Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kt1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N ASP 1.A OD1 no hydrogen 3.072 N/A LYS 4.A N ASP 1.A OD1 no hydrogen 3.023 N/A GLY 5.A N ASP 1.A O no hydrogen 3.399 N/A MET 6.A N ILE 3.A O no hydrogen 3.001 N/A PHE 7.A N LYS 4.A O no hydrogen 3.257 N/A ASN 8.A N LEU 38.A O no hydrogen 2.852 N/A LYS 10.A NZ HIS 36.A O no hydrogen 3.026 N/A ILE 11.A N ASN 8.A O no hydrogen 3.186 N/A TRP 12.A N PRO 9.A O no hydrogen 3.185 N/A TRP 12.A NE1 LYS 4.A O no hydrogen 2.850 N/A ASP 13.A N LYS 10.A O no hydrogen 2.842 N/A LYS 14.A NZ ASP 18.A OD1 no hydrogen 3.231 N/A LYS 14.A NZ TYR 108.A OH no hydrogen 3.425 N/A PHE 16.A N ASP 13.A OD2 no hydrogen 3.020 N/A GLN 17.A N ASP 13.A O no hydrogen 2.979 N/A ASP 18.A N LYS 14.A O no hydrogen 2.968 N/A GLY 19.A N THR 15.A O no hydrogen 2.964 N/A LEU 20.A N PHE 16.A O no hydrogen 2.817 N/A LYS 21.A N GLN 17.A O no hydrogen 2.894 N/A LYS 22.A N ASP 18.A O no hydrogen 3.028 N/A LYS 22.A NZ ASP 26.A OD1 no hydrogen 2.961 N/A GLU 23.A N GLY 19.A O no hydrogen 3.073 N/A ILE 24.A N LEU 20.A O no hydrogen 3.012 N/A GLU 25.A N LYS 21.A O no hydrogen 2.996 N/A ASP 26.A N LYS 22.A O no hydrogen 2.931 N/A SER 27.A N ILE 24.A O no hydrogen 3.307 N/A SER 27.A OG ILE 24.A O no hydrogen 2.799 N/A SER 27.A OG TRP 32.A O no hydrogen 3.098 N/A GLN 28.A NE2 SER 182.A OG no hydrogen 2.899 N/A TYR 30.A OH PHE 203.A O no hydrogen 3.326 N/A TRP 32.A N SER 27.A OG no hydrogen 2.868 N/A TRP 32.A NE1 GLN 28.A O no hydrogen 2.781 N/A GLY 33.A N PHE 194.A O no hydrogen 2.876 N/A THR 34.A OG1 GLN 191.A OE1 no hydrogen 2.795 N/A THR 34.A OG1 ILE 192.A O no hydrogen 2.771 N/A ILE 35.A N ILE 192.A O no hydrogen 3.077 N/A LEU 38.A N ASN 190.A O no hydrogen 3.086 N/A ASN 40.A N MET 6.A O no hydrogen 2.719 N/A LEU 44.A N ASN 40.A O no hydrogen 3.069 N/A ARG 45.A N ASP 41.A O no hydrogen 3.015 N/A ARG 45.A NE ASP 41.A OD1 no hydrogen 2.785 N/A ARG 45.A NH1 ASP 155.A OD2 no hydrogen 3.009 N/A ARG 45.A NH2 ASP 155.A OD1 no hydrogen 2.980 N/A ALA 46.A N ASP 42.A O no hydrogen 3.033 N/A VAL 47.A N LEU 43.A O no hydrogen 2.975 N/A ARG 48.A N LEU 44.A O no hydrogen 2.887 N/A ARG 48.A NH1 LEU 151.A O no hydrogen 3.348 N/A LYS 49.A N ARG 45.A O no hydrogen 3.013 N/A GLU 50.A N ALA 46.A O no hydrogen 2.914 N/A ILE 51.A N VAL 47.A O no hydrogen 2.920 N/A GLU 52.A N ARG 48.A O no hydrogen 3.114 N/A THR 53.A N LYS 49.A O no hydrogen 3.121 N/A THR 53.A OG1 LYS 49.A O no hydrogen 3.240 N/A GLU 54.A N GLU 50.A O no hydrogen 2.860 N/A ILE 55.A N ILE 51.A O no hydrogen 2.988 N/A HIS 56.A N SER 77.A O no hydrogen 2.738 N/A THR 58.A N GLN 69.A O no hydrogen 2.899 N/A LYS 59.A NZ GLU 497.A OE2 no hydrogen 2.812 N/A LYS 