Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4zop_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PRO 1.A N GLU 75.A O no hydrogen 2.970 N/A PRO 1.A N GLU 126.A OE2 no hydrogen 2.688 N/A ARG 3.A NE GLN 74.A OE1 no hydrogen 3.121 N/A ARG 3.A NH2 GLY 7.A O no hydrogen 2.788 N/A SER 6.A OG GLU 656.A OE1 no hydrogen 2.780 N/A GLY 7.A N SER 5.A OG no hydrogen 3.015 N/A GLU 8.A N HIS 13.A O no hydrogen 3.042 N/A LEU 9.A N ILE 12.A O no hydrogen 3.094 N/A TRP 10.A N PHE 94.A O no hydrogen 3.078 N/A ILE 12.A N LEU 9.A O no hydrogen 3.479 N/A HIS 13.A ND1 GLU 668.A OE1 no hydrogen 2.729 N/A MET 15.A N GLU 8.A OE1 no hydrogen 2.921 N/A ILE 19.A N CYS 35.A O no hydrogen 2.821 N/A VAL 21.A N LEU 33.A O no hydrogen 2.722 N/A GLU 22.A N PRO 96.A O no hydrogen 3.059 N/A CYS 23.A N VAL 31.A O no hydrogen 2.767 N/A CYS 23.A SG VAL 21.A O no hydrogen 3.605 N/A LEU 24.A N LEU 98.A O no hydrogen 2.845 N/A LEU 25.A N MET 29.A O no hydrogen 2.801 N/A ASN 27.A ND2 LEU 57.A O no hydrogen 3.059 N/A GLY 28.A N LEU 25.A O no hydrogen 3.217 N/A MET 29.A N ASN 27.A OD1 no hydrogen 3.158 N/A VAL 31.A N CYS 23.A O no hydrogen 2.829 N/A THR 32.A OG1 GLU 22.A OE2 no hydrogen 2.719 N/A LEU 33.A N VAL 21.A O no hydrogen 2.981 N/A CYS 35.A N ILE 19.A O no hydrogen 2.723 N/A CYS 35.A SG LEU 33.A O no hydrogen 3.665 N/A ARG 37.A N PRO 17.A O no hydrogen 2.821 N/A ARG 37.A NE GLU 8.A OE1 no hydrogen 3.238 N/A ARG 37.A NH1 ASP 689.A OD1 no hydrogen 3.071 N/A ARG 37.A NH2 GLU 8.A OE1 no hydrogen 3.357 N/A ARG 37.A NH2 GLU 8.A OE2 no hydrogen 2.747 N/A ARG 37.A NH2 ASP 689.A OD2 no hydrogen 3.107 N/A GLU 38.A N GLU 38.A OE1 no hydrogen 2.920 N/A ALA 39.A N LEU 36.A O no hydrogen 3.132 N/A THR 40.A OG1 THR 43.A OG1 no hydrogen 3.324 N/A LEU 41.A N ARG 86.A O no hydrogen 2.982 N/A ILE 42.A N GLU 84.A O no hydrogen 3.138 N/A THR 43.A OG1 THR 40.A OG1 no hydrogen 3.324 N/A ILE 44.A N THR 40.A O no hydrogen 3.051 N/A LYS 45.A N LEU 41.A O no hydrogen 2.825 N/A LYS 45.A NZ GLU 64.A O no hydrogen 3.024 N/A LYS 45.A NZ TYR 67.A O no hydrogen 2.727 N/A LYS 45.A NZ GLU 84.A OE1 no hydrogen 2.802 N/A LYS 45.A NZ GLU 84.A OE2 no hydrogen 3.118 N/A HIS 46.A N ILE 42.A O no hydrogen 3.117 N/A HIS 46.A ND1 GLU 64.A OE2 no hydrogen 2.711 N/A GLU 47.A N THR 43.A O no hydrogen 2.865 N/A LEU 48.A N ILE 44.A O no hydrogen 2.846 N/A PHE 49.A N LYS 45.A O no hydrogen 2.880 N/A LYS 50.A N HIS 46.A O no hydrogen 3.158 N/A LYS 50.A NZ GLU 47.A OE1 no hydrogen 2.952 N/A GLU 51.A N GLU 47.A O no hydrogen 3.163 N/A ALA 52.A N LEU 48.A O no hydrogen 2.766 N/A LYS 54.A N GLU 51.A O no hydrogen 3.089 N/A LYS 54.A NZ GLU 51.A OE1 no hydrogen 3.505 N/A LYS 54.A NZ GLU 51.A OE2 no hydrogen 3.133 N/A TYR 55.A N ALA 52.A O no hydrogen 3.229 N/A HIS 58.A ND1 TYR 55.A O no hydrogen 3.333 N/A GLN 59.A N GLN 59.A OE1 no hydrogen 3.095 N/A LEU 60.A N LEU 57.A O no hydrogen 2.853 N/A LEU 61.A N HIS 58.A O no hydrogen 2.850 N/A GLN 62.A N TYR 67.A OH no hydrogen 2.884 N/A GLN 62.A NE2 GLU 102.A OE1 no hydrogen 3.031 N/A SER 66.A N ASP 63.A O no hydrogen 2.804 N/A SER 66.A OG ASP 63.A O no hydrogen 3.083 N/A TYR 67.A N GLU 64.A O no hydrogen 3.208 N/A ILE 68.A N ILE 101.A O no hydrogen 2.913 N/A VAL 70.A N LYS 99.A O no hydrogen 2.901 N/A SER 71.A N GLU 79.A O no hydrogen 3.187 N/A SER 71.A OG PHE 97.A O no hydrogen 2.756 N/A THR 73.A N GLU 77.A O no hydrogen 2.792 N/A THR 73.A OG1 GLU 77.A O no hydrogen 3.129 N/A GLN 74.A N ARG 92.A O no hydrogen 2.795 N/A GLN 74.A NE2 GLY 7.A O no hydrogen 3.127 N/A GLN 74.A NE2 LEU 93.A O no hydrogen 2.824 N/A ALA 76.A N THR 73.A O no hydrogen 2.914 N/A GLU 79.A N SER 71.A O no hydrogen 2.917 N/A PHE 81.A N PHE 69.A O no hydrogen 2.736 N/A THR 85.A N ASP 83.A OD1 no hydrogen 3.259 N/A THR 85.A OG1 ASP 83.A OD1 no hydrogen 2.731 N/A ARG 86.A N ASP 83.A O no hydrogen 3.356 N/A ARG 86.A NH1 GLU 79.A OE2 no hydrogen 2.824 N/A ARG 86.A NH2 ASP 90.A O no hydrogen 3.037 N/A ARG 87.A NH1 GLU 38.A O no hydrogen 3.156 N/A ARG 87.A NH2 ASP 692.A OD2 no hydrogen 2.931 N/A LEU 88.A N ALA 39.A O no hydrogen 2.994 N/A CYS 89.A N ARG 37.A O no hydrogen 2.845 N/A CYS 89.A SG ASP 90.A OD1 no hydrogen 3.799 N/A ASP 90.A N ARG 87.A O no hydrogen 2.883 N/A LEU 91.A N LEU 88.A O no hydrogen 3.382 N/A PHE 94.A N VAL 72.A O no hydrogen 3.015 N/A GLN 95.A NE2 PHE 94.A O no hydrogen 3.063 N/A PHE 97.A N GLN 95.A O no hydrogen 2.878 N/A LEU 98.A N GLU 22.A O no hydrogen 2.778 N/A LYS 99.A N VAL 70.A O no hydrogen 2.800 N/A VAL 100.A N LEU 24.A O no hydrogen 3.044 N/A ILE 101.A N ILE 68.A O no hydrogen 2.957 N/A GLU 109.A N ASN 106.A OD1 no hydrogen 3.224 N/A LYS 110.A N ASN 106.A O no hydrogen 3.101 N/A LYS 110.A NZ GLU 80.A OE1 no hydrogen 3.290 N/A LYS 110.A NZ GLU 80.A OE2 no hydrogen 2.974 N/A LYS 110.A NZ VAL 104.A O no hydrogen 2.823 N/A ILE 111.A N ARG 107.A O no hydrogen 2.963 N/A LEU 112.A N GLU 108.A O no hydrogen 3.015 N/A ASN 113.A N GLU 109.A O no hydrogen 2.865 N/A ARG 114.A N LYS 110.A O no hydrogen 3.204 N/A ARG 114.A NH1 GLU 79.A OE2 no hydrogen 3.395 N/A GLU 115.A N ILE 111.A O no hydrogen 3.166 N/A ILE 116.A N LEU 112.A O no hydrogen 2.880 N/A GLY 117.A N ASN 113.A O no hydrogen 2.863 N/A PHE 118.A N ARG 114.A O no hydrogen 2.892 N/A ALA 119.A N GLU 115.A O no hydrogen 3.160 N/A ILE 120.A N ILE 116.A O no hydrogen 3.170 N/A MET 122.A N GLY 117.A O no hydrogen 3.121 N/A GLU 126.A N PRO 123.A O no hydrogen 3.041 N/A PHE 127.A N VAL 124.A O no hydrogen 3.137 N/A GLU 134.A N ASP 132.A OD1 no hydrogen 3.000 N/A GLN 136.A N ASP 132.A O no