Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kqe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A NH1 SER 330.A OG no hydrogen 3.003 N/A LYS 6.A NZ GLN 470.A OE1 no hydrogen 2.971 N/A MET 7.A N ASP 3.A O no hydrogen 3.004 N/A GLY 8.A N ARG 4.A O no hydrogen 2.889 N/A ASP 9.A N ALA 5.A O no hydrogen 2.917 N/A THR 10.A N LYS 6.A O no hydrogen 2.958 N/A THR 10.A OG1 LYS 6.A O no hydrogen 3.394 N/A THR 10.A OG1 THR 472.A OG1 no hydrogen 3.327 N/A LEU 11.A N MET 7.A O no hydrogen 2.884 N/A LYS 12.A N GLY 8.A O no hydrogen 2.907 N/A ARG 13.A N ASP 9.A O no hydrogen 2.904 N/A ARG 14.A N THR 10.A O no hydrogen 3.018 N/A ARG 14.A NH1 ARG 529.A O no hydrogen 2.798 N/A ARG 14.A NH1 GLU 532.A OE1 no hydrogen 2.634 N/A PHE 16.A N LEU 11.A O no hydrogen 2.960 N/A ASP 18.A N ASP 32.A O no hydrogen 2.875 N/A ALA 20.A N LEU 30.A O no hydrogen 2.916 N/A TYR 24.A N PHE 21.A O no hydrogen 2.973 N/A GLY 25.A N ALA 22.A O no hydrogen 2.998 N/A GLY 26.A N PHE 21.A O no hydrogen 2.757 N/A VAL 27.A N ALA 20.A O no hydrogen 3.248 N/A LEU 30.A N VAL 27.A O no hydrogen 3.410 N/A ASP 32.A N ASP 18.A O no hydrogen 2.891 N/A GLY 34.A N PHE 16.A O no hydrogen 3.035 N/A CYS 38.A N GLY 34.A O no hydrogen 2.581 N/A CYS 38.A SG PHE 33.A O no hydrogen 3.247 N/A CYS 38.A SG GLY 34.A O no hydrogen 3.492 N/A ALA 39.A N PRO 35.A O no hydrogen 2.898 N/A LEU 40.A N VAL 36.A O no hydrogen 2.943 N/A LYS 41.A N GLY 37.A O no hydrogen 2.910 N/A LYS 41.A NZ THR 230.A OG1 no hydrogen 2.745 N/A ASN 42.A N CYS 38.A O no hydrogen 2.911 N/A ASN 43.A N ALA 39.A O no hydrogen 2.952 N/A ASN 43.A ND2 VAL 480.A O no hydrogen 3.251 N/A ASN 43.A ND2 PRO 482.A O no hydrogen 3.596 N/A ILE 44.A N LEU 40.A O no hydrogen 2.888 N/A ILE 45.A N LYS 41.A O no hydrogen 2.937 N/A GLN 46.A N ASN 42.A O no hydrogen 2.918 N/A THR 47.A N ASN 43.A O no hydrogen 2.899 N/A THR 47.A OG1 ASN 43.A O no hydrogen 2.790 N/A TRP 48.A N ILE 44.A O no hydrogen 2.926 N/A ARG 49.A N ILE 45.A O no hydrogen 2.870 N/A ARG 49.A NH1 GLU 60.A OE1 no hydrogen 2.691 N/A ARG 49.A NH1 GLU 60.A OE2 no hydrogen 2.920 N/A ARG 49.A NH2 GLU 60.A OE2 no hydrogen 2.882 N/A GLN 50.A N GLN 46.A O no hydrogen 2.947 N/A HIS 51.A N THR 47.A O no hydrogen 2.899 N/A HIS 51.A NE2 ARG 295.A O no hydrogen 3.017 N/A PHE 52.A N TRP 48.A O no hydrogen 2.910 N/A GLN 54.A N ARG 49.A O no hydrogen 2.762 N/A GLU 55.A N HIS 51.A O no hydrogen 2.920 N/A GLU 56.A N PHE 52.A O no hydrogen 2.944 N/A GLN 57.A NE2 GLN 54.A O no hydrogen 2.821 N/A ILE 58.A N ILE 53.A O no hydrogen 3.073 N/A LEU 59.A N ALA 205.A O no hydrogen 2.743 N/A ILE 61.A N ALA 207.A O no hydrogen 2.905 N/A CYS 63.A N GLN 208.A OE1 no hydrogen 2.461 N/A THR 64.A OG1 LEU 66.A O no hydrogen 2.758 N/A THR 67.A N TYR 178.A O no hydrogen 2.911 N/A THR 67.A OG1 MET 65.A O no hydrogen 3.047 N/A GLU 69.A N PRO 176.A O no hydrogen 2.937 N/A VAL 71.A N PRO 68.A O no hydrogen 3.225 N/A LYS 73.A N GLU 69.A O no hydrogen 2.904 N/A LYS 73.A N PRO 70.A O no hydrogen 3.141 N/A LYS 73.A NZ ASP 79.A OD1 no hydrogen 3.067 N/A LYS 73.A NZ ASP 79.A OD2 no hydrogen 3.346 N/A THR 74.A N PRO 70.A O no hydrogen 2.914 N/A THR 