60.A N VAL 67.A O no hydrogen 2.820 N/A LYS 60.A NZ TYR 65.A OH no hydrogen 3.380 N/A THR 62.A N TYR 65.A O no hydrogen 2.900 N/A ILE 64.A N THR 62.A OG1 no hydrogen 3.220 N/A TYR 65.A N THR 62.A OG1 no hydrogen 3.218 N/A ARG 66.A N HIS 132.A O no hydrogen 3.004 N/A ARG 66.A NE GLU 61.A OE2 no hydrogen 2.872 N/A ARG 66.A NH2 GLU 61.A OE2 no hydrogen 3.545 N/A ARG 66.A NH2 GLU 497.A O no hydrogen 2.570 N/A VAL 67.A N LYS 60.A O no hydrogen 2.971 N/A ASN 68.A N THR 126.A O no hydrogen 3.039 N/A ASN 68.A ND2 THR 126.A OG1 no hydrogen 2.963 N/A ASN 68.A ND2 THR 128.A OG1 no hydrogen 3.217 N/A GLN 69.A N THR 58.A O no hydrogen 2.685 N/A SER 70.A OG ILE 124.A O no hydrogen 2.672 N/A ASN 75.A N ASP 72.A O no hydrogen 2.876 N/A ASN 75.A ND2 ASP 72.A O no hydrogen 3.396 N/A LEU 76.A N ASP 72.A OD2 no hydrogen 2.890 N/A SER 77.A N ASP 72.A OD1 no hydrogen 2.922 N/A SER 77.A OG SER 70.A O no hydrogen 2.523 N/A GLY 78.A N ASN 75.A O no hydrogen 3.323 N/A LEU 79.A N SER 77.A OG no hydrogen 3.184 N/A ASP 82.A N ASP 80.A OD2 no hydrogen 3.032 N/A ASP 83.A N ASP 80.A O no hydrogen 3.011 N/A SER 85.A N ASP 83.A OD2 no hydrogen 3.239 N/A SER 85.A OG ASP 83.A OD2 no hydrogen 2.400 N/A ARG 86.A NE GLU 54.A OE2 no hydrogen 2.789 N/A ARG 86.A NH1 GLU 54.A OE1 no hydrogen 3.227 N/A LEU 87.A N LEU 84.A O no hydrogen 2.975 N/A ASN 89.A N GLU 50.A OE2 no hydrogen 2.767 N/A LEU 90.A N GLU 50.A OE1 no hydrogen 2.958 N/A PHE 91.A N LEU 87.A O no hydrogen 3.092 N/A LYS 92.A N PRO 88.A O no hydrogen 2.988 N/A LYS 92.A NZ GLN 95.A OE1 no hydrogen 3.067 N/A LEU 93.A N ASN 89.A O no hydrogen 2.889 N/A ARG 94.A N LEU 90.A O no hydrogen 2.968 N/A ARG 94.A NH1 TRP 81.A O no hydrogen 2.901 N/A GLN 95.A N PHE 91.A O no hydrogen 2.978 N/A ILE 96.A N LYS 92.A O no hydrogen 2.952 N/A LEU 97.A N LEU 93.A O no hydrogen 3.095 N/A TYR 98.A N ARG 94.A O no hydrogen 3.064 N/A TYR 98.A OH TRP 221.A O no hydrogen 2.527 N/A SER 99.A N ILE 96.A O no hydrogen 3.305 N/A SER 99.A OG ILE 96.A O no hydrogen 2.840 N/A LYS 100.A NZ ASP 104.A OD1 no hydrogen 2.906 N/A LYS 100.A NZ GLU 230.A OE1 no hydrogen 3.303 N/A TYR 102.A N SER 99.A OG no hydrogen 3.164 N/A ARG 103.A N SER 99.A O no hydrogen 2.945 N/A ARG 103.A NE TYR 98.A O no hydrogen 2.640 N/A ASP 104.A N LYS 100.A O no hydrogen 2.865 N/A PHE 105.A N GLN 101.A O no hydrogen 3.277 N/A PHE 106.A N TYR 102.A O no hydrogen 2.828 N/A GLY 107.A N ARG 103.A O no hydrogen 2.782 N/A TYR 108.A N ASP 104.A O no hydrogen 3.097 N/A TYR 108.A OH ASP 18.A OD1 no hydrogen 2.646 N/A VAL 109.A N PHE 105.A O no hydrogen 2.988 N/A THR 110.A N PHE 106.A O no hydrogen 3.175 N/A THR 110.A OG1 PHE 106.A O no hydrogen 2.705 N/A LYS 111.A N TYR 108.A O no hydrogen 3.154 N/A LYS 111.A