hydrogen 3.393 N/A GLN 136.A NE2 PHE 127.A O no hydrogen 2.764 N/A GLN 136.A NE2 VAL 130.A O no hydrogen 3.164 N/A ASP 137.A N PRO 133.A O no hydrogen 2.975 N/A PHE 138.A N GLU 134.A O no hydrogen 2.920 N/A ARG 139.A N VAL 135.A O no hydrogen 2.936 N/A ARG 139.A NE GLU 635.A OE1 no hydrogen 3.012 N/A ARG 139.A NH1 ASP 128.A OD1 no hydrogen 3.197 N/A ARG 139.A NH2 GLU 635.A OE1 no hydrogen 3.282 N/A ARG 139.A NH2 GLU 635.A OE2 no hydrogen 2.786 N/A ARG 140.A N GLN 136.A O no hydrogen 3.255 N/A ASN 141.A N ASP 137.A O no hydrogen 2.719 N/A ASN 141.A ND2 ASP 137.A O no hydrogen 3.053 N/A ILE 142.A N PHE 138.A O no hydrogen 2.983 N/A LEU 143.A N ARG 140.A O no hydrogen 3.317 N/A ASN 144.A N ASN 141.A O no hydrogen 3.505 N/A VAL 145.A N ILE 142.A O no hydrogen 2.992 N/A CYS 146.A N ILE 142.A O no hydrogen 3.390 N/A CYS 146.A SG ILE 142.A O no hydrogen 3.828 N/A CYS 146.A SG SER 636.A O no hydrogen 3.432 N/A LYS 147.A N LEU 143.A O no hydrogen 2.994 N/A LYS 147.A NZ ASP 151.A OD1 no hydrogen 3.373 N/A GLU 148.A N ASN 144.A O no hydrogen 2.946 N/A ALA 149.A N VAL 145.A O no hydrogen 3.122 N/A VAL 150.A N CYS 146.A O no hydrogen 3.201 N/A ASP 151.A N LYS 147.A O no hydrogen 2.921 N/A LEU 152.A N GLU 148.A O no hydrogen 2.928 N/A ARG 153.A N VAL 150.A O no hydrogen 3.144 N/A ARG 153.A NH1 ALA 640.A O no hydrogen 3.415 N/A ARG 153.A NH2 LEU 604.A O no hydrogen 2.802 N/A ARG 153.A NH2 ALA 640.A O no hydrogen 3.104 N/A ASP 154.A N VAL 150.A O no hydrogen 3.230 N/A ASP 154.A N ASP 151.A O no hydrogen 3.113 N/A SER 157.A OG ASP 154.A OD1 no hydrogen 3.508 N/A HIS 159.A NE2 LEU 244.A O no hydrogen 3.167 N/A SER 160.A N ASN 156.A O no hydrogen 2.950 N/A SER 160.A OG ARG 153.A O no hydrogen 2.625 N/A ARG 161.A N PRO 158.A O no hydrogen 3.216 N/A ARG 161.A NH1 LEU 279.A O no hydrogen 3.105 N/A ARG 161.A NH2 LEU 279.A O no hydrogen 3.521 N/A ALA 162.A N PRO 158.A O no hydrogen 2.873 N/A MET 163.A N HIS 159.A O no hydrogen 2.752 N/A TYR 164.A OH CYS 641.A O no hydrogen 2.717 N/A VAL 165.A N ARG 161.A O no hydrogen 3.081 N/A TYR 166.A N ALA 162.A O no hydrogen 2.748 N/A GLU 171.A N GLN 251.A O no hydrogen 2.780 N/A SER 172.A OG THR 570.A OG1 no hydrogen 2.672 N/A SER 172.A OG ASP 572.A OD2 no hydrogen 2.691 N/A ILE 180.A N PRO 177.A O no hydrogen 2.858 N/A TYR 181.A N PRO 177.A O no hydrogen 3.042 N/A ASN 182.A N LYS 178.A O no hydrogen 3.035 N/A LYS 183.A N ILE 180.A O no hydrogen 3.082 N/A LYS 183.A NZ HIS 179.A O no hydrogen 3.047 N/A LEU 184.A N TYR 181.A O no hydrogen 3.172 N/A ASP 185.A N GLN 188.A O no hydrogen 3.315 N/A GLN 188.A N ASP 185.A O no hydrogen 3.290 N/A GLN 188.A NE2 ASN 211.A OD1 no hydrogen 3.485 N/A ILE 189.A N ILE 210.A O no hydrogen 2.709 N/A VAL 191.A N LEU 208.A O no hydrogen 2.763 N/A VAL 192.A N PRO 265.A O no hydrogen 2.880 N/A ILE 193.A N TYR 206.A O no hydrogen 2.866 N/A TRP 194.A N LEU 267.A O no hydrogen 2.813 N/A TRP 194.A NE1 ASN 266.A OD1 no hydrogen 2.931 N/A VAL 195.A N GLN 204.A O no hydrogen 2.991 N/A VAL 197.A N ASP 202.A O no hydrogen 3.064 N/A LYS 203.A NZ ILE 734.A O no hydrogen 2.895 N/A LYS 203.A NZ GLU 737.A OE1 no hydrogen 3.410 N/A LYS 203.A NZ GLU 737.A OE2 no hydrogen 3.461 N/A GLN 204.A N VAL 195.A O no hydrogen 2.977 N/A LEU 208.A N VAL 191.A O no hydrogen 2.764 N/A LYS 209.A NZ ASP 185.A OD2 no hydrogen 2.807 N/A ILE 210.A N ILE 189.A O no hydrogen 2.878 N/A HIS 212.A N GLY 187.A O no hydrogen 3.241 N/A HIS 212.A ND1 SER 250.A OG no hydrogen 2.938 N/A CYS 214.A N ASN 211.A O no hydrogen 3.023 N/A GLN 218.A N VAL 215.A O no hydrogen 3.057 N/A VAL 219.A N VAL 215.A O no hydrogen 3.387 N/A VAL 219.A N PRO 216.A O no hydrogen 3.208 N/A ILE 220.A N PRO 216.A O no hydrogen 3.138 N/A ALA 221.A N GLU 217.A O no hydrogen 2.790 N/A GLU 222.A N GLN 218.A O no hydrogen 3.161 N/A ALA 223.A N VAL 219.A O no hydrogen 3.072 N/A ILE 224.A N ILE 220.A O no hydrogen 2.880 N/A ARG 225.A N ALA 221.A O no hydrogen 3.029 N/A ARG 225.A NH1 GLU 222.A OE1 no hydrogen 3.543 N/A LYS 226.A N GLU 222.A O no hydrogen 3.057 N/A LYS 226.A NZ THR 207.A O no hydrogen 3.069 N/A LYS 227.A N ARG 225.A O no hydrogen 2.814 N/A LYS 231.A N GLN 229.A O no hydrogen 2.907 N/A ILE 233.A N MET 270.A O no hydrogen 2.936 N/A LYS 235.A N MET 268.A O no hydrogen 3.016 N/A LYS 235.A NZ VAL 236.A O no hydrogen 3.263 N/A LYS 235.A NZ CYS 239.A O no hydrogen 3.231 N/A LYS 235.A NZ ASP 733.A OD1 no hydrogen 2.851 N/A LYS 235.A NZ ASP 733.A OD2 no hydrogen 3.279 N/A VAL 236.A N GLU 241.A O no hydrogen 2.892 N/A CYS 237.A N ASN 266.A O no hydrogen 3.163 N/A CYS 237.A SG ASN 266.A O no hydrogen 3.339 N/A GLY 238.A N ASP 733.A OD2 no hydrogen 2.990 N/A CYS 239.A N VAL 236.A O no hydrogen 3.517 N/A ASP 240.A N ALA 704.A O no hydrogen 2.884 N/A PHE 243.A N LEU 234.A O no hydrogen 3.094 N/A LYS 246.A N GLU 245.A OE2 no hydrogen 2.943 N/A LYS 246.A NZ GLU 245.A OE2 no hydrogen 2.831 N/A TYR 247.A N GLU 245.A O no hydrogen 2.952 N/A LEU 249.A N CYS 214.A O no hydrogen 2.807 N/A SER 250.A N HIS 212.A O no hydrogen 3.133 N/A SER 250.A OG HIS 212.A ND1 no hydrogen 2.938 N/A SER 250.A OG HIS 212.A O no hydrogen 3.516 N/A GLN 251.A N PRO 248.A O no hydrogen 2.881 N/A GLN 251.A NE2 GLU 171.A O no hydrogen 3.121 N/A TYR 252.A N LEU 249.A O no hydrogen 3.256 N/A TYR 252.A OH GLU 245.A O no hydrogen 2.745 N/A LYS 253.A N ASN 169.A O no hydrogen 2.906 N/A LYS 253.A NZ ASP 572.A OD1 no hydrogen 2.772 N/A ARG 256.A N TYR 252.A O no hydrogen 3.004 N/A ARG 256.A NE SER 250.A O no hydrogen 2.811 N/A ARG 256.A NH2 SER 173.A O no hydrogen 