.A O no hydrogen 3.348 N/A CYS 817.A SG MET 813.A O no hydrogen 3.257 N/A SER 821.A OG ASP 906.A OD1 no hydrogen 2.822 N/A HIS 825.A NE2 TYR 837.A OH no hydrogen 2.629 N/A GLN 826.A N HIS 822.A O no hydrogen 2.963 N/A GLN 826.A NE2 GLN 826.A O no hydrogen 3.283 N/A GLN 826.A NE2 ASP 830.A OD2 no hydrogen 2.986 N/A TRP 827.A N THR 823.A O no hydrogen 2.797 N/A LEU 828.A N LEU 824.A O no hydrogen 2.972 N/A LYS 829.A N HIS 825.A O no hydrogen 2.859 N/A ASP 830.A N GLN 826.A O no hydrogen 3.039 N/A LYS 831.A N TRP 827.A O no hydrogen 3.264 N/A ASN 832.A N LEU 828.A O no hydrogen 3.064 N/A ASN 832.A N LYS 829.A O no hydrogen 3.245 N/A ASN 832.A ND2 LEU 828.A O no hydrogen 3.591 N/A ASN 832.A ND2 ASP 872.A O no hydrogen 2.789 N/A TYR 837.A N GLY 834.A O no hydrogen 3.411 N/A TYR 837.A OH HIS 825.A NE2 no hydrogen 2.629 N/A ILE 841.A N TYR 837.A O no hydrogen 3.284 N/A ASP 842.A N ASP 838.A O no hydrogen 3.023 N/A LEU 843.A N ALA 839.A O no hydrogen 3.035 N/A PHE 844.A N ALA 840.A O no hydrogen 2.972 N/A THR 845.A N ILE 841.A O no hydrogen 3.019 N/A THR 845.A OG1 ILE 841.A O no hydrogen 2.701 N/A ARG 846.A N ASP 842.A O no hydrogen 2.878 N/A ARG 846.A NE ASP 842.A OD1 no hydrogen 3.021 N/A ARG 846.A NE ASP 842.A OD2 no hydrogen 3.384 N/A ARG 846.A NH1 ASP 785.A O no hydrogen 3.353 N/A SER 847.A N LEU 843.A O no hydrogen 2.976 N/A SER 847.A OG LEU 843.A O no hydrogen 2.829 N/A SER 847.A OG PHE 844.A O no hydrogen 2.996 N/A CYS 848.A N PHE 844.A O no hydrogen 2.951 N/A ALA 849.A N THR 845.A O no hydrogen 2.992 N/A GLY 850.A N ARG 846.A O no hydrogen 3.249 N/A TYR 851.A N SER 847.A O no hydrogen 3.103 N/A CYS 852.A N CYS 848.A O no hydrogen 3.027 N/A VAL 853.A N ALA 849.A O no hydrogen 2.961 N/A ALA 854.A N GLY 850.A O no hydrogen 2.819 N/A THR 855.A N TYR 851.A O no hydrogen 3.002 N/A THR 855.A OG1 TYR 851.A O no hydrogen 2.594 N/A PHE 856.A N CYS 852.A O no hydrogen 3.293 N/A ILE 857.A N VAL 853.A O no hydrogen 2.910 N/A LEU 858.A N ALA 854.A O no hydrogen 3.083 N/A GLY 859.A N THR 855.A O no hydrogen 2.808 N/A ILE 860.A N THR 855.A O no hydrogen 3.354 N/A GLY 861.A N HIS 883.A O no hydrogen 3.279 N/A ARG 863.A N PRO 900.A O no hydrogen 3.226 N/A ARG 863.A NE GLY 861.A O no hydrogen 2.972 N/A ARG 863.A NH1 GLY 861.A O no hydrogen 2.815 N/A ARG 863.A NH1 ASP 880.A O no hydrogen 3.300 N/A ARG 863.A NH2 ILE 879.A O no hydrogen 2.809 N/A SER 866.A N HIS 864.A ND1 no hydrogen 3.371 N/A ASN 867.A N HIS 864.A O no hydrogen 3.105 N/A MET 869.A N PHE 877.A O no hydrogen 2.867 N/A VAL 870.A N HIS 810.A O no hydrogen 2.906 N/A LYS 871.A N GLN 875.A O no hydrogen 2.778 N/A ASP 872.A N ASN 808.A O no hydrogen 2.886 N/A GLY 874.A N LYS 871.A O no hydrogen 3.132 N/A GLN 875.A N ASP 873.A OD1 no hydrogen 