NZ GLU 25.A OE1 no hydrogen 2.682 N/A ALA 112.A N GLY 107.A O no hydrogen 3.050 N/A SER 116.A N HIS 223.A O no hydrogen 2.858 N/A SER 116.A OG GLU 229.A OE1 no hydrogen 2.789 N/A SER 116.A OG GLU 229.A OE2 no hydrogen 3.199 N/A GLY 117.A N GLU 229.A OE2 no hydrogen 3.143 N/A SER 118.A N GLU 229.A OE2 no hydrogen 2.909 N/A SER 118.A OG GLU 229.A OE2 no hydrogen 2.844 N/A LYS 119.A N SER 116.A OG no hydrogen 2.969 N/A LYS 119.A NZ SER 142.A OG no hydrogen 2.727 N/A THR 120.A N SER 118.A O no hydrogen 2.953 N/A ASP 121.A N TYR 98.A OH no hydrogen 3.144 N/A SER 123.A N GLN 219.A O no hydrogen 2.716 N/A SER 123.A OG ASN 125.A OD1 no hydrogen 3.366 N/A ASN 125.A N SER 217.A O no hydrogen 3.051 N/A ASN 125.A ND2 ASN 68.A O no hydrogen 3.397 N/A THR 126.A N ASN 68.A O no hydrogen 3.145 N/A TYR 127.A N ARG 215.A O no hydrogen 2.919 N/A GLY 130.A N VAL 209.A O no hydrogen 2.967 N/A CYS 131.A N THR 128.A O no hydrogen 2.919 N/A CYS 131.A SG THR 128.A OG1 no hydrogen 3.650 N/A HIS 132.A N ARG 66.A O no hydrogen 3.034 N/A HIS 132.A ND1 GLY 130.A O no hydrogen 2.803 N/A LEU 133.A N VAL 206.A O no hydrogen 3.255 N/A LEU 134.A N ILE 64.A O no hydrogen 2.990 N/A THR 135.A OG1 PRO 356.A O no hydrogen 3.364 N/A HIS 136.A N HIS 204.A O no hydrogen 3.038 N/A HIS 136.A ND1 LEU 134.A O no hydrogen 3.170 N/A VAL 139.A N ASP 137.A OD1 no hydrogen 3.127 N/A SER 142.A OG HIS 223.A ND1 no hydrogen 2.800 N/A ARG 143.A N ILE 140.A O no hydrogen 3.163 N/A ARG 143.A NH2 ASP 138.A O no hydrogen 3.415 N/A ARG 144.A N TYR 222.A O no hydrogen 2.697 N/A ARG 144.A NH1 LYS 114.A O no hydrogen 2.744 N/A ARG 144.A NH2 GLU 236.A OE2 no hydrogen 2.769 N/A ILE 145.A N TYR 222.A O no hydrogen 3.078 N/A SER 146.A N PHE 195.A O no hydrogen 2.950 N/A SER 146.A OG ASP 138.A OD2 no hydrogen 2.814 N/A PHE 147.A N GLY 220.A O no hydrogen 2.933 N/A ILE 148.A N ALA 193.A O no hydrogen 2.820 N/A LEU 149.A N ILE 218.A O no hydrogen 2.819 N/A TYR 150.A N GLN 191.A O no hydrogen 2.867 N/A LEU 151.A N LEU 216.A O no hydrogen 2.842 N/A ASP 155.A N ASP 153.A OD1 no hydrogen 2.948 N/A ARG 156.A N ASP 153.A O no hydrogen 3.418 N/A TRP 158.A NE1 GLY 163.A O no hydrogen 2.861 N/A TYR 162.A N LYS 159.A O no hydrogen 3.101 N/A GLY 163.A N SER 160.A O no hydrogen 2.937 N/A GLY 164.A N GLU 208.A O no hydrogen 3.108 N/A GLY 165.A N GLU 207.A OE1 no hydrogen 2.821 N/A LEU 166.A N LEU 185.A O no hydrogen 3.047 N/A ARG 167.A N ASP 205.A O no hydrogen 2.913 N/A ARG 167.A NE ASP 205.A OD2 no hydrogen 2.945 N/A ARG 167.A NH1 ASP 205.A OD1 no hydrogen 2.708 N/A ARG 167.A NH1 ASP 205.A OD2 no hydrogen 3.413 N/A LEU 168.A N ALA 183.A O no hydrogen 2.929 N/A PHE 169.A N PHE 203.A O no hydrogen 2.857 N/A ILE 172.A N VAL 176.A O no