2.804 N/A SER 257.A N LYS 253.A O no hydrogen 2.895 N/A SER 257.A OG LYS 253.A O no hydrogen 2.698 N/A CYS 258.A N TYR 254.A O no hydrogen 3.087 N/A CYS 258.A SG TYR 254.A O no hydrogen 3.187 N/A ILE 259.A N ILE 255.A O no hydrogen 3.061 N/A MET 260.A N ARG 256.A O no hydrogen 3.512 N/A LEU 261.A N SER 257.A O no hydrogen 2.972 N/A GLY 262.A N ILE 259.A O no hydrogen 2.967 N/A ARG 263.A N CYS 258.A O no hydrogen 2.778 N/A ASN 266.A N TYR 254.A OH no hydrogen 2.916 N/A LEU 267.A N VAL 192.A O no hydrogen 2.884 N/A MET 268.A N LYS 235.A O no hydrogen 2.763 N/A LEU 269.A N TRP 194.A O no hydrogen 2.771 N/A MET 270.A N ILE 233.A O no hydrogen 3.212 N/A LYS 272.A N LYS 231.A O no hydrogen 3.192 N/A LYS 272.A NZ TYR 276.A OH no hydrogen 3.027 N/A SER 274.A N ALA 271.A O no hydrogen 2.974 N/A SER 274.A OG ALA 271.A O no hydrogen 2.715 N/A TYR 276.A N LYS 272.A O no hydrogen 3.114 N/A SER 277.A N GLU 273.A O no hydrogen 2.898 N/A SER 277.A OG GLU 273.A O no hydrogen 2.850 N/A SER 290.A N PRO 287.A O no hydrogen 2.880 N/A SER 290.A OG PRO 287.A O no hydrogen 2.687 N/A ARG 291.A N SER 288.A O no hydrogen 3.045 N/A ARG 292.A NH1 ASP 128.A OD1 no hydrogen 2.808 N/A ARG 292.A NH2 ASP 128.A OD1 no hydrogen 2.925 N/A THR 295.A N SER 294.A OG no hydrogen 2.799 N/A THR 295.A OG1 SER 294.A O no hydrogen 2.663 N/A LYS 299.A N VAL 457.A O no hydrogen 2.936 N/A LYS 299.A NZ PHE 454.A O no hydrogen 2.781 N/A TRP 302.A N SER 300.A OG no hydrogen 3.429 N/A ILE 304.A N LEU 301.A O no hydrogen 3.278 N/A SER 306.A N ILE 304.A O no hydrogen 3.025 N/A SER 306.A OG ALA 307.A O no hydrogen 3.565 N/A LEU 308.A N ILE 365.A O no hydrogen 2.805 N/A ARG 309.A NE ASP 452.A OD1 no hydrogen 2.969 N/A ARG 309.A NH2 ASP 452.A OD1 no hydrogen 2.930 N/A ILE 310.A N LEU 361.A O no hydrogen 2.988 N/A LYS 311.A N GLU 450.A O no hydrogen 2.824 N/A ILE 312.A N GLU 359.A O no hydrogen 2.922 N/A LEU 313.A N GLU 448.A O no hydrogen 3.041 N/A ALA 315.A N PRO 355.A O no hydrogen 3.028 N/A THR 316.A N CYS 446.A O no hydrogen 2.951 N/A ASP 324.A N ASN 321.A O no hydrogen 3.066 N/A ILE 325.A N ASN 321.A O no hydrogen 3.221 N/A ASP 326.A N VAL 383.A O no hydrogen 3.189 N/A LYS 327.A N VAL 383.A O no hydrogen 3.205 N/A ILE 328.A N VAL 350.A O no hydrogen 2.843 N/A TYR 329.A N CYS 381.A O no hydrogen 3.071 N/A TYR 329.A OH HIS 393.A ND1 no hydrogen 2.844 N/A VAL 330.A N THR 347.A OG1 no hydrogen 2.892 N/A ARG 331.A N SER 379.A O no hydrogen 2.801 N/A ARG 331.A NH1 ASN 346.A OD1 no hydrogen 2.871 N/A THR 332.A N VAL 345.A O no hydrogen 3.160 N/A THR 332.A OG1 VAL 345.A O no hydrogen 2.801 N/A THR 332.A OG1 TYR 363.A OH no hydrogen 2.707 N/A GLY 333.A N CYS 377.A O no hydrogen 2.757 N/A TYR 335.A N ARG 375.A O no hydrogen 2.896 N/A HIS 336.A N GLU 339.A O no hydrogen 2.919 N/A GLU 339.A N HIS 336.A O no hydrogen 3.265 N/A LEU 341.A N ILE 334.A O no hydrogen 2.757 N/A CYS 342.A SG ASP 343.A O no hydrogen 3.992 N/A ASN 344.A N ASP 343.A OD1 no hydrogen 2.993 N/A ASN 344.A ND2 TYR 335.A OH no hydrogen 3.399 N/A THR 347.A N VAL 330.A O no hydrogen 2.987 N/A THR 347.A OG1 GLN 348.A O no hydrogen 3.238 N/A GLN 348.A N GLU 359.A OE1 no hydrogen 2.929 N/A ARG 349.A NH2 GLU 391.A OE2 no hydrogen 2.948 N/A VAL 350.A N ILE 328.A O no hydrogen 2.970 N/A CYS 352.A SG ILE 325.A O no hydrogen 3.941 N/A CYS 352.A SG ASP 326.A O no hydrogen 3.898 N/A ASN 354.A N PRO 351.A O no hydrogen 2.935 N/A TRP 357.A N LEU 313.A O no hydrogen 2.799 N/A ASN 358.A N LEU 313.A O no hydrogen 2.995 N/A GLU 359.A N ILE 312.A O no hydrogen 3.162 N/A LEU 361.A N ILE 310.A O no hydrogen 2.752 N/A TYR 363.A N LEU 308.A O no hydrogen 2.890 N/A TYR 363.A OH THR 332.A OG1 no hydrogen 2.707 N/A ILE 365.A N TYR 363.A O no hydrogen 2.754 N/A TYR 366.A OH ASN 305.A OD1 no hydrogen 2.703 N/A ILE 367.A N SER 306.A O no hydrogen 3.072 N/A ASP 369.A N TYR 366.A O no hydrogen 2.727 N/A LEU 370.A N ILE 367.A O no hydrogen 3.055 N/A ARG 372.A NE ASP 408.A OD1 no hydrogen 3.429 N/A ARG 372.A NH1 ARG 372.A O no hydrogen 2.899 N/A ARG 372.A NH1 TYR 590.A OH no hydrogen 2.812 N/A ARG 372.A NH2 ASP 408.A OD1 no hydrogen 2.921 N/A ARG 372.A NH2 TYR 590.A OH no hydrogen 3.398 N/A ALA 374.A N PRO 371.A O no hydrogen 3.351 N/A ARG 375.A N TYR 335.A O no hydrogen 2.904 N/A ARG 375.A NH1 PRO 432.A O no hydrogen 2.994 N/A ARG 375.A NH2 PRO 432.A O no hydrogen 2.752 N/A LEU 376.A N ILE 401.A O no hydrogen 2.836 N/A CYS 377.A N GLY 333.A O no hydrogen 2.904 N/A LEU 378.A N GLY 399.A O no hydrogen 2.881 N/A SER 379.A N ARG 331.A O no hydrogen 2.901 N/A SER 379.A OG LEU 429.A O no hydrogen 2.858 N/A ILE 380.A N ALA 397.A O no hydrogen 3.004 N/A CYS 381.A N TYR 329.A O no hydrogen 2.887 N/A CYS 381.A SG SER 379.A OG no hydrogen 3.175 N/A SER 382.A N CYS 394.A O.A no hydrogen 2.885 N/A SER 382.A N CYS 394.A O.B no hydrogen 2.900 N/A SER 382.A OG CYS 394.A O.A no hydrogen 3.508 N/A SER 382.A OG CYS 394.A O.B no hydrogen 3.494 N/A VAL 383.A N LYS 327.A O no hydrogen 2.922 N/A LYS 384.A N GLU 392.A O no hydrogen 3.088 N/A GLY 385.A N ASP 326.A OD2 no hydrogen 2.784 N/A LYS 390.A N LYS 387.A O no hydrogen 2.965 N/A GLU 392.A N LYS 384.A O no hydrogen 2.993 N/A HIS 393.A ND1 TYR 329.A OH no hydrogen 2.844 N/A CYS 394.A N.A SER 382.A O no hydrogen 3.117 N/A CYS 394.A N.B SER 382.A O no hydrogen 3.117 N/A CYS 394.A SG.A HIS 393.A O no hydrogen 3.372 N/A CYS 394.A SG.B PRO 395.A O no hydrogen 3.391 N/A LEU 396.A N ILE 380.A O no hydrogen 2.812 N/A TRP 398.A N TRP 420.A O no hydrogen 3.153 N/A TRP 398.A NE1 PRO 421.A O no