3.390 N/A LEU 876.A N SER 847.A OG no hydrogen 2.911 N/A PHE 877.A N MET 869.A O no hydrogen 2.888 N/A ILE 879.A N ASN 867.A O no hydrogen 3.046 N/A ASP 880.A N TYR 791.A OH no hydrogen 3.296 N/A PHE 881.A N ASP 765.A OD2 no hydrogen 3.028 N/A HIS 883.A ND1 GLU 959.A OE2 no hydrogen 2.802 N/A PHE 884.A N GLU 959.A OE1 no hydrogen 2.925 N/A LEU 885.A N LEU 858.A O no hydrogen 2.739 N/A HIS 887.A N LEU 885.A O no hydrogen 3.010 N/A LYS 888.A NZ ASP 862.A OD2 no hydrogen 2.722 N/A PHE 892.A N LYS 888.A O no hydrogen 2.905 N/A ARG 898.A NH1 ILE 860.A O no hydrogen 3.344 N/A ARG 898.A NH1 ASP 862.A OD1 no hydrogen 3.452 N/A ARG 898.A NH2 ILE 860.A O no hydrogen 2.864 N/A LEU 903.A N HIS 994.A NE2 no hydrogen 2.904 N/A LEU 908.A N THR 904.A O no hydrogen 3.079 N/A ILE 909.A N GLN 905.A O no hydrogen 2.739 N/A VAL 910.A N ASP 906.A O no hydrogen 3.361 N/A ILE 911.A N PHE 907.A O no hydrogen 3.099 N/A SER 912.A N LEU 908.A O no hydrogen 2.814 N/A SER 912.A OG LEU 908.A O no hydrogen 3.049 N/A LYS 913.A N VAL 910.A O no hydrogen 3.048 N/A LYS 913.A NZ ASP 838.A OD1 no hydrogen 3.455 N/A GLY 914.A N ILE 909.A O no hydrogen 2.679 N/A ALA 915.A N SER 912.A O no hydrogen 3.378 N/A CYS 918.A SG GLN 905.A OE1 no hydrogen 4.035 N/A CYS 918.A SG SER 912.A OG no hydrogen 3.343 N/A CYS 918.A SG ALA 915.A O no hydrogen 3.365 N/A THR 921.A OG1 CYS 918.A O no hydrogen 2.925 N/A PHE 924.A N THR 921.A OG1 no hydrogen 3.283 N/A GLU 925.A N THR 921.A O no hydrogen 3.347 N/A ARG 926.A N ARG 922.A O no hydrogen 3.180 N/A PHE 927.A N GLU 923.A O no hydrogen 3.034 N/A GLN 928.A N PHE 924.A O no hydrogen 3.004 N/A GLN 928.A NE2 GLY 997.A O no hydrogen 2.976 N/A GLU 929.A N GLU 925.A O no hydrogen 3.182 N/A MET 930.A N ARG 926.A O no hydrogen 3.202 N/A CYS 931.A N PHE 927.A O no hydrogen 3.189 N/A CYS 931.A SG PHE 927.A O no hydrogen 3.366 N/A TYR 932.A N GLN 928.A O no hydrogen 2.937 N/A LYS 933.A N GLU 929.A O no hydrogen 3.045 N/A ALA 934.A N MET 930.A O no hydrogen 2.947 N/A TYR 935.A N CYS 931.A O no hydrogen 2.775 N/A TYR 935.A OH THR 972.A O no hydrogen 2.693 N/A LEU 936.A N TYR 932.A O no hydrogen 3.046 N/A ALA 937.A N LYS 933.A O no hydrogen 2.799 N/A ILE 938.A N ALA 934.A O no hydrogen 3.161 N/A ARG 939.A N TYR 935.A O no hydrogen 3.111 N/A ARG 939.A NE LEU 973.A O no hydrogen 2.772 N/A ARG 939.A NH2 ALA 974.A O no hydrogen 2.780 N/A ARG 939.A NH2 LYS 977.A O no hydrogen 2.811 N/A GLN 940.A N LEU 936.A O no hydrogen 2.955 N/A GLN 940.A NE2 GLU 979.A OE2 no hydrogen 2.944 N/A HIS 941.A N ILE 938.A O no hydrogen 2.989 N/A HIS 941.A ND1 ALA 937.A O no hydrogen 2.831 N/A ALA 942.A N ARG 939.A O no hydrogen 3.265 N/A LEU 944.A N HIS 941.A O no hydrogen 3.065 N/A ILE 946.A N ALA 942.A O no hydrogen 2.871 N/A ASN 