hydrogen 2.726 N/A LEU 173.A N VAL 176.A O no hydrogen 3.414 N/A ASN 175.A N GLY 200.A O no hydrogen 2.812 N/A VAL 176.A N LEU 173.A O no hydrogen 2.750 N/A HIS 178.A N PRO 170.A O no hydrogen 2.925 N/A SER 182.A N LEU 168.A O no hydrogen 2.812 N/A ALA 183.A N LEU 168.A O no hydrogen 3.470 N/A LEU 185.A N LEU 166.A O no hydrogen 2.770 N/A ASN 190.A N TYR 150.A O no hydrogen 2.988 N/A GLN 191.A N GLN 188.A O no hydrogen 3.139 N/A ILE 192.A N ILE 35.A O no hydrogen 3.021 N/A ALA 193.A N ILE 148.A O no hydrogen 2.963 N/A PHE 194.A N GLY 33.A O no hydrogen 2.993 N/A PHE 195.A N SER 146.A O no hydrogen 3.085 N/A LYS 196.A NZ LYS 111.A O no hydrogen 3.261 N/A VAL 197.A N ARG 144.A O no hydrogen 2.821 N/A LEU 198.A N SER 202.A OG no hydrogen 3.146 N/A PHE 201.A N LEU 198.A O no hydrogen 2.876 N/A SER 202.A N LEU 198.A O no hydrogen 2.940 N/A SER 202.A OG ASP 137.A O no hydrogen 2.748 N/A SER 202.A OG LEU 198.A O no hydrogen 3.267 N/A PHE 203.A N PHE 201.A O no hydrogen 2.633 N/A HIS 204.A N HIS 136.A O no hydrogen 2.899 N/A HIS 204.A ND1 SER 202.A O no hydrogen 2.976 N/A ASP 205.A N ARG 167.A O no hydrogen 2.867 N/A VAL 206.A N LEU 133.A O no hydrogen 2.887 N/A GLU 207.A N GLY 165.A O no hydrogen 2.767 N/A VAL 209.A N CYS 131.A O no hydrogen 3.084 N/A LYS 210.A N TYR 162.A O no hydrogen 2.780 N/A LYS 213.A N VAL 211.A O no hydrogen 2.870 N/A ARG 215.A N TYR 127.A O no hydrogen 3.000 N/A ARG 215.A NH2 GLY 164.A O no hydrogen 2.452 N/A SER 217.A N ASN 125.A O no hydrogen 2.801 N/A ILE 218.A N LEU 149.A O no hydrogen 2.861 N/A GLN 219.A N SER 123.A O no hydrogen 2.829 N/A GLY 220.A N PHE 147.A O no hydrogen 2.991 N/A TRP 221.A N ASP 121.A O no hydrogen 2.851 N/A TYR 222.A N ILE 145.A O no hydrogen 2.833 N/A TYR 222.A OH LEU 97.A O no hydrogen 2.494 N/A HIS 223.A ND1 SER 142.A OG no hydrogen 2.800 N/A HIS 223.A NE2 ASP 121.A OD2 no hydrogen 2.660 N/A ILE 224.A N SER 142.A O no hydrogen 2.914 N/A GLN 226.A N GLU 229.A OE1 no hydrogen 2.797 N/A GLU 229.A N GLN 226.A O no hydrogen 3.152 N/A TYR 232.A N GLU 229.A O no hydrogen 3.093 N/A GLU 236.A N ILE 233.A O no hydrogen 3.173 N/A GLU 238.A N GLU 238.A OE1 no hydrogen 2.790 N/A ALA 239.A N GLY 235.A O no hydrogen 2.931 N/A TRP 240.A N GLU 236.A O no hydrogen 2.869 N/A VAL 241.A N GLU 237.A O no hydrogen 2.921 N/A ARG 242.A N GLU 238.A O no hydrogen 3.110 N/A ASN 243.A N ALA 239.A O no hydrogen 3.221 N/A ASN 244.A N VAL 241.A O no hydrogen 3.251 N/A THR 245.A N ARG 242.A O no hydrogen 3.314 N/A THR 245.A OG1 VAL 241.A O no hydrogen 3.296 N/A ASP 250.A N VAL 247.A O no hydrogen 3.376 N/A PHE 251.A N LEU 248.A O no hydrogen 2.904 N/A GLU 252.A N GLU 249.A O no hydrogen 3.400 N/A PHE 253.A N ILE 354.A O no hydrogen 2.945 N/A LYS 