hydrogen 2.889 N/A GLY 399.A N LEU 378.A O no hydrogen 3.019 N/A ASN 400.A ND2 ASN 431.A O no hydrogen 2.776 N/A ASN 400.A ND2 GLY 434.A O no hydrogen 2.811 N/A ASN 400.A ND2 VAL 435.A O no hydrogen 3.638 N/A ILE 401.A N LEU 376.A O no hydrogen 2.905 N/A ASN 402.A ND2 GLN 589.A O no hydrogen 2.806 N/A LEU 403.A N ALA 374.A O no hydrogen 3.143 N/A ASP 405.A N THR 409.A O no hydrogen 3.073 N/A TYR 406.A OH ASP 137.A OD2 no hydrogen 3.000 N/A THR 407.A N ASP 405.A OD1 no hydrogen 3.059 N/A THR 407.A OG1 ASP 405.A OD1 no hydrogen 2.668 N/A THR 407.A OG1 ASP 405.A OD2 no hydrogen 3.368 N/A THR 407.A OG1 THR 409.A OG1 no hydrogen 3.014 N/A ASP 408.A N ASP 405.A O no hydrogen 2.889 N/A THR 409.A N ASP 405.A OD1 no hydrogen 2.897 N/A THR 409.A OG1 ASP 405.A OD1 no hydrogen 3.428 N/A THR 409.A OG1 THR 407.A OG1 no hydrogen 3.014 N/A LEU 410.A N VAL 458.A O no hydrogen 2.775 N/A VAL 411.A N LEU 403.A O no hydrogen 2.851 N/A SER 412.A OG ASP 452.A O no hydrogen 3.438 N/A MET 415.A N LEU 449.A O no hydrogen 2.949 N/A LEU 417.A N LEU 447.A O no hydrogen 2.899 N/A ASN 418.A N SER 438.A OG no hydrogen 3.135 N/A LEU 419.A N PRO 445.A O no hydrogen 2.812 N/A TRP 420.A N TRP 398.A O no hydrogen 2.854 N/A TRP 420.A NE1 GLY 437.A O no hydrogen 3.221 N/A LEU 426.A N PRO 423.A O no hydrogen 2.957 N/A GLY 434.A N ASN 431.A O no hydrogen 3.058 N/A GLY 437.A N ASN 400.A O no hydrogen 2.959 N/A ASN 439.A N ASN 418.A O no hydrogen 2.921 N/A ASN 439.A ND2 LEU 419.A O no hydrogen 3.169 N/A ASN 441.A N ASN 439.A OD1 no hydrogen 2.865 N/A LYS 442.A NZ ASN 439.A O no hydrogen 2.788 N/A GLU 443.A N ASN 441.A OD1 no hydrogen 3.117 N/A THR 444.A OG1 ASN 418.A OD1 no hydrogen 3.078 N/A THR 444.A OG1 ASN 441.A O no hydrogen 2.722 N/A CYS 446.A N THR 316.A OG1 no hydrogen 2.972 N/A CYS 446.A SG GLU 448.A OE2 no hydrogen 3.664 N/A LEU 447.A N LEU 417.A O no hydrogen 2.795 N/A GLU 448.A N CYS 314.A O no hydrogen 2.711 N/A LEU 449.A N MET 415.A O no hydrogen 2.704 N/A GLU 450.A N LYS 311.A O no hydrogen 2.987 N/A PHE 451.A N GLY 413.A O no hydrogen 2.970 N/A SER 455.A OG PHE 454.A O no hydrogen 2.741 N/A SER 456.A OG SER 297.A O no hydrogen 2.721 N/A SER 456.A OG VAL 457.A O no hydrogen 3.343 N/A VAL 457.A N SER 297.A O no hydrogen 3.298 N/A LYS 459.A N LYS 299.A O no hydrogen 2.883 N/A LYS 459.A NZ THR 407.A O no hydrogen 2.753 N/A LYS 459.A NZ THR 409.A OG1 no hydrogen 3.123 N/A PHE 460.A N ASP 408.A O no hydrogen 2.894 N/A ILE 466.A N ASP 462.A O no hydrogen 3.174 N/A GLU 467.A N MET 463.A O no hydrogen 3.215 N/A GLU 468.A N ILE 466.A O no hydrogen 2.693 N/A LEU 477.A N ASP 473.A O no hydrogen 3.065 N/A LYS 478.A N LYS 474.A O no hydrogen 3.406 N/A ALA 479.A N GLU 475.A O no hydrogen 3.239 N/A ILE 480.A N GLN 476.A O no hydrogen 3.042 N/A SER 481.A N LEU 477.A O no hydrogen 3.047 N/A SER 481.A OG LYS 478.A O no hydrogen 2.791 N/A THR 482.A N LYS 478.A O no hydrogen 3.087 N/A THR 482.A OG1 LYS 478.A O no hydrogen 3.569 N/A THR 482.A OG1 ALA 479.A O no hydrogen 2.735 N/A ARG 483.A N ILE 480.A O no hydrogen 3.318 N/A LEU 486.A N ASP 484.A OD2 no hydrogen 3.305 N/A SER 487.A N ASP 484.A O no hydrogen 3.082 N/A SER 487.A OG ASP 484.A O no hydrogen 3.163 N/A THR 490.A N GLU 493.A OE1 no hydrogen 3.060 N/A THR 490.A OG1 GLN 492.A OE1 no hydrogen 3.518 N/A THR 490.A OG1 GLU 493.A OE1 no hydrogen 3.151 N/A GLU 493.A N THR 490.A OG1 no hydrogen 3.050 N/A LYS 494.A N THR 490.A O no hydrogen 2.833 N/A LYS 494.A NZ GLU 491.A OE2 no hydrogen 2.979 N/A ASP 495.A N GLU 491.A O no hydrogen 2.987 N/A PHE 496.A N GLN 492.A O no hydrogen 2.889 N/A LEU 497.A N GLU 493.A O no hydrogen 2.799 N/A TRP 498.A N LYS 494.A O no hydrogen 2.768 N/A SER 499.A N ASP 495.A O no hydrogen 3.057 N/A SER 499.A OG ASP 495.A O no hydrogen 2.748 N/A HIS 500.A N PHE 496.A O no hydrogen 3.029 N/A HIS 500.A ND1 PHE 496.A O no hydrogen 2.737 N/A ARG 501.A N TRP 498.A O no hydrogen 3.409 N/A ARG 501.A NH1 TRP 498.A O no hydrogen 2.772 N/A ARG 501.A NH2 GLN 528.A OE1 no hydrogen 2.729 N/A CYS 504.A N HIS 500.A O no hydrogen 2.979 N/A CYS 504.A SG LEU 497.A O no hydrogen 3.829 N/A CYS 504.A SG HIS 500.A O no hydrogen 3.482 N/A THR 506.A N TYR 503.A O no hydrogen 2.970 N/A THR 506.A OG1 TYR 503.A O no hydrogen 2.750 N/A ILE 507.A N CYS 504.A O no hydrogen 3.087 N/A GLU 509.A N GLU 509.A OE1 no hydrogen 3.152 N/A ILE 510.A N ILE 507.A O no hydrogen 3.204 N/A LEU 511.A N PRO 508.A O no hydrogen 3.040 N/A LYS 513.A NZ ILE 480.A O no hydrogen 3.489 N/A LYS 513.A NZ ARG 483.A O no hydrogen 2.745 N/A LYS 513.A NZ ASP 484.A O no hydrogen 3.428 N/A LEU 514.A N ILE 510.A O no hydrogen 2.895 N/A LEU 515.A N LEU 511.A O no hydrogen 2.817 N/A LEU 516.A N PRO 512.A O no hydrogen 3.283 N/A SER 517.A N LEU 514.A O no hydrogen 2.934 N/A SER 517.A OG LYS 513.A O no hydrogen 2.934 N/A LYS 519.A N GLU 525.A OE1 no hydrogen 3.111 N/A TRP 520.A NE1 LEU 515.A O no hydrogen 2.812 N/A ASN 521.A ND2 LEU 341.A O no hydrogen 3.029 N/A ARG 523.A N ASP 369.A OD1 no hydrogen 2.773 N/A GLU 525.A N SER 522.A OG no hydrogen 3.369 N/A VAL 526.A N SER 522.A O no hydrogen 3.194 N/A ALA 527.A N ARG 523.A O no hydrogen 3.201 N/A GLN 528.A NE2 ASP 524.A O no hydrogen 3.279 N/A MET 529.A N GLU 525.A O no hydrogen 3.050 N/A TYR 530.A N VAL 526.A O no hydrogen 2.816 N/A TYR 530.A OH ASP 554.A OD1 no hydrogen 2.969 N/A TYR 530.A OH ASP 554.A OD2 no hydrogen 3.201 N/A CYS 531.A SG ALA 527.A O no hydrogen 3.462 N/A LEU 532.A N GLN 528.A O no hydrogen 3.312 N/A VAL 533.A N MET 529.A O no hydrogen 3.072 N/A LYS 534.A N TYR 