74.A OG1 PRO 70.A O no hydrogen 2.805 N/A SER 75.A N VAL 71.A O no hydrogen 3.295 N/A SER 75.A OG VAL 71.A O no hydrogen 3.418 N/A SER 75.A OG HIS 77.A ND1 no hydrogen 2.753 N/A GLY 76.A N LYS 73.A O no hydrogen 2.963 N/A HIS 77.A N LEU 72.A O no hydrogen 2.928 N/A HIS 77.A ND1 SER 75.A OG no hydrogen 2.753 N/A VAL 78.A N LEU 72.A O no hydrogen 3.165 N/A LYS 80.A N GLY 76.A O no hydrogen 2.951 N/A PHE 81.A N HIS 77.A O no hydrogen 3.173 N/A ALA 82.A N LYS 80.A O no hydrogen 3.132 N/A ASP 83.A N PHE 161.A O no hydrogen 2.915 N/A MET 85.A N VAL 159.A O no hydrogen 2.891 N/A VAL 86.A N PHE 95.A O no hydrogen 2.915 N/A LYS 87.A N SER 156.A OG no hydrogen 2.616 N/A ASP 88.A N GLU 93.A O no hydrogen 3.147 N/A LYS 90.A N ASP 88.A OD2 no hydrogen 2.534 N/A ASN 91.A N ASP 88.A OD2 no hydrogen 3.232 N/A GLU 93.A N ASN 91.A OD1 no hydrogen 2.543 N/A CYS 94.A SG GLY 92.A O no hydrogen 3.777 N/A PHE 95.A N VAL 86.A O no hydrogen 2.893 N/A ALA 97.A N PHE 84.A O no hydrogen 2.741 N/A LEU 100.A N ARG 96.A O no hydrogen 3.252 N/A LEU 101.A N ALA 97.A O no hydrogen 2.927 N/A LYS 102.A N ASP 98.A O no hydrogen 2.910 N/A ALA 103.A N HIS 99.A O no hydrogen 2.891 N/A HIS 104.A N LEU 100.A O no hydrogen 2.930 N/A HIS 104.A NE2 TYR 144.A O no hydrogen 2.967 N/A LEU 105.A N LEU 101.A O no hydrogen 2.906 N/A GLN 106.A N LYS 102.A O no hydrogen 2.901 N/A LYS 107.A N ALA 103.A O no hydrogen 2.914 N/A LEU 108.A N HIS 104.A O no hydrogen 2.943 N/A MET 109.A N LEU 105.A O no hydrogen 2.865 N/A SER 110.A OG GLN 106.A O no hydrogen 3.420 N/A CYS 114.A N LYS 112.A O no hydrogen 2.776 N/A CYS 114.A SG LEU 108.A O no hydrogen 3.729 N/A CYS 114.A SG SER 115.A O no hydrogen 3.777 N/A GLU 117.A N GLU 117.A OE1 no hydrogen 2.386 N/A LYS 118.A NZ GLU 121.A OE1 no hydrogen 3.168 N/A LYS 119.A N SER 115.A O no hydrogen 3.144 N/A SER 120.A N VAL 116.A O no hydrogen 2.918 N/A GLU 121.A N GLU 117.A O no hydrogen 2.924 N/A MET 122.A N LYS 118.A O no hydrogen 2.885 N/A GLU 123.A N LYS 119.A O no hydrogen 2.912 N/A SER 124.A N SER 120.A O no hydrogen 2.917 N/A VAL 125.A N GLU 121.A O no hydrogen 2.926 N/A LEU 126.A N MET 122.A O no hydrogen 2.902 N/A ALA 127.A N GLU 123.A O no hydrogen 2.930 N/A LEU 129.A N LEU 126.A O no hydrogen 3.087 N/A ASN 131.A N GLN 128.A O no hydrogen 3.043 N/A GLY 133.A N GLU 136.A OE1 no hydrogen 3.363 N/A GLN 134.A NE2 PRO 158.A O no hydrogen 2.323 N/A GLN 135.A NE2 GLN 135.A O no hydrogen 3.189 N/A GLN 135.A NE2 ASP 139.A OD1 no hydrogen 2.820 N/A LEU 137.A N GLY 133.A O no hydrogen 2.925 N/A ALA 138.A N GLN 134.A O no hydrogen 2.914 N/A ASP 139.A N GLN 135.A O no hydrogen 2.909 N/A LEU 140.A N GLU 136.A O no hydrogen 2.897 N/A PHE 141.A N LEU 137.A O no hydrogen 2.903 N/A VAL 142.A N ALA 138.A O no hydrogen 2.938 N/A ASN 143.A N ASP 139.A O no hydrogen 2.882 N/A TYR 144.A N LEU 140.A O no hydrogen 3.192 N/A TYR 144.A OH GLU 121.A OE1 no hydrogen 3.316 N/A ASN 145.A N VAL 142.A O no hydrogen 3.131 N/A VAL 146.A N PHE 141.A O no hydrogen 3.118 N/A SER 148.A N ASN 153.A O no hydrogen 2.951 N/A SER 148.A OG THR 151.A OG1 no hydrogen 3.005 N/A ILE 150.A N SER 148.A OG no hydrogen 