255.A NZ GLU 249.A O no hydrogen 3.202 N/A LYS 255.A NZ ASP 250.A O no hydrogen 2.695 N/A LYS 255.A NZ GLU 252.A O no hydrogen 2.739 N/A ARG 258.A NE ASP 553.A OD1 no hydrogen 2.714 N/A ARG 258.A NH1 ARG 465.A O no hydrogen 3.290 N/A ARG 258.A NH2 ARG 465.A O no hydrogen 2.930 N/A ARG 258.A NH2 ASP 553.A OD1 no hydrogen 3.286 N/A ARG 258.A NH2 ASP 553.A OD2 no hydrogen 2.747 N/A ASN 259.A N GLU 445.A O no hydrogen 2.975 N/A LEU 261.A N VAL 443.A O no hydrogen 3.151 N/A SER 262.A N GLU 265.A OE2 no hydrogen 3.088 N/A SER 262.A OG GLU 265.A OE2 no hydrogen 2.765 N/A VAL 266.A N SER 262.A O no hydrogen 3.319 N/A LYS 267.A N PHE 263.A O no hydrogen 3.067 N/A HIS 268.A N HIS 264.A O no hydrogen 3.344 N/A PHE 269.A N GLU 265.A O no hydrogen 3.266 N/A GLU 270.A N VAL 266.A O no hydrogen 2.856 N/A LYS 271.A N LYS 267.A O no hydrogen 2.830 N/A MET 272.A N HIS 268.A O no hydrogen 3.421 N/A LEU 273.A N PHE 269.A O no hydrogen 3.177 N/A LEU 273.A N GLU 270.A O no hydrogen 3.145 N/A SER 278.A N GLU 281.A OE1 no hydrogen 2.967 N/A GLU 281.A N SER 278.A OG no hydrogen 3.351 N/A PHE 282.A N SER 278.A O no hydrogen 3.048 N/A THR 283.A N GLU 279.A O no hydrogen 2.999 N/A THR 283.A OG1 GLU 279.A O no hydrogen 2.727 N/A TYR 284.A N ALA 280.A O no hydrogen 3.003 N/A LEU 285.A N GLU 281.A O no hydrogen 2.919 N/A SER 286.A N PHE 282.A O no hydrogen 2.949 N/A SER 286.A OG PHE 282.A O no hydrogen 3.190 N/A SER 286.A OG THR 283.A O no hydrogen 2.738 N/A GLN 287.A N TYR 284.A O no hydrogen 3.286 N/A TYR 288.A N LEU 285.A O no hydrogen 3.195 N/A ILE 289.A N LEU 285.A O no hydrogen 2.906 N/A SER 290.A N PHE 317.A O no hydrogen 2.801 N/A HIS 293.A N SER 290.A O no hydrogen 2.981 N/A HIS 293.A NE2 GLU 315.A O no hydrogen 3.062 N/A HIS 293.A NE2 SER 316.A O no hydrogen 2.911 N/A LEU 294.A N PRO 291.A O no hydrogen 3.060 N/A SER 295.A N PRO 291.A O no hydrogen 3.236 N/A SER 295.A OG GLU 292.A O no hydrogen 3.505 N/A LYS 297.A NZ GLU 300.A OE1 no hydrogen 3.370 N/A GLY 298.A N SER 295.A OG no hydrogen 2.971 N/A ILE 299.A N SER 295.A O no hydrogen 2.806 N/A GLU 300.A N SER 296.A O no hydrogen 3.106 N/A LYS 301.A N LYS 297.A O no hydrogen 2.916 N/A LEU 302.A N GLY 298.A O no hydrogen 3.174 N/A GLN 303.A N ILE 299.A O no hydrogen 2.892 N/A GLN 303.A NE2 LEU 436.A O no hydrogen 2.995 N/A LYS 304.A N GLU 300.A O no hydrogen 3.245 N/A LYS 304.A N LYS 301.A O no hydrogen 3.250 N/A GLN 305.A N LYS 301.A O no hydrogen 3.006 N/A PHE 306.A N LEU 302.A O no hydrogen 2.943 N/A VAL 307.A N GLN 303.A O no hydrogen 3.178 N/A GLU 308.A N LYS 304.A O no hydrogen 3.103 N/A ASN 309.A N GLN 305.A O no hydrogen 2.892 N/A SER 310.A N PHE 306.A O no hydrogen 2.901 N/A LEU 312.A N LEU 523.A O no hydrogen 2.738 