530.A O no hydrogen 3.279 N/A LYS 534.A NZ GLU 467.A OE2 no hydrogen 3.247 N/A TRP 536.A N VAL 533.A O no hydrogen 3.189 N/A TRP 536.A NE1 PRO 508.A O no hydrogen 3.114 N/A LYS 540.A N GLN 543.A OE1 no hydrogen 3.351 N/A GLN 543.A N LYS 540.A O no hydrogen 2.916 N/A ALA 544.A N LYS 540.A O no hydrogen 2.936 N/A MET 545.A N PRO 541.A O no hydrogen 3.099 N/A GLU 546.A N GLN 543.A O no hydrogen 3.222 N/A LEU 547.A N ALA 544.A O no hydrogen 2.993 N/A LEU 548.A N MET 545.A O no hydrogen 3.054 N/A ASP 549.A N GLU 546.A O no hydrogen 3.090 N/A ASN 551.A N ASP 549.A OD1 no hydrogen 2.866 N/A TYR 552.A N ASP 549.A O no hydrogen 3.249 N/A TYR 552.A OH PRO 512.A O no hydrogen 3.185 N/A TYR 552.A OH GLU 546.A OE2 no hydrogen 3.258 N/A MET 556.A N ASP 554.A OD2 no hydrogen 3.193 N/A ARG 558.A N ASP 554.A O no hydrogen 2.912 N/A ARG 558.A NE GLU 588.A OE2 no hydrogen 2.909 N/A ARG 558.A NH1 LEU 548.A O no hydrogen 2.983 N/A ARG 558.A NH1 ASP 549.A O no hydrogen 3.097 N/A ARG 558.A NH1 TYR 552.A O no hydrogen 2.813 N/A ARG 558.A NH2 LEU 548.A O no hydrogen 2.787 N/A ARG 558.A NH2 GLU 588.A OE2 no hydrogen 2.921 N/A GLY 559.A N PRO 555.A O no hydrogen 2.884 N/A PHE 560.A N MET 556.A O no hydrogen 2.803 N/A ALA 561.A N VAL 557.A O no hydrogen 2.970 N/A VAL 562.A N ARG 558.A O no hydrogen 2.949 N/A ARG 563.A N GLY 559.A O no hydrogen 3.247 N/A CYS 564.A N PHE 560.A O no hydrogen 3.342 N/A CYS 564.A SG PHE 560.A O no hydrogen 3.360 N/A LEU 565.A N ALA 561.A O no hydrogen 3.329 N/A GLU 566.A N VAL 562.A O no hydrogen 2.820 N/A LYS 567.A N ARG 563.A O no hydrogen 3.123 N/A TYR 568.A N CYS 564.A O no hydrogen 2.801 N/A LEU 569.A N LEU 565.A O no hydrogen 3.038 N/A THR 570.A OG1 SER 172.A OG no hydrogen 2.672 N/A LEU 574.A N THR 570.A O no hydrogen 2.906 N/A SER 575.A N ASP 571.A O no hydrogen 2.879 N/A SER 575.A OG ASP 571.A O no hydrogen 3.178 N/A GLN 576.A N ASP 572.A O no hydrogen 2.907 N/A TYR 577.A N LYS 573.A O no hydrogen 2.892 N/A TYR 577.A OH GLU 542.A OE2 no hydrogen 2.793 N/A GLN 580.A NE2 GLN 761.A OE1 no hydrogen 2.745 N/A LEU 581.A N TYR 577.A O no hydrogen 3.078 N/A VAL 582.A N LEU 578.A O no hydrogen 2.901 N/A GLN 583.A N ILE 579.A O no hydrogen 3.184 N/A GLN 583.A NE2 GLU 620.A OE1 no hydrogen 2.845 N/A VAL 584.A N GLN 580.A O no hydrogen 3.064 N/A LEU 585.A N VAL 582.A O no hydrogen 3.338 N/A LYS 586.A N GLN 583.A O no hydrogen 3.189 N/A LYS 586.A NZ GLN 583.A OE1 no hydrogen 3.098 N/A LYS 586.A NZ GLU 620.A OE1 no hydrogen 3.162 N/A LYS 586.A NZ GLU 620.A OE2 no hydrogen 2.776 N/A TYR 587.A N VAL 584.A O no hydrogen 2.862 N/A TYR 587.A OH SER 942.A O no hydrogen 3.384 N/A GLN 589.A NE2 ASN 402.A OD1 no hydrogen 2.882 N/A TYR 590.A OH PHE 404.A O no hydrogen 2.640 N/A LEU 591.A N GLU 134.A OE2 no hydrogen 3.031 N/A ASN 593.A ND2 TYR 590.A O no hydrogen 2.817 N/A VAL 596.A N ASN 593.A OD1 no hydrogen 2.775 N/A ARG 597.A N ASN 593.A O no hydrogen 3.429 N/A ARG 597.A NH1 ASP 592.A OD1 no hydrogen 2.918 N/A ARG 597.A NH2 ASN 141.A O no hydrogen 3.294 N/A ARG 597.A NH2 ASN 144.A OD1 no hydrogen 3.262 N/A PHE 598.A N LEU 594.A O no hydrogen 3.179 N/A LEU 599.A N LEU 595.A O no hydrogen 2.989 N/A LEU 600.A N VAL 596.A O no hydrogen 3.000 N/A LYS 601.A N ARG 597.A O no hydrogen 2.939 N/A LYS 602.A N PHE 598.A O no hydrogen 2.995 N/A LYS 602.A NZ ASP 571.A OD1 no hydrogen 3.250 N/A ALA 603.A N LEU 599.A O no hydrogen 2.823 N/A LEU 604.A N LEU 600.A O no hydrogen 2.864 N/A THR 605.A N LYS 602.A O no hydrogen 3.130 N/A THR 605.A OG1 LYS 601.A O no hydrogen 2.710 N/A THR 605.A OG1 LYS 602.A O no hydrogen 3.393 N/A ASN 606.A ND2 ASP 571.A OD2 no hydrogen 3.103 N/A GLN 607.A N TYR 164.A O no hydrogen 2.985 N/A ARG 608.A NE SER 575.A OG no hydrogen 3.361 N/A ILE 609.A N ASN 606.A OD1 no hydrogen 3.291 N/A GLY 610.A N ASN 606.A O no hydrogen 2.812 N/A HIS 611.A N GLN 607.A O no hydrogen 2.886 N/A HIS 611.A ND1 TYR 644.A OH no hydrogen 2.782 N/A HIS 611.A NE2 PRO 700.A O no hydrogen 2.670 N/A PHE 613.A N ILE 609.A O no hydrogen 2.885 N/A PHE 614.A N GLY 610.A O no hydrogen 2.966 N/A TRP 615.A N HIS 611.A O no hydrogen 3.129 N/A TRP 615.A NE1 GLN 651.A OE1 no hydrogen 2.940 N/A HIS 616.A N PHE 612.A O no hydrogen 2.799 N/A LEU 617.A N PHE 613.A O no hydrogen 3.231 N/A LYS 618.A N PHE 614.A O no hydrogen 2.771 N/A SER 619.A N TRP 615.A O no hydrogen 2.954 N/A SER 619.A OG TRP 615.A O no hydrogen 3.453 N/A SER 619.A OG HIS 616.A O no hydrogen 2.931 N/A GLU 620.A N LEU 617.A O no hydrogen 3.276 N/A MET 621.A N LYS 618.A O no hydrogen 3.249 N/A ASN 623.A N GLU 620.A O no hydrogen 2.989 N/A THR 625.A N ASN 623.A OD1 no hydrogen 2.987 N/A THR 625.A OG1 ASN 623.A OD1 no hydrogen 2.709 N/A VAL 626.A N ASN 623.A O no hydrogen 3.050 N/A SER 627.A N ASN 623.A O no hydrogen 2.921 N/A ARG 629.A NH1 TYR 590.A O no hydrogen 3.221 N/A PHE 630.A N VAL 626.A O no hydrogen 2.763 N/A GLY 631.A N SER 627.A O no hydrogen 2.898 N/A LEU 632.A N GLN 628.A O no hydrogen 3.163 N/A LEU 633.A N ARG 629.A O no hydrogen 3.140 N/A LEU 634.A N PHE 630.A O no hydrogen 2.936 N/A GLU 635.A N GLY 631.A O no hydrogen 2.835 N/A SER 636.A N LEU 632.A O no hydrogen 3.238 N/A SER 636.A OG LEU 632.A O no hydrogen 3.492 N/A SER 636.A OG LEU 633.A O no hydrogen 2.721 N/A TYR 637.A N LEU 633.A O no hydrogen 2.996 N/A CYS 638.A N LEU 634.A O no hydrogen 2.837 N/A CYS 638.A SG LEU 634.A O no hydrogen 3.262 N/A ARG 639.A N GLU 635.A O no hydrogen 2.869 N/A ARG 639.A NH1 ASN 113.A OD1 no hydrogen 3.467 N/A ARG 639.A NH2 ASN 113.A OD1 no hydrogen 2.765 N/A ARG 