3.231 N/A THR 151.A N SER 148.A OG no hydrogen 3.149 N/A THR 151.A OG1 ASP 88.A OD1 no hydrogen 2.717 N/A THR 151.A OG1 SER 148.A OG no hydrogen 3.005 N/A GLY 152.A N SER 148.A O no hydrogen 2.968 N/A ASN 153.A N THR 151.A OG1 no hydrogen 3.330 N/A SER 156.A N LYS 87.A O no hydrogen 2.728 N/A SER 156.A OG LYS 87.A O no hydrogen 3.097 N/A VAL 159.A N MET 85.A O no hydrogen 2.913 N/A PHE 161.A N ASP 83.A O no hydrogen 2.897 N/A ASN 162.A ND2 HIS 77.A O no hydrogen 2.767 N/A LEU 163.A N PHE 81.A O no hydrogen 3.016 N/A MET 164.A N ASN 162.A OD1 no hydrogen 3.046 N/A LYS 166.A NZ THR 167.A O no hydrogen 2.719 N/A THR 167.A N GLY 177.A O no hydrogen 2.911 N/A PHE 168.A N THR 167.A OG1 no hydrogen 2.538 N/A ILE 169.A N MET 175.A O no hydrogen 2.751 N/A GLY 177.A N THR 167.A O no hydrogen 2.895 N/A TYR 178.A N THR 67.A O no hydrogen 2.850 N/A TYR 178.A OH GLU 69.A OE2 no hydrogen 2.773 N/A LEU 179.A N PHE 165.A O no hydrogen 3.122 N/A ARG 180.A N MET 65.A O no hydrogen 2.876 N/A ARG 180.A NE ASN 211.A O no hydrogen 2.867 N/A ARG 180.A NH1 GLN 208.A OE1 no hydrogen 3.264 N/A ARG 180.A NH2 ASN 211.A O no hydrogen 3.137 N/A THR 183.A N GLU 233.A OE1 no hydrogen 2.811 N/A THR 183.A OG1 GLU 233.A OE1 no hydrogen 2.399 N/A GLN 185.A NE2 GLU 182.A OE1 no hydrogen 2.735 N/A GLN 185.A NE2 ASP 346.A OD2 no hydrogen 3.327 N/A PHE 188.A N ALA 184.A O no hydrogen 2.941 N/A LEU 189.A N GLN 185.A O no hydrogen 2.913 N/A ASN 190.A N GLY 186.A O no hydrogen 3.366 N/A ASN 190.A ND2 GLY 186.A O no hydrogen 2.773 N/A PHE 191.A N PHE 188.A O no hydrogen 3.222 N/A LEU 194.A N ASN 190.A O no hydrogen 2.955 N/A LEU 195.A N PHE 191.A O no hydrogen 2.905 N/A GLU 196.A N LYS 192.A O no hydrogen 2.916 N/A PHE 197.A N ARG 193.A O no hydrogen 2.909 N/A ASN 198.A N LEU 194.A O no hydrogen 3.018 N/A ASN 198.A N LEU 195.A O no hydrogen 3.190 N/A ASN 198.A ND2 LYS 201.A O no hydrogen 2.783 N/A GLN 199.A N GLU 196.A O no hydrogen 2.902 N/A GLY 200.A N LEU 195.A O no hydrogen 2.730 N/A LYS 201.A N ASN 198.A O no hydrogen 3.199 N/A PHE 204.A N PHE 237.A O no hydrogen 2.977 N/A ALA 206.A N GLU 235.A O no hydrogen 2.930 N/A ALA 207.A N LEU 59.A O no hydrogen 2.952 N/A GLN 208.A N GLU 233.A O no hydrogen 2.907 N/A GLY 210.A N MET 231.A O no hydrogen 2.954 N/A SER 212.A N PHE 229.A O no hydrogen 2.843 N/A PHE 213.A N ARG 180.A O no hydrogen 2.895 N/A ARG 214.A N ARG 227.A O no hydrogen 2.830 N/A ASN 215.A N LEU 163.A O no hydrogen 2.509 N/A GLU 216.A N ARG 214.A O no hydrogen 2.420 N/A SER 218.A OG SER 218.A O no hydrogen 2.229 N/A ILE 224.A N SER 221.A O no hydrogen 3.160 N/A ARG 225.A NH1 SER 218.A O no hydrogen 2.613 N/A ARG 227.A N GLY 29.A O no hydrogen 2.811 N/A ARG 227.A NE GLU 216.A O no hydrogen 2.893 N/A ARG 227.A NH1 SER 28.A O no hydrogen 2.709 N/A ARG 227.A NH2 GLU 216.A O no hydrogen 2.734 N/A PHE 229.A N SER 212.A O no hydrogen 2.967 N/A THR 230.A OG1 ASN 211.A OD1 no hydrogen 2.839 N/A MET 231.A N GLY 210.A O no hydrogen 2.873 N/A ALA 232.A N PHE 448.A O no hydrogen 2.945 N/A GLU 233.A N GLN 208.A O no hydrogen 2.888 N/A ILE 234.A N PRO 446.A O no hydrogen 2.902 N/A GLU 235.A N ALA 206.A O