N/A GLN 313.A NE2 ASP 514.A OD2 no hydrogen 3.528 N/A ILE 314.A N PHE 521.A O no hydrogen 2.843 N/A PHE 317.A N ASN 519.A O no hydrogen 3.023 N/A ASN 319.A N TYR 288.A O no hydrogen 2.673 N/A LYS 322.A NZ GLN 287.A O no hydrogen 2.981 N/A LYS 322.A NZ ASP 321.A OD2 no hydrogen 3.212 N/A SER 323.A N ASN 319.A O no hydrogen 2.876 N/A GLU 324.A N ASP 320.A O no hydrogen 2.944 N/A LEU 325.A N ASP 321.A O no hydrogen 3.074 N/A LEU 326.A N LYS 322.A O no hydrogen 2.946 N/A LYS 327.A N SER 323.A O no hydrogen 3.031 N/A LYS 328.A N GLU 324.A O no hydrogen 3.072 N/A VAL 329.A N LEU 325.A O no hydrogen 3.064 N/A ILE 330.A N LEU 326.A O no hydrogen 2.956 N/A LYS 331.A N LYS 327.A O no hydrogen 2.937 N/A GLN 332.A N LYS 328.A O no hydrogen 3.053 N/A LYS 333.A N VAL 329.A O no hydrogen 3.028 N/A LYS 333.A NZ GLU 415.A OE1 no hydrogen 3.078 N/A LYS 333.A NZ GLU 415.A OE2 no hydrogen 3.085 N/A GLU 334.A N ILE 330.A O no hydrogen 2.944 N/A LEU 335.A N LYS 331.A O no hydrogen 3.029 N/A GLU 336.A N GLN 332.A O no hydrogen 3.098 N/A GLN 337.A N LYS 333.A O no hydrogen 3.086 N/A CYS 339.A SG PRO 340.A O no hydrogen 3.825 N/A TYR 341.A OH PRO 454.A O no hydrogen 2.702 N/A SER 343.A N ASP 180.A OD2 no hydrogen 2.849 N/A SER 343.A OG ASP 180.A OD2 no hydrogen 2.929 N/A LYS 344.A N HIS 342.A ND1 no hydrogen 3.121 N/A LYS 344.A NZ ASP 345.A OD1 no hydrogen 2.981 N/A ASP 345.A N HIS 342.A O no hydrogen 2.921 N/A TRP 350.A N LYS 347.A O no hydrogen 2.821 N/A TRP 350.A NE1 GLU 415.A OE1 no hydrogen 2.794 N/A LYS 351.A N TYR 363.A O no hydrogen 2.900 N/A LYS 351.A NZ ASP 365.A OD2 no hydrogen 2.935 N/A LYS 351.A NZ LYS 367.A O no hydrogen 3.074 N/A LYS 351.A NZ GLU 368.A O no hydrogen 3.025 N/A ALA 353.A N TYR 361.A O no hydrogen 2.800 N/A ILE 354.A N PHE 253.A O no hydrogen 3.023 N/A LYS 358.A N PRO 355.A O no hydrogen 2.870 N/A ALA 359.A N PRO 355.A O no hydrogen 3.002 N/A ARG 360.A N PHE 458.A O no hydrogen 2.981 N/A ARG 360.A NE SER 179.A O no hydrogen 3.295 N/A ARG 360.A NE SER 179.A OG no hydrogen 3.237 N/A ARG 360.A NH1 SER 179.A O no hydrogen 2.780 N/A ARG 360.A NH2 MET 456.A O no hydrogen 2.688 N/A LEU 362.A N ARG 451.A O no hydrogen 2.989 N/A TYR 363.A N LYS 351.A O no hydrogen 2.918 N/A ILE 364.A N ILE 449.A O no hydrogen 2.777 N/A LYS 367.A N ASP 365.A OD2 no hydrogen 2.867 N/A LYS 367.A NZ ASP 386.A O no hydrogen 2.920 N/A GLU 368.A N ASP 386.A OD1 no hydrogen 2.678 N/A TYR 369.A OH VAL 346.A O no hydrogen 2.753 N/A ASN 371.A ND2 SER 343.A O no hydrogen 2.818 N/A ASN 371.A ND2 VAL 346.A O no hydrogen 3.347 N/A ASN 371.A ND2 TYR 369.A OH no hydrogen 3.086 N/A GLN 373.A N ASP 377.A OD1 no hydrogen 3.043 N/A GLN 373.A NE2 SER 343.A OG no hydrogen 3.065 N/A GLN 373.A NE2 ASN 