639.A NH2 GLU 635.A OE2 no hydrogen 2.839 N/A ALA 640.A N TYR 637.A O no hydrogen 3.061 N/A CYS 641.A SG CYS 638.A O no hydrogen 3.731 N/A MET 643.A N ASP 282.A OD1 no hydrogen 2.909 N/A TYR 644.A OH HIS 611.A ND1 no hydrogen 2.782 N/A LEU 645.A N GLY 642.A O no hydrogen 3.352 N/A LYS 646.A N MET 643.A O no hydrogen 3.036 N/A LEU 648.A N TYR 644.A O no hydrogen 2.820 N/A ASN 649.A N LEU 645.A O no hydrogen 2.906 N/A ASN 649.A ND2 GLU 115.A O no hydrogen 3.138 N/A ARG 650.A N LYS 646.A O no hydrogen 3.233 N/A ARG 650.A NE GLY 696.A O no hydrogen 3.011 N/A ARG 650.A NH1 ASP 692.A O no hydrogen 3.448 N/A ARG 650.A NH2 ASP 692.A O no hydrogen 2.782 N/A GLN 651.A N HIS 647.A O no hydrogen 3.183 N/A GLN 651.A NE2 TYR 644.A OH no hydrogen 3.085 N/A VAL 652.A N LEU 648.A O no hydrogen 2.904 N/A GLU 653.A N ASN 649.A O no hydrogen 2.958 N/A ALA 654.A N ARG 650.A O no hydrogen 3.180 N/A MET 655.A N GLN 651.A O no hydrogen 3.110 N/A GLU 656.A N VAL 652.A O no hydrogen 3.125 N/A GLU 656.A N GLU 653.A O no hydrogen 3.092 N/A LYS 657.A N GLU 653.A O no hydrogen 3.196 N/A LYS 657.A NZ ASP 90.A OD1 no hydrogen 2.796 N/A LYS 657.A NZ ASP 689.A OD2 no hydrogen 3.048 N/A LEU 658.A N ALA 654.A O no hydrogen 3.232 N/A ILE 659.A N MET 655.A O no hydrogen 3.028 N/A ASN 660.A N GLU 656.A O no hydrogen 2.990 N/A ASN 660.A ND2 HIS 13.A O no hydrogen 2.802 N/A LEU 661.A N LYS 657.A O no hydrogen 3.111 N/A THR 662.A N LEU 658.A O no hydrogen 2.995 N/A THR 662.A OG1 LEU 658.A O no hydrogen 2.935 N/A THR 662.A OG1 ILE 659.A O no hydrogen 3.123 N/A ASP 663.A N ILE 659.A O no hydrogen 2.853 N/A ILE 664.A N ASN 660.A O no hydrogen 2.926 N/A LEU 665.A N LEU 661.A O no hydrogen 3.196 N/A LYS 666.A N THR 662.A O no hydrogen 2.881 N/A LYS 666.A NZ ASN 749.A OD1 no hydrogen 3.552 N/A GLN 667.A N ASP 663.A O no hydrogen 2.936 N/A LYS 669.A N ILE 664.A O no hydrogen 2.932 N/A LYS 670.A NZ GLN 667.A O no hydrogen 3.540 N/A GLU 672.A N LYS 669.A O no hydrogen 3.211 N/A GLN 674.A NE2 ILE 717.A O no hydrogen 2.810 N/A GLN 677.A N THR 673.A O no hydrogen 2.985 N/A GLN 677.A NE2 GLU 672.A O no hydrogen 2.928 N/A GLN 677.A NE2 THR 673.A O no hydrogen 3.662 N/A MET 678.A N GLN 674.A O no hydrogen 2.745 N/A LYS 679.A N LYS 675.A O no hydrogen 2.869 N/A PHE 680.A N VAL 676.A O no hydrogen 3.146 N/A LEU 681.A N GLN 677.A O no hydrogen 2.831 N/A VAL 682.A N MET 678.A O no hydrogen 2.949 N/A GLU 683.A N LYS 679.A O no hydrogen 3.020 N/A GLN 684.A N PHE 680.A O no hydrogen 2.990 N/A MET 685.A N LEU 681.A O no hydrogen 2.891 N/A ARG 687.A N GLN 684.A O no hydrogen 3.127 N/A ARG 687.A NE GLN 684.A OE1 no hydrogen 3.395 N/A MET 691.A N ARG 687.A O no hydrogen 2.790 N/A ASP 692.A N PRO 688.A O no hydrogen 2.768 N/A LEU 694.A N PHE 690.A O no hydrogen 2.981 N/A GLN 695.A NE2 MET 691.A O no hydrogen 3.535 N/A GLY 696.A N GLY 708.A O no hydrogen 3.205 N/A PHE 697.A N LEU 707.A O no hydrogen 3.027 N/A SER 699.A N HIS 705.A O no hydrogen 2.835 N/A LEU 701.A N SER 699.A OG no hydrogen 3.277 N/A ASN 702.A N SER 699.A O no hydrogen 3.128 N/A ALA 704.A N ASN 702.A OD1 no hydrogen 3.182 N/A HIS 705.A N ASN 702.A O no hydrogen 2.918 N/A LEU 707.A N PHE 697.A O no hydrogen 2.811 N/A GLY 708.A N GLU 730.A O no hydrogen 2.997 N/A LEU 710.A N GLN 695.A OE1 no hydrogen 2.809 N/A ARG 711.A N ASN 728.A O no hydrogen 3.173 N/A ARG 711.A NH1 ASN 728.A OD1 no hydrogen 3.223 N/A ARG 711.A NH1 GLN 741.A O no hydrogen 3.218 N/A GLU 713.A N GLU 713.A OE1 no hydrogen 2.876 N/A GLU 714.A N ARG 711.A O no hydrogen 2.852 N/A CYS 715.A N LEU 712.A O no hydrogen 3.423 N/A CYS 715.A SG ARG 711.A O no hydrogen 3.719 N/A CYS 715.A SG ASN 728.A O no hydrogen 4.025 N/A ARG 716.A N TRP 726.A O no hydrogen 2.957 N/A MET 718.A N PRO 724.A O no hydrogen 2.759 N/A ARG 723.A N SER 720.A O no hydrogen 2.927 N/A ARG 723.A NH2 MET 718.A O no hydrogen 3.477 N/A LEU 725.A N PHE 747.A O no hydrogen 2.957 N/A TRP 726.A N ARG 716.A O no hydrogen 2.765 N/A TRP 726.A NE1 GLU 744.A OE2 no hydrogen 2.982 N/A LEU 727.A N ILE 745.A O no hydrogen 2.915 N/A ASN 728.A ND2 ASN 742.A OD1 no hydrogen 3.481 N/A TRP 729.A N ASN 743.A O no hydrogen 3.245 N/A TRP 729.A NE1 LEU 694.A O no hydrogen 2.748 N/A GLU 730.A N ASN 709.A O no hydrogen 2.772 N/A ASN 731.A N GLN 741.A O no hydrogen 3.060 N/A ASN 731.A ND2 GLY 238.A O no hydrogen 2.769 N/A ASN 731.A ND2 PHE 740.A O no hydrogen 3.003 N/A ASP 733.A N ASN 731.A OD1 no hydrogen 3.184 N/A MET 735.A N ASP 733.A OD2 no hydrogen 3.291 N/A SER 736.A N ASP 733.A O no hydrogen 3.375 N/A SER 736.A OG ASN 731.A O no hydrogen 3.472 N/A SER 736.A OG ASP 733.A O no hydrogen 3.365 N/A SER 736.A OG GLN 741.A OE1 no hydrogen 2.673 N/A GLU 737.A N GLU 737.A OE1 no hydrogen 2.899 N/A LEU 738.A N MET 735.A O no hydrogen 3.114 N/A LEU 739.A N SER 736.A O no hydrogen 2.997 N/A PHE 740.A N SER 736.A O no hydrogen 2.863 N/A ASN 743.A N TRP 729.A O no hydrogen 3.009 N/A ASN 743.A ND2 HIS 705.A ND1 no hydrogen 3.573 N/A ILE 745.A N LEU 727.A O no hydrogen 2.880 N/A ILE 746.A N ILE 794.A O no hydrogen 2.913 N/A PHE 747.A N LEU 725.A O no hydrogen 2.796 N/A LYS 748.A N GLY 792.A O no hydrogen 2.834 N/A ASN 749.A ND2 ILE 659.A O no hydrogen 3.571 N/A ASN 749.A ND2 THR 662.A OG1 no hydrogen 2.876 N/A ASN 749.A ND2 ASP 663.A OD1 no hydrogen 2.786 N/A GLY 750.A N CYS 790.A O no hydrogen 2.798 N/A ARG 754.A N ASP 752.A OD1 no hydrogen 3.311 N/A ARG 754.A NE ASP 752.A OD1 no hydrogen 3.018 N/A ARG 754.A NE ASP 752.A OD2 no hydrogen 3.297 N/A ARG 754.A NH2 ASP 752.A OD2 no hydrogen 3.036 N/A ARG 