no hydrogen 2.857 N/A HIS 236.A N ILE 444.A O no hydrogen 2.899 N/A PHE 237.A N PHE 204.A O no hydrogen 2.842 N/A VAL 238.A N ASN 442.A O no hydrogen 2.863 N/A SER 241.A N ASP 239.A OD1 no hydrogen 2.854 N/A SER 241.A OG ASP 239.A OD1 no hydrogen 3.293 N/A SER 241.A OG GLU 242.A OE2 no hydrogen 3.518 N/A GLU 242.A N ASP 239.A O no hydrogen 2.741 N/A LYS 243.A NZ ASP 341.A OD1 no hydrogen 3.077 N/A LYS 243.A NZ ASP 341.A OD2 no hydrogen 3.532 N/A ASP 244.A N GLU 242.A O no hydrogen 2.692 N/A HIS 245.A N THR 287.A OG1 no hydrogen 2.900 N/A LYS 247.A N HIS 245.A ND1 no hydrogen 3.207 N/A LYS 247.A NZ GLU 55.A O no hydrogen 3.034 N/A LYS 247.A NZ GLU 56.A OE1 no hydrogen 3.544 N/A LYS 247.A NZ GLU 56.A OE2 no hydrogen 2.870 N/A PHE 248.A N HIS 245.A O no hydrogen 3.238 N/A ASN 250.A N LYS 247.A O no hydrogen 3.084 N/A VAL 251.A N PHE 248.A O no hydrogen 3.055 N/A LEU 254.A N VAL 251.A O no hydrogen 3.151 N/A LEU 256.A N MET 273.A O no hydrogen 2.889 N/A LEU 258.A N ARG 271.A O no hydrogen 3.010 N/A TYR 259.A N PHE 312.A O no hydrogen 2.767 N/A ALA 261.A N GLN 314.A OE1 no hydrogen 2.943 N/A ALA 263.A N SER 260.A OG no hydrogen 2.935 N/A GLN 264.A N SER 260.A O no hydrogen 3.130 N/A GLN 264.A NE2 TYR 259.A O no hydrogen 3.279 N/A GLN 264.A NE2 SER 260.A O no hydrogen 3.253 N/A GLN 264.A NE2 GLN 314.A O no hydrogen 2.605 N/A VAL 265.A N ALA 261.A O no hydrogen 2.909 N/A SER 266.A N LYS 262.A O no hydrogen 2.883 N/A SER 266.A OG LYS 262.A O no hydrogen 2.763 N/A SER 266.A OG GLN 268.A OE1 no hydrogen 3.476 N/A GLY 267.A N GLN 264.A O no hydrogen 3.413 N/A GLN 268.A N ALA 263.A O no hydrogen 2.581 N/A ARG 271.A N LEU 258.A O no hydrogen 3.073 N/A MET 273.A N LEU 256.A O no hydrogen 2.883 N/A ARG 274.A NE ASP 277.A OD1 no hydrogen 3.005 N/A LEU 275.A N LEU 254.A O no hydrogen 2.926 N/A GLY 276.A N ALA 252.A O no hydrogen 2.918 N/A ALA 278.A N ARG 274.A O no hydrogen 2.910 N/A VAL 279.A N LEU 275.A O no hydrogen 2.952 N/A GLU 280.A N GLY 276.A O no hydrogen 2.892 N/A GLN 281.A N ASP 277.A O no hydrogen 2.907 N/A GLY 282.A N VAL 279.A O no hydrogen 3.001 N/A VAL 283.A N ALA 278.A O no hydrogen 2.924 N/A ILE 284.A N ALA 278.A O no hydrogen 3.219 N/A ASN 286.A ND2 ASN 285.A OD1 no hydrogen 2.677 N/A ASN 286.A ND2 ASP 341.A OD2 no hydrogen 2.748 N/A VAL 288.A N ASN 286.A OD1 no hydrogen 3.163 N/A LEU 289.A N ASN 286.A OD1 no hydrogen 3.111 N/A GLY 290.A N ASN 286.A O no hydrogen 3.020 N/A TYR 291.A N THR 287.A O no hydrogen 2.907 N/A TYR 291.A OH GLU 56.A OE1 no hydrogen 2.590 N/A TYR 291.A OH GLU 56.A OE2 no hydrogen 3.409 N/A PHE 292.A N VAL 288.A O no hydrogen 2.971 N/A ILE 293.A N LEU 289.A O no hydrogen 2.914 N/A GLY 294.A N GLY 290.A O no hydrogen 2.917 N/A ARG 295.A N TYR 291.A O no hydrogen 2.951 N/A ILE 296.A N PHE 292.A O no hydrogen 2.897 N/A TYR 297.A N ILE 293.A O no hydrogen 2.942 N/A LEU 298.A N GLY 294.A O no hydrogen 2.941 N/A TYR 299.A N ARG 295.A O no hydrogen 2.931 N/A TYR 299.A OH ILE 44.A O no hydrogen 2.794 N/A LEU 300.A N ILE 296.A O no hydrogen 2.917 N/A THR 301.A N TYR 297.A O no hydrogen 2.943 N/A THR 301.A OG1 TYR 297.A O no hydrogen 3.058 N/A