371.A OD1 no hydrogen 2.895 N/A THR 374.A N ASP 377.A OD1 no hydrogen 3.123 N/A ASP 377.A N THR 374.A OG1 no hydrogen 3.120 N/A ILE 378.A N THR 374.A O no hydrogen 3.359 N/A LEU 379.A N GLU 375.A O no hydrogen 2.830 N/A GLU 380.A N ALA 376.A O no hydrogen 2.972 N/A ALA 381.A N ASP 377.A O no hydrogen 3.377 N/A LEU 382.A N ILE 378.A O no hydrogen 3.116 N/A ASN 383.A N LEU 379.A O no hydrogen 2.949 N/A ASN 384.A N GLU 380.A O no hydrogen 2.982 N/A ASN 389.A N GLY 366.A O no hydrogen 2.866 N/A PHE 392.A N ASN 389.A OD1 no hydrogen 3.227 N/A THR 393.A N ASN 389.A O no hydrogen 3.144 N/A THR 393.A OG1 ASN 389.A O no hydrogen 2.910 N/A LYS 394.A N PHE 390.A O no hydrogen 2.781 N/A ASP 395.A N GLN 391.A O no hydrogen 2.796 N/A ALA 396.A N PHE 392.A O no hydrogen 2.887 N/A ILE 397.A N THR 393.A O no hydrogen 3.054 N/A LYS 398.A N LYS 394.A O no hydrogen 3.279 N/A ILE 399.A N ASP 395.A O no hydrogen 3.296 N/A ILE 400.A N ALA 396.A O no hydrogen 3.161 N/A SER 401.A N ILE 397.A O no hydrogen 2.822 N/A SER 401.A OG ILE 397.A O no hydrogen 3.544 N/A SER 401.A OG LYS 398.A O no hydrogen 3.372 N/A SER 401.A OG ASP 402.A OD1 no hydrogen 3.317 N/A ASP 402.A N LYS 398.A O no hydrogen 3.004 N/A ALA 403.A N ILE 400.A O no hydrogen 3.406 N/A SER 404.A OG GLY 405.A O no hydrogen 3.157 N/A GLY 405.A N SER 401.A O no hydrogen 3.022 N/A SER 407.A N GLY 405.A O no hydrogen 2.827 N/A GLU 409.A N SER 407.A OG no hydrogen 3.400 N/A ASN 411.A N SER 407.A O no hydrogen 3.263 N/A ASN 411.A ND2 SER 407.A O no hydrogen 3.033 N/A ASP 413.A N ASN 411.A OD1 no hydrogen 3.045 N/A GLU 415.A N GLU 415.A OE2 no hydrogen 2.879 N/A LEU 416.A N PHE 412.A O no hydrogen 2.919 N/A ALA 417.A N ASP 413.A O no hydrogen 3.159 N/A LEU 418.A N ALA 414.A O no hydrogen 2.896 N/A ILE 419.A N GLU 415.A O no hydrogen 2.840 N/A ASP 420.A N LEU 416.A O no hydrogen 2.978 N/A LEU 421.A N ALA 417.A O no hydrogen 3.047 N/A ALA 422.A N LEU 418.A O no hydrogen 2.862 N/A VAL 423.A N ILE 419.A O no hydrogen 2.704 N/A PHE 424.A N ASP 420.A O no hydrogen 2.951 N/A HIS 425.A N LEU 421.A O no hydrogen 3.081 N/A LYS 426.A N ALA 422.A O no hydrogen 2.962 N/A LYS 426.A N VAL 423.A O no hydrogen 2.942 N/A SER 427.A N PHE 424.A O no hydrogen 3.149 N/A SER 427.A OG PHE 424.A O no hydrogen 2.868 N/A PHE 430.A N SER 427.A OG no hydrogen 2.980 N/A LYS 431.A N SER 427.A O no hydrogen 3.310 N/A LYS 431.A NZ GLU 265.A OE1 no hydrogen 2.516 N/A LYS 431.A NZ LYS 426.A O no hydrogen 2.673 N/A LYS 431.A NZ GLU 445.A OE2 no hydrogen 2.657 N/A LYS 432.A N THR 428.A O no hydrogen 2.984 N/A LYS 432.A NZ GLU 281.A OE2 no hydrogen 2.981 N/A TYR 433.A N ILE 429.A O no hydrogen 2.977 N/A TYR 433.A OH HIS 293.A O no hydrogen 2.724 N/A LEU 434.A N PHE 