947.A N ASN 943.A O no hydrogen 2.951 N/A ASN 947.A ND2 GLU 551.A O no hydrogen 3.673 N/A LEU 948.A N LEU 944.A O no hydrogen 2.850 N/A PHE 949.A N PHE 945.A O no hydrogen 3.099 N/A SER 950.A N ILE 946.A O no hydrogen 2.914 N/A SER 950.A OG ILE 946.A O no hydrogen 2.822 N/A MET 951.A N ASN 947.A O no hydrogen 2.934 N/A MET 952.A N PHE 949.A O no hydrogen 3.212 N/A GLY 954.A N TYR 596.A OH no hydrogen 3.133 N/A SER 955.A N MET 952.A O no hydrogen 3.012 N/A SER 955.A OG MET 952.A O no hydrogen 2.709 N/A LEU 960.A N MET 957.A O no hydrogen 3.169 N/A GLN 961.A N ASP 965.A OD2 no hydrogen 3.212 N/A SER 962.A OG ASP 965.A OD1 no hydrogen 3.243 N/A ASP 965.A N SER 962.A O no hydrogen 3.198 N/A ILE 966.A N PHE 963.A O no hydrogen 2.908 N/A ALA 967.A N PHE 963.A O no hydrogen 3.066 N/A ILE 969.A N ILE 966.A O no hydrogen 2.997 N/A ARG 970.A N ALA 967.A O no hydrogen 3.178 N/A ARG 970.A NE ASP 493.A OD2 no hydrogen 2.862 N/A ARG 970.A NH2 ASP 493.A OD1 no hydrogen 2.768 N/A ARG 970.A NH2 ASP 493.A OD2 no hydrogen 3.450 N/A ARG 970.A NH2 ASP 976.A OD1 no hydrogen 2.877 N/A LYS 971.A N ALA 967.A O no hydrogen 3.087 N/A THR 972.A N TYR 968.A O no hydrogen 2.984 N/A THR 972.A OG1 ILE 857.A O no hydrogen 2.716 N/A THR 972.A OG1 TYR 968.A O no hydrogen 3.347 N/A THR 972.A OG1 ILE 969.A O no hydrogen 3.516 N/A LEU 973.A N ILE 969.A O no hydrogen 2.956 N/A ALA 974.A N LYS 971.A O no hydrogen 2.870 N/A LEU 975.A N ARG 970.A O no hydrogen 2.910 N/A LYS 977.A N ALA 974.A O no hydrogen 3.120 N/A THR 978.A N GLU 981.A OE2 no hydrogen 3.085 N/A GLU 981.A N THR 978.A OG1 no hydrogen 3.218 N/A ALA 982.A N THR 978.A O no hydrogen 2.849 N/A LEU 983.A N GLU 979.A O no hydrogen 3.056 N/A GLU 984.A N GLN 980.A O no hydrogen 3.183 N/A TYR 985.A N GLU 981.A O no hydrogen 3.025 N/A TYR 985.A OH GLU 897.A OE1 no hydrogen 2.651 N/A PHE 986.A N ALA 982.A O no hydrogen 3.078 N/A MET 987.A N LEU 983.A O no hydrogen 3.024 N/A LYS 988.A N GLU 984.A O no hydrogen 2.917 N/A LYS 988.A NZ ASP 992.A OD1 no hydrogen 2.792 N/A GLN 989.A N TYR 985.A O no hydrogen 2.967 N/A GLN 989.A NE2 TYR 985.A O no hydrogen 3.377 N/A MET 990.A N PHE 986.A O no hydrogen 2.904 N/A ASN 991.A N MET 987.A O no hydrogen 2.792 N/A ASP 992.A N LYS 988.A O no hydrogen 2.844 N/A ALA 993.A N GLN 989.A O no hydrogen 3.093 N/A HIS 994.A N MET 990.A O no hydrogen 2.957 N/A HIS 994.A ND1 MET 990.A O no hydrogen 2.764 N/A GLY 996.A N ASN 991.A O no hydrogen 3.238 N/A TRP 998.A N ASN 991.A OD1 no hydrogen 2.847 N/A THR 1000.A OG1 MET 1002.A O no hydrogen 2.907 N/A PHE 1006.A N ASP 1003.A OD2 no hydrogen 2.729 N/A HIS 1007.A N ASP 1003.A O no hydrogen 2.757 N/A THR 1008.A N ASP 1003.A OD1 no hydrogen 2.937 N/A THR 1008.A OG1 ASP 1003.A OD1 no hydrogen 2.952 N/A