THR 301.A OG1 LEU 298.A O no hydrogen 2.953 N/A LYS 302.A N LEU 298.A O no hydrogen 2.923 N/A LYS 302.A NZ HIS 51.A ND1 no hydrogen 3.090 N/A VAL 303.A N TYR 299.A O no hydrogen 3.119 N/A GLY 304.A N THR 301.A O no hydrogen 3.269 N/A ILE 305.A N LEU 300.A O no hydrogen 3.066 N/A SER 306.A N HIS 460.A ND1 no hydrogen 3.024 N/A ASP 308.A N ASP 308.A OD2 no hydrogen 2.591 N/A LYS 309.A N SER 306.A O no hydrogen 3.054 N/A LEU 310.A N PRO 307.A O no hydrogen 3.418 N/A ARG 311.A N GLU 326.A O no hydrogen 2.908 N/A ARG 311.A NE GLU 326.A OE1 no hydrogen 2.853 N/A ARG 311.A NH2 GLU 326.A OE1 no hydrogen 2.833 N/A PHE 312.A N TYR 257.A O no hydrogen 2.725 N/A ARG 313.A N ASP 324.A O no hydrogen 2.906 N/A ARG 313.A NE GLU 326.A OE2 no hydrogen 2.873 N/A ARG 313.A NH1 GLN 264.A OE1 no hydrogen 2.792 N/A ARG 313.A NH1 GLU 319.A OE1 no hydrogen 2.957 N/A ARG 313.A NH1 GLU 319.A OE2 no hydrogen 3.259 N/A ARG 313.A NH2 GLU 319.A OE2 no hydrogen 2.589 N/A GLN 314.A N TYR 259.A O no hydrogen 2.935 N/A GLN 314.A NE2 ASP 321.A OD1 no hydrogen 3.286 N/A HIS 315.A N CYS 322.A O no hydrogen 2.733 N/A HIS 315.A NE2 ASP 324.A OD2 no hydrogen 2.371 N/A MET 316.A N GLU 319.A OE1 no hydrogen 2.594 N/A GLU 319.A N MET 316.A O no hydrogen 3.270 N/A ASP 321.A N ASP 341.A O no hydrogen 3.299 N/A CYS 322.A SG ASP 324.A OD1 no hydrogen 3.238 N/A TRP 323.A N CYS 339.A O no hydrogen 3.134 N/A ASP 324.A N ARG 313.A O no hydrogen 2.892 N/A ALA 325.A N VAL 337.A O no hydrogen 2.579 N/A GLU 326.A N ARG 311.A O no hydrogen 2.867 N/A SER 327.A N ILE 334.A O no hydrogen 2.917 N/A SER 327.A OG THR 456.A OG1 no hydrogen 2.924 N/A LYS 328.A N LYS 309.A O no hydrogen 2.990 N/A THR 329.A N GLY 332.A O no hydrogen 2.891 N/A THR 329.A OG1 GLY 332.A O no hydrogen 2.994 N/A SER 330.A N GLU 459.A OE2 no hydrogen 2.932 N/A SER 330.A OG GLU 459.A OE1 no hydrogen 2.548 N/A TYR 331.A N THR 329.A OG1 no hydrogen 3.057 N/A GLY 332.A N THR 329.A O no hydrogen 2.898 N/A ILE 334.A N SER 327.A O no hydrogen 2.899 N/A ILE 336.A N ALA 325.A O no hydrogen 2.899 N/A VAL 337.A N ALA 325.A O no hydrogen 3.329 N/A GLY 338.A N SER 447.A O no hydrogen 2.909 N/A ALA 340.A N GLU 445.A O no hydrogen 2.957 N/A ASP 341.A N ASP 321.A O no hydrogen 2.732 N/A ARG 342.A N VAL 443.A O no hydrogen 3.010 N/A ARG 342.A NH2 GLU 445.A OE1 no hydrogen 2.647 N/A CYS 344.A N PRO 441.A O no hydrogen 3.252 N/A TYR 345.A N SER 343.A O no hydrogen 2.945 N/A SER 348.A OG ASP 395.A OD1 no hydrogen 3.388 N/A CYS 349.A N TYR 345.A O no hydrogen 2.893 N/A CYS 349.A SG TYR 345.A O no hydrogen 3.159 N/A HIS 350.A N ASP 346.A O no hydrogen 2.942 N/A HIS 350.A NE2 GLN 185.A OE1 no hydrogen 2.888 N/A ALA 351.A N LEU 347.A O no hydrogen 2.904 N/A ARG 352.A N SER 348.A O no hydrogen 2.913 N/A ALA 353.A N CYS 349.A O no hydrogen 2.929 N/A THR 354.A N HIS 350.A O no hydrogen 2.932 N/A THR 354.A OG1 HIS 350.A O no hydrogen 2.601 N/A LYS 355.A NZ GLU 389.A OE2 no hydrogen 3.238 N/A LYS 355.A NZ GLU 417.A OE2 no hydrogen 2.890 N/A VAL 356.A N THR 354.A OG1 no hydrogen 3.165 N/A ALA 360.A N VAL 439.A O no hydrogen 2.924 N/A LYS 362.A N GLU 437.A O no hydrogen 3.115 