754.A NH2 GLY 948.A O no hydrogen 3.428 N/A GLN 755.A NE2 GLU 951.A OE1 no hydrogen 3.067 N/A MET 757.A N LEU 753.A O no hydrogen 2.990 N/A LEU 758.A N ARG 754.A O no hydrogen 3.063 N/A THR 759.A N GLN 755.A O no hydrogen 2.933 N/A THR 759.A OG1 GLN 755.A O no hydrogen 2.908 N/A LEU 760.A N ASP 756.A O no hydrogen 2.848 N/A GLN 761.A N MET 757.A O no hydrogen 3.031 N/A GLN 761.A NE2 GLN 576.A O no hydrogen 2.698 N/A GLN 761.A NE2 GLN 580.A OE1 no hydrogen 2.792 N/A ILE 762.A N LEU 758.A O no hydrogen 2.992 N/A ILE 763.A N THR 759.A O no hydrogen 3.084 N/A ARG 764.A N LEU 760.A O no hydrogen 3.289 N/A ARG 764.A NH2 PRO 781.A O no hydrogen 2.817 N/A ILE 765.A N GLN 761.A O no hydrogen 3.039 N/A MET 766.A N ILE 762.A O no hydrogen 2.769 N/A GLU 767.A N ILE 763.A O no hydrogen 2.804 N/A ASN 768.A N ARG 764.A O no hydrogen 2.960 N/A ILE 769.A N ILE 765.A O no hydrogen 2.999 N/A TRP 770.A N MET 766.A O no hydrogen 3.075 N/A TRP 770.A NE1 ALA 926.A O no hydrogen 3.090 N/A GLN 771.A N GLU 767.A O no hydrogen 3.009 N/A ASN 772.A N ASN 768.A O no hydrogen 3.081 N/A GLN 773.A N ILE 769.A O no hydrogen 2.972 N/A GLN 773.A N TRP 770.A O no hydrogen 3.248 N/A GLN 773.A NE2 GLN 932.A OE1 no hydrogen 3.077 N/A GLY 774.A N GLN 771.A O no hydrogen 3.107 N/A LEU 775.A N TRP 770.A O no hydrogen 2.687 N/A ARG 778.A NH2 ASP 776.A OD2 no hydrogen 3.357 N/A MET 779.A N GLU 767.A OE2 no hydrogen 2.936 N/A LEU 780.A N TYR 843.A OH no hydrogen 2.834 N/A TYR 782.A N LEU 780.A O no hydrogen 2.894 N/A GLY 783.A N GLU 795.A OE1 no hydrogen 2.784 N/A CYS 784.A SG LEU 793.A O no hydrogen 4.004 N/A LEU 785.A N LEU 793.A O no hydrogen 2.988 N/A SER 786.A OG GLY 788.A O no hydrogen 3.317 N/A ILE 787.A N VAL 791.A O no hydrogen 2.933 N/A CYS 790.A SG ASP 789.A OD1 no hydrogen 3.584 N/A GLY 792.A N LYS 748.A O no hydrogen 2.950 N/A LEU 793.A N LEU 785.A O no hydrogen 3.047 N/A ILE 794.A N ILE 746.A O no hydrogen 2.853 N/A GLU 795.A N GLY 783.A O no hydrogen 2.760 N/A VAL 796.A N GLU 744.A O no hydrogen 3.349 N/A ARG 798.A NH1 GLU 744.A OE1 no hydrogen 2.960 N/A SER 800.A OG VAL 797.A O no hydrogen 3.139 N/A HIS 801.A N VAL 862.A O no hydrogen 3.002 N/A THR 802.A N GLN 805.A OE1 no hydrogen 3.098 N/A ILE 803.A N ILE 860.A O no hydrogen 3.008 N/A MET 804.A N ASN 857.A O no hydrogen 2.954 N/A GLN 805.A N THR 802.A OG1 no hydrogen 3.161 N/A ILE 806.A N THR 802.A O no hydrogen 3.088 N/A GLN 807.A N ILE 803.A O no hydrogen 2.748 N/A CYS 808.A N MET 804.A O no hydrogen 2.957 N/A CYS 808.A SG MET 804.A O no hydrogen 3.230 N/A ASN 812.A N THR 815.A OG1 no hydrogen 2.861 N/A HIS 814.A N ASN 812.A OD1 no hydrogen 2.990 N/A THR 815.A OG1 ASN 812.A O no hydrogen 2.937 N/A THR 815.A OG1 ASN 812.A OD1 no hydrogen 3.470 N/A HIS 817.A NE2 TYR 829.A OH no hydrogen 2.673 N/A GLN 818.A N HIS 814.A O no hydrogen 2.789 N/A GLN 818.A NE2 GLN 818.A O no hydrogen 3.239 N/A GLN 818.A NE2 ASP 822.A OD1 no hydrogen 2.822 N/A TRP 819.A N THR 815.A O no hydrogen 2.904 N/A LEU 820.A N LEU 816.A O no hydrogen 3.082 N/A LYS 821.A N HIS 817.A O no hydrogen 3.029 N/A ASP 822.A N GLN 818.A O no hydrogen 2.955 N/A LYS 823.A N TRP 819.A O no hydrogen 3.128 N/A LYS 823.A NZ ASP 864.A OD1 no hydrogen 3.470 N/A ASN 824.A N LYS 821.A O no hydrogen 3.171 N/A ASN 824.A ND2 LEU 820.A O no hydrogen 3.172 N/A ASN 824.A ND2 ASP 864.A O no hydrogen 2.814 N/A TYR 829.A N GLY 826.A O no hydrogen 3.236 N/A TYR 829.A OH HIS 817.A NE2 no hydrogen 2.673 N/A ILE 833.A N TYR 829.A O no hydrogen 3.255 N/A ASP 834.A N ASP 830.A O no hydrogen 2.917 N/A LEU 835.A N ALA 831.A O no hydrogen 2.888 N/A PHE 836.A N ALA 832.A O no hydrogen 3.065 N/A THR 837.A N ILE 833.A O no hydrogen 3.100 N/A THR 837.A OG1 ILE 833.A O no hydrogen 2.709 N/A ARG 838.A N ASP 834.A O no hydrogen 2.949 N/A ARG 838.A NE ASP 834.A OD1 no hydrogen 2.946 N/A ARG 838.A NE ASP 834.A OD2 no hydrogen 3.414 N/A ARG 838.A NH1 ASP 776.A O no hydrogen 3.118 N/A SER 839.A N LEU 835.A O no hydrogen 2.949 N/A SER 839.A OG LEU 835.A O no hydrogen 2.736 N/A SER 839.A OG PHE 836.A O no hydrogen 2.835 N/A CYS 840.A N PHE 836.A O no hydrogen 2.780 N/A ALA 841.A N THR 837.A O no hydrogen 2.994 N/A GLY 842.A N ARG 838.A O no hydrogen 3.216 N/A TYR 843.A N SER 839.A O no hydrogen 3.066 N/A CYS 844.A N CYS 840.A O no hydrogen 3.087 N/A VAL 845.A N ALA 841.A O no hydrogen 2.969 N/A ALA 846.A N GLY 842.A O no hydrogen 2.906 N/A THR 847.A N TYR 843.A O no hydrogen 3.114 N/A THR 847.A OG1 TYR 843.A O no hydrogen 2.698 N/A THR 847.A OG1 CYS 844.A O no hydrogen 3.508 N/A PHE 848.A N CYS 844.A O no hydrogen 3.253 N/A ILE 849.A N VAL 845.A O no hydrogen 2.960 N/A LEU 850.A N ALA 846.A O no hydrogen 2.983 N/A GLY 851.A N THR 847.A O no hydrogen 2.871 N/A ARG 855.A N PRO 892.A O no hydrogen 3.183 N/A ARG 855.A NE GLY 853.A O no hydrogen 3.077 N/A ARG 855.A NH1 ILE 871.A O no hydrogen 2.942 N/A ARG 855.A NH2 GLY 853.A O no hydrogen 3.221 N/A ARG 855.A NH2 ASP 872.A O no hydrogen 2.932 N/A HIS 856.A N ASN 859.A OD1 no hydrogen 2.771 N/A ASN 857.A ND2 GLN 807.A OE1 no hydrogen 3.592 N/A SER 858.A N HIS 856.A ND1 no hydrogen 3.182 N/A ASN 859.A ND2 ASP 854.A O no hydrogen 3.015 N/A MET 861.A N PHE 869.A O no hydrogen 2.870 N/A VAL 862.A N HIS 801.A O no hydrogen 2.870 N/A LYS 863.A N GLN 867.A O no hydrogen 2.791 N/A LYS 863.A NZ GLN 867.A OE1 no hydrogen 3.482 N/A ASP 864.A N ASN 799.A O no hydrogen 2.902 N/A GLY 866.A N LYS 863.A O no hydrogen 2.896 N/A GLN 867.A N ASP 865.A OD1 no hydrogen 3.472 N/A LEU 868.A N SER 839.A OG no hydrogen 3.030 N/A