430.A O no hydrogen 2.856 N/A ALA 435.A N LYS 431.A O no hydrogen 2.959 N/A LEU 436.A N LYS 432.A O no hydrogen 2.861 N/A LEU 437.A N TYR 433.A O no hydrogen 2.945 N/A THR 438.A N LEU 434.A O no hydrogen 3.068 N/A THR 438.A OG1 LEU 434.A O no hydrogen 2.690 N/A SER 439.A N ALA 435.A O no hydrogen 2.682 N/A LEU 440.A N THR 438.A OG1 no hydrogen 3.243 N/A CYS 441.A N LYS 555.A O no hydrogen 2.741 N/A VAL 443.A N ASP 553.A O no hydrogen 2.797 N/A SER 444.A OG ASP 553.A OD1 no hydrogen 2.544 N/A GLU 445.A N ASN 259.A O no hydrogen 2.879 N/A GLN 446.A N LYS 551.A O no hydrogen 2.814 N/A LEU 448.A N LYS 549.A O no hydrogen 2.829 N/A ILE 449.A N ILE 364.A O no hydrogen 2.980 N/A ARG 450.A N ASP 547.A O no hydrogen 2.813 N/A ARG 450.A NE ASP 547.A OD1 no hydrogen 2.843 N/A ARG 450.A NH2 ASP 547.A OD1 no hydrogen 3.522 N/A ARG 450.A NH2 ASP 547.A OD2 no hydrogen 2.787 N/A ARG 451.A N LEU 362.A O no hydrogen 2.857 N/A ARG 451.A NH1 SER 544.A OG no hydrogen 3.214 N/A PHE 452.A N ARG 545.A O no hydrogen 2.770 N/A ARG 453.A N ASP 457.A OD1 no hydrogen 2.687 N/A ARG 453.A NE ASP 457.A OD1 no hydrogen 2.776 N/A ARG 453.A NE ASP 457.A OD2 no hydrogen 3.417 N/A ARG 453.A NH1 PRO 340.A O no hydrogen 2.842 N/A ARG 453.A NH2 ASP 457.A OD1 no hydrogen 3.564 N/A ARG 453.A NH2 ASP 457.A OD2 no hydrogen 2.954 N/A GLY 455.A N VAL 537.A O no hydrogen 2.641 N/A MET 456.A N ARG 453.A O no hydrogen 3.190 N/A ASP 457.A N ARG 453.A O no hydrogen 3.163 N/A PHE 458.A N ARG 360.A O no hydrogen 2.746 N/A THR 459.A N VAL 534.A O no hydrogen 3.040 N/A ALA 461.A N ASP 63.A OD1 no hydrogen 2.913 N/A THR 462.A N GLU 532.A O no hydrogen 3.080 N/A LYS 463.A NZ ASP 507.A OD1 no hydrogen 3.173 N/A CYS 464.A SG ASP 527.A O no hydrogen 3.956 N/A GLU 468.A N GLU 468.A OE2 no hydrogen 2.513 N/A LEU 469.A N ASN 467.A OD1 no hydrogen 3.049 N/A LEU 470.A N ASN 467.A O no hydrogen 2.994 N/A ASN 473.A N LEU 470.A O no hydrogen 3.332 N/A ASN 473.A ND2 ASP 475.A OD2 no hydrogen 3.317 N/A ILE 477.A N VAL 554.A O no hydrogen 2.928 N/A VAL 480.A N ARG 526.A O no hydrogen 2.886 N/A LEU 481.A N TRP 552.A O no hydrogen 2.948 N/A GLU 482.A N VAL 524.A O no hydrogen 2.837 N/A GLY 483.A N MET 550.A O no hydrogen 2.678 N/A THR 484.A N ASN 522.A O no hydrogen 2.824 N/A THR 484.A OG1 GLU 502.A OE2 no hydrogen 2.575 N/A LEU 485.A N VAL 548.A O no hydrogen 2.926 N/A CYS 486.A N THR 520.A O no hydrogen 2.888 N/A CYS 486.A SG THR 488.A OG1 no hydrogen 3.253 N/A CYS 486.A SG ALA 517.A O no hydrogen 3.374 N/A CYS 486.A SG TRP 546.A O no hydrogen 3.947 N/A LEU 487.A N TRP 546.A O no hydrogen 2.742 N/A THR 488.A N ALA 517.A O no hydrogen 3.122 N/A THR 488.A OG1 TRP 546.A O no hydrogen 3.558 N/A SER 490.A OG SER 543.A OG no hydrogen 