N/A LYS 362.A NZ ASP 239.A OD2 no hydrogen 2.857 N/A GLU 370.A N ILE 428.A O no hydrogen 2.900 N/A SER 372.A N ASP 426.A O no hydrogen 2.634 N/A SER 372.A OG ASP 426.A O no hydrogen 2.854 N/A ILE 376.A N SER 372.A O no hydrogen 3.214 N/A GLY 377.A N LYS 373.A O no hydrogen 2.903 N/A LYS 378.A N GLY 374.A O no hydrogen 2.885 N/A ALA 379.A N ALA 375.A O no hydrogen 2.905 N/A TYR 380.A N ILE 376.A O no hydrogen 2.644 N/A TYR 380.A OH GLN 422.A O no hydrogen 2.515 N/A ALA 384.A N LYS 381.A O no hydrogen 3.232 N/A LEU 386.A N ASP 383.A O no hydrogen 3.230 N/A VAL 387.A N ASP 383.A O no hydrogen 3.275 N/A MET 388.A N ALA 384.A O no hydrogen 2.899 N/A GLU 389.A N LYS 385.A O no hydrogen 2.905 N/A TYR 390.A N LEU 386.A O no hydrogen 2.916 N/A TYR 390.A OH TYR 398.A OH no hydrogen 3.305 N/A LEU 391.A N VAL 387.A O no hydrogen 2.934 N/A ALA 392.A N MET 388.A O no hydrogen 2.898 N/A ILE 393.A N TYR 390.A O no hydrogen 3.207 N/A CYS 394.A SG TYR 390.A O no hydrogen 3.260 N/A TYR 398.A N ASP 395.A O no hydrogen 2.744 N/A ILE 399.A N ASP 395.A O no hydrogen 2.966 N/A THR 400.A N GLU 396.A O no hydrogen 2.916 N/A THR 400.A OG1 GLU 396.A O no hydrogen 2.688 N/A GLU 401.A N CYS 397.A O no hydrogen 2.915 N/A MET 402.A N TYR 398.A O no hydrogen 2.906 N/A GLU 403.A N ILE 399.A O no hydrogen 2.910 N/A MET 404.A N THR 400.A O no hydrogen 2.975 N/A LEU 406.A N MET 402.A O no hydrogen 2.898 N/A ASN 407.A N GLU 403.A O no hydrogen 2.919 N/A GLU 408.A N MET 404.A O no hydrogen 2.925 N/A GLY 410.A N ASN 407.A O no hydrogen 3.143 N/A GLU 411.A N LEU 405.A O no hydrogen 3.377 N/A THR 413.A OG1 GLN 422.A OE1 no hydrogen 2.225 N/A ILE 414.A N PHE 421.A O no hydrogen 2.906 N/A THR 416.A N LYS 419.A O no hydrogen 2.766 N/A PHE 421.A N ILE 414.A O no hydrogen 2.900 N/A LEU 423.A N PHE 412.A O no hydrogen 3.273 N/A VAL 430.A N GLN 368.A O no hydrogen 3.179 N/A GLU 437.A N LYS 362.A O no hydrogen 2.713 N/A VAL 439.A N ALA 360.A O no hydrogen 2.900 N/A ASN 442.A N VAL 238.A O no hydrogen 2.837 N/A ASN 442.A ND2 ASP 341.A OD1 no hydrogen 3.546 N/A VAL 443.A N ARG 342.A O no hydrogen 2.843 N/A ILE 444.A N HIS 236.A O no hydrogen 2.912 N/A GLU 445.A N ALA 340.A O no hydrogen 2.876 N/A SER 447.A N GLY 338.A O no hydrogen 2.876 N/A SER 447.A OG GLU 233.A OE2 no hydrogen 2.628 N/A PHE 448.A N ALA 232.A O no hydrogen 2.906 N/A GLY 449.A N ILE 336.A O no hydrogen 2.940 N/A ARG 452.A NE ILE 224.A O no hydrogen 2.697 N/A ARG 452.A NH1 GLU 335.A O no hydrogen 2.767 N/A ARG 452.A NH2 ILE 224.A O no hydrogen 2.893 N/A ILE 453.A N GLY 449.A O no hydrogen 3.083 N/A MET 454.A N LEU 450.A O no hydrogen 2.906 N/A TYR 455.A N GLY 451.A O no hydrogen 2.935 N/A TYR 455.A OH GLU 459.A OE1 no hydrogen 2.699 N/A THR 456.A N ARG 452.A O no hydrogen 2.895 N/A THR 456.A OG1 SER 327.A OG no hydrogen 2.924 N/A THR 456.A OG1 ARG 452.A O no hydrogen 2.780 N/A VAL 457.A N ILE 453.A O no hydrogen 2.923 N/A PHE 458.A N MET 454.A O no hydrogen 2.920 N/A GLU 459.A N TYR 455.A O no hydrogen 2.946 N/A HIS 460.A N THR 456.A O no hydrogen 2.886 N/A HIS 460.A NE2 LYS 328.A O no hydrogen 3.068 N/A THR 461.A N VAL 457.A O no hydrogen 2.941 