PHE 869.A N MET 861.A O no hydrogen 2.930 N/A ILE 871.A N ASN 859.A O no hydrogen 3.103 N/A ASP 872.A N TYR 782.A OH no hydrogen 3.164 N/A PHE 873.A N ASP 756.A OD2 no hydrogen 2.914 N/A HIS 875.A N PHE 873.A O no hydrogen 2.771 N/A HIS 875.A ND1 GLU 951.A OE2 no hydrogen 2.727 N/A PHE 876.A N GLU 951.A OE1 no hydrogen 2.760 N/A LEU 877.A N LEU 850.A O no hydrogen 2.766 N/A LYS 880.A NZ ASP 854.A OD1 no hydrogen 2.699 N/A LYS 881.A N ASP 878.A O no hydrogen 3.345 N/A LYS 882.A NZ GLY 425.A O no hydrogen 3.467 N/A PHE 884.A N LYS 880.A O no hydrogen 3.048 N/A GLY 885.A N LYS 881.A O no hydrogen 2.838 N/A ARG 890.A NH1 ILE 852.A O no hydrogen 3.492 N/A ARG 890.A NH1 ASP 854.A OD2 no hydrogen 3.409 N/A ARG 890.A NH2 ILE 852.A O no hydrogen 2.843 N/A LEU 895.A N HIS 986.A NE2 no hydrogen 2.909 N/A PHE 899.A N THR 896.A O no hydrogen 2.949 N/A LEU 900.A N THR 896.A O no hydrogen 3.142 N/A ILE 901.A N GLN 897.A O no hydrogen 2.737 N/A ILE 903.A N PHE 899.A O no hydrogen 2.995 N/A SER 904.A N LEU 900.A O no hydrogen 2.842 N/A SER 904.A OG CYS 910.A O no hydrogen 2.744 N/A SER 904.A OG THR 913.A OG1 no hydrogen 2.795 N/A LYS 905.A N VAL 902.A O no hydrogen 3.043 N/A LYS 905.A NZ ASP 830.A OD1 no hydrogen 2.997 N/A GLY 906.A N ILE 901.A O no hydrogen 2.798 N/A ALA 907.A N SER 904.A O no hydrogen 3.193 N/A CYS 910.A SG ALA 907.A O no hydrogen 3.287 N/A CYS 910.A SG GLN 908.A O no hydrogen 3.809 N/A THR 913.A OG1 SER 904.A OG no hydrogen 2.795 N/A THR 913.A OG1 CYS 910.A O no hydrogen 2.714 N/A ARG 914.A NH1 LYS 912.A O no hydrogen 2.749 N/A PHE 916.A N THR 913.A OG1 no hydrogen 3.297 N/A GLU 917.A N THR 913.A O no hydrogen 3.286 N/A ARG 918.A N ARG 914.A O no hydrogen 3.041 N/A ARG 918.A NH1 ASP 834.A OD1 no hydrogen 3.344 N/A ARG 918.A NH2 ASP 834.A OD1 no hydrogen 2.802 N/A PHE 919.A N GLU 915.A O no hydrogen 2.990 N/A GLN 920.A N PHE 916.A O no hydrogen 2.984 N/A GLN 920.A NE2 PHE 916.A O no hydrogen 3.606 N/A GLN 920.A NE2 GLY 989.A O no hydrogen 3.554 N/A GLU 921.A N GLU 917.A O no hydrogen 3.238 N/A MET 922.A N ARG 918.A O no hydrogen 3.108 N/A CYS 923.A N PHE 919.A O no hydrogen 3.233 N/A CYS 923.A SG PHE 919.A O no hydrogen 3.429 N/A TYR 924.A N GLN 920.A O no hydrogen 2.983 N/A TYR 924.A OH THR 991.A O no hydrogen 2.784 N/A LYS 925.A N GLU 921.A O no hydrogen 3.038 N/A ALA 926.A N MET 922.A O no hydrogen 2.945 N/A TYR 927.A N CYS 923.A O no hydrogen 2.869 N/A TYR 927.A OH THR 964.A O no hydrogen 2.617 N/A LEU 928.A N TYR 924.A O no hydrogen 3.128 N/A ALA 929.A N LYS 925.A O no hydrogen 2.983 N/A ILE 930.A N ALA 926.A O no hydrogen 3.182 N/A ARG 931.A N TYR 927.A O no hydrogen 3.086 N/A ARG 931.A NE LEU 965.A O no hydrogen 2.914 N/A ARG 931.A NE ALA 966.A O no hydrogen 3.443 N/A ARG 931.A NH2 ALA 966.A O no hydrogen 2.830 N/A GLN 932.A N LEU 928.A O no hydrogen 3.021 N/A GLN 932.A NE2 GLU 971.A OE1 no hydrogen 3.342 N/A HIS 933.A N ILE 930.A O no hydrogen 2.930 N/A HIS 933.A ND1 ALA 929.A O no hydrogen 2.914 N/A ASN 935.A ND2 ARG 483.A O no hydrogen 3.351 N/A LEU 936.A N HIS 933.A O no hydrogen 3.014 N/A ILE 938.A N ALA 934.A O no hydrogen 2.927 N/A ASN 939.A N ASN 935.A O no hydrogen 2.895 N/A ASN 939.A ND2 GLU 542.A O no hydrogen 3.476 N/A LEU 940.A N LEU 936.A O no hydrogen 2.911 N/A PHE 941.A N PHE 937.A O no hydrogen 3.086 N/A SER 942.A N ILE 938.A O no hydrogen 2.862 N/A SER 942.A OG ILE 938.A O no hydrogen 2.716 N/A MET 943.A N ASN 939.A O no hydrogen 2.860 N/A MET 944.A N PHE 941.A O no hydrogen 3.037 N/A GLY 946.A N TYR 587.A OH no hydrogen 3.159 N/A SER 947.A N MET 944.A O no hydrogen 3.071 N/A LEU 952.A N MET 949.A O no hydrogen 3.422 N/A GLN 953.A N ASP 957.A OD2 no hydrogen 2.895 N/A GLN 953.A NE2 HIS 424.A O no hydrogen 2.983 N/A SER 954.A N ASP 957.A OD2 no hydrogen 3.219 N/A ASP 957.A N SER 954.A O no hydrogen 3.137 N/A ILE 958.A N PHE 955.A O no hydrogen 3.037 N/A ILE 961.A N ILE 958.A O no hydrogen 3.013 N/A ARG 962.A NE ASP 484.A OD2 no hydrogen 2.760 N/A ARG 962.A NH1 ASP 968.A OD2 no hydrogen 3.388 N/A ARG 962.A NH2 ASP 484.A OD1 no hydrogen 2.753 N/A ARG 962.A NH2 ASP 484.A OD2 no hydrogen 3.279 N/A ARG 962.A NH2 ASP 968.A OD1 no hydrogen 3.003 N/A LYS 963.A N ALA 959.A O no hydrogen 3.044 N/A LYS 963.A N TYR 960.A O no hydrogen 3.045 N/A THR 964.A N TYR 960.A O no hydrogen 2.936 N/A THR 964.A OG1 ILE 849.A O no hydrogen 2.877 N/A LEU 965.A N ILE 961.A O no hydrogen 2.899 N/A ALA 966.A N LYS 963.A O no hydrogen 2.850 N/A LEU 967.A N ARG 962.A O no hydrogen 3.008 N/A LYS 969.A N ALA 966.A O no hydrogen 3.340 N/A THR 970.A N GLU 973.A OE2 no hydrogen 3.157 N/A GLU 973.A N THR 970.A OG1 no hydrogen 3.191 N/A ALA 974.A N THR 970.A O no hydrogen 2.802 N/A LEU 975.A N GLU 971.A O no hydrogen 3.142 N/A GLU 976.A N GLN 972.A O no hydrogen 3.215 N/A TYR 977.A N GLU 973.A O no hydrogen 2.989 N/A TYR 977.A OH GLU 889.A OE1 no hydrogen 2.700 N/A PHE 978.A N ALA 974.A O no hydrogen 2.979 N/A MET 979.A N LEU 975.A O no hydrogen 3.052 N/A LYS 980.A N GLU 976.A O no hydrogen 2.969 N/A GLN 981.A N TYR 977.A O no hydrogen 3.006 N/A MET 982.A N PHE 978.A O no hydrogen 2.985 N/A ASN 983.A N MET 979.A O no hydrogen 2.990 N/A ASN 983.A ND2 TRP 990.A O no hydrogen 2.860 N/A ASP 984.A N LYS 980.A O no hydrogen 2.781 N/A ALA 985.A N GLN 981.A O no hydrogen 3.028 N/A HIS 986.A N MET 982.A O no hydrogen 2.824 N/A HIS 986.A ND1 MET 982.A O no hydrogen 2.796 N/A GLY 988.A N ASN 983.A O no hydrogen 3.021 N/A TRP 990.A N ASN 983.A OD1 no hydrogen 2.929 N/A THR 991.A N GLN 920.A OE1 no hydrogen 2.823 N/A