N/A THR 461.A OG1 VAL 457.A O no hydrogen 2.528 N/A HIS 463.A N PHE 473.A O no hydrogen 2.915 N/A HIS 463.A ND1 SER 475.A OG no hydrogen 2.872 N/A ARG 465.A N ARG 471.A O no hydrogen 2.615 N/A ARG 465.A NH1 ASP 559.A O no hydrogen 2.889 N/A ARG 465.A NH2 ASP 531.A OD2 no hydrogen 2.913 N/A ARG 465.A NH2 ARG 558.A O no hydrogen 2.658 N/A ARG 471.A N GLU 469.A O no hydrogen 3.048 N/A ARG 471.A NE GLU 469.A OE1 no hydrogen 2.775 N/A THR 472.A OG1 THR 10.A OG1 no hydrogen 3.327 N/A PHE 473.A N HIS 463.A O no hydrogen 2.899 N/A PHE 474.A N ASP 531.A O no hydrogen 3.473 N/A SER 475.A N THR 461.A O no hydrogen 2.674 N/A SER 475.A OG HIS 463.A ND1 no hydrogen 2.872 N/A SER 475.A OG ASP 559.A OD1 no hydrogen 3.545 N/A VAL 480.A N PRO 477.A O no hydrogen 2.983 N/A ALA 481.A N PRO 477.A O no hydrogen 2.947 N/A LYS 484.A N SER 513.A O no hydrogen 2.977 N/A LYS 484.A N SER 513.A OG no hydrogen 3.085 N/A CYS 485.A N SER 513.A O no hydrogen 3.115 N/A CYS 485.A SG SER 486.A O no hydrogen 3.776 N/A SER 486.A N PHE 537.A O no hydrogen 2.888 N/A VAL 487.A N LYS 515.A O no hydrogen 2.891 N/A LEU 488.A N VAL 539.A O no hydrogen 2.911 N/A LEU 490.A N ILE 541.A O no hydrogen 3.033 N/A SER 491.A OG ASN 493.A OD1 no hydrogen 2.445 N/A PHE 496.A N ASN 493.A O no hydrogen 2.683 N/A VAL 500.A N PHE 496.A O no hydrogen 3.130 N/A LYS 501.A N MET 497.A O no hydrogen 2.877 N/A GLU 502.A N PRO 498.A O no hydrogen 2.916 N/A LEU 503.A N PHE 499.A O no hydrogen 2.923 N/A SER 504.A N VAL 500.A O no hydrogen 2.902 N/A SER 504.A OG HIS 514.A NE2 no hydrogen 2.492 N/A GLU 505.A N LYS 501.A O no hydrogen 2.907 N/A ALA 506.A N GLU 502.A O no hydrogen 2.905 N/A LEU 507.A N LEU 503.A O no hydrogen 2.905 N/A THR 508.A N SER 504.A O no hydrogen 2.903 N/A THR 508.A OG1 SER 504.A O no hydrogen 3.270 N/A ARG 509.A N GLU 505.A O no hydrogen 2.917 N/A ARG 509.A NH2 GLU 502.A OE2 no hydrogen 3.291 N/A HIS 510.A N ALA 506.A O no hydrogen 3.073 N/A HIS 510.A ND1 GLN 576.A OE1 no hydrogen 2.593 N/A GLY 511.A N THR 508.A O no hydrogen 3.050 N/A VAL 512.A N LEU 507.A O no hydrogen 2.850 N/A HIS 514.A ND1 VAL 512.A O no hydrogen 3.043 N/A HIS 514.A NE2 SER 504.A OG no hydrogen 2.492 N/A LYS 515.A N CYS 485.A O no hydrogen 2.943 N/A ASP 517.A N VAL 487.A O no hydrogen 2.862 N/A SER 519.A N ASP 517.A OD2 no hydrogen 2.887 N/A ARG 525.A N SER 522.A O no hydrogen 3.232 N/A ARG 526.A N SER 522.A O no hydrogen 3.007 N/A ARG 526.A NH1 ASP 517.A OD2 no hydrogen 2.758 N/A ARG 526.A NH2 PRO 489.A O no hydrogen 2.622 N/A TYR 527.A N ILE 523.A O no hydrogen 2.899 N/A ALA 528.A N GLY 524.A O no hydrogen 2.896 N/A ARG 529.A N ARG 525.A O no hydrogen 2.928 N/A ARG 529.A NH2 SER 520.A O no hydrogen 2.643 N/A THR 530.A N ARG 526.A O no hydrogen 2.953 N/A THR 530.A OG1 ARG 526.A O no hydrogen 3.505 N/A THR 530.A OG1 TYR 527.A O no hydrogen 3.086 N/A ASP 531.A N TYR 527.A O no hydrogen 2.892 N/A GLU 532.A N ALA 528.A O no hydrogen 2.925 N/A ILE 533.A N THR 530.A O no hydrogen 3.410 N/A GLY 534.A N ASP 531.A O no hydrogen 2.782 N/A VAL 535.A N THR 530.A O no hydrogen 3.144 N/A PHE 537.A N LYS 484.A O no hydrogen 2.754 N/A GLY 538.A N ARG 556.A O no hydrogen 2.940 N/A VAL 539.A N SER 486.A O no hydrogen 2.862 N/A THR 540.A N THR 554.A O no hydrogen 2.913 N/A ILE 541.A N LEU 488.A O no hydrogen 2.891 N/A ASP 542.A N THR 545.A OG1 no hydrogen 3.098 N/A THR 545.A N ASP 542.A O no hydrogen 3.052 N/A THR 545.A N ASP 542.A OD1 no hydrogen 2.960 N/A THR 545.A OG1 ASP 542.A OD1 no hydrogen 2.695 N/A THR 545.A OG1 THR 552.A O no hydrogen 2.713 N/A VAL 546.A N ASP 542.A O no hydrogen 3.327 N/A ASN 547.A N PHE 543.A O no hydrogen 2.898 N/A ASN 547.A ND2 PHE 543.A O no hydrogen 3.340 N/A LYS 548.A N ASP 544.A O no hydrogen 3.233 N/A LYS 548.A NZ ASP 544.A OD2 no hydrogen 2.975 N/A HIS 551.A ND1 THR 545.A O no hydrogen 2.743 N/A ALA 553.A N ALA 566.A O no hydrogen 2.880 N/A THR 554.A N THR 540.A O no hydrogen 2.968 N/A LEU 555.A N ILE 564.A O no hydrogen 2.888 N/A ARG 556.A N GLY 538.A O no hydrogen 2.864 N/A ARG 556.A NH1 ASP 531.A OD1 no hydrogen 2.965 N/A ARG 556.A NH1 ASP 531.A OD2 no hydrogen 3.165 N/A ARG 556.A NH2 ASP 531.A OD2 no hydrogen 2.785 N/A ASP 557.A N ARG 562.A O no hydrogen 3.061 N/A ARG 558.A N ALA 536.A O no hydrogen 3.044 N/A ARG 558.A NH1 ASP 559.A OD1 no hydrogen 2.654 N/A ARG 558.A NH2 PHE 476.A O no hydrogen 2.210 N/A ARG 558.A NH2 GLY 534.A O no hydrogen 3.195 N/A SER 560.A N ASP 557.A OD1 no hydrogen 3.185 N/A SER 560.A OG ASP 557.A OD1 no hydrogen 2.825 N/A MET 561.A N ASP 557.A O no hydrogen 2.832 N/A ARG 562.A N SER 560.A OG no hydrogen 3.143 N/A ARG 562.A NE GLU 589.A OE2 no hydrogen 2.658 N/A ARG 562.A NH2 GLU 589.A OE1 no hydrogen 2.657 N/A ARG 562.A NH2 GLU 589.A OE2 no hydrogen 3.082 N/A ILE 564.A N LEU 555.A O no hydrogen 2.904 N/A ARG 565.A N PRO 593.A O no hydrogen 2.918 N/A ARG 565.A NE THR 552.A OG1 no hydrogen 2.561 N/A ARG 565.A NH1 ASP 542.A OD1 no hydrogen 3.555 N/A ARG 565.A NH1 ASP 542.A OD2 no hydrogen 2.832 N/A ARG 565.A NH1 THR 554.A OG1 no hydrogen 2.748 N/A ARG 565.A NH2 ASP 542.A OD1 no hydrogen 2.724 N/A ARG 565.A NH2 ASP 542.A OD2 no hydrogen 3.455 N/A ALA 566.A N ALA 553.A O no hydrogen 2.959 N/A ILE 568.A N HIS 551.A O no hydrogen 2.932 N/A GLU 570.A N GLU 567.A O no hydrogen 2.774 N/A LEU 571.A N GLU 567.A O no hydrogen 3.320 N/A ILE 574.A N GLU 570.A O no hydrogen 3.243 N/A VAL 575.A N LEU 571.A O no hydrogen 2.886 N/A GLN 576.A N PRO 572.A O no hydrogen 2.908 N/A ASP 577.A N SER 573.A O no hydrogen 2.912 N/A LEU 578.A N ILE 574.A O no hydrogen 2.905 N/A ALA 579.A N VAL 575.A O no hydrogen 2.906 N/A ASN 580.A N GLN 576.A O no hydrogen 2.887 N/A GLY 581.A N LEU 578.A O no hydrogen 3.172 N/A ASN 582.A N ASP 577.A O no hydrogen 2.730 N/A ASN 582.A ND2 ASP 577.A OD1 no hydrogen 3.378 N/A ILE 583.A N ASP 577.A O no hydrogen 3.185 N/A THR 584.A N ASP 587.A OD1 no hydrogen 2.997 N/A TRP 585.A NE1 GLU 589.A OE2 no hydrogen 2.793 N/A ASP 587.A N THR 584.A OG1 no hydrogen 2.861 N/A VAL 588.A N THR 584.A O no hydrogen 3.267 N/A GLU 589.A N TRP 585.A O no hydrogen 2.891 N/A ALA 590.A N ALA 586.A O no hydrogen 3.004 N/A ARG 591.A N VAL 588.A O no hydrogen 3.093 N/A TYR 592.A N VAL 588.A O no hydrogen 3.089 N/A PHE 595.A N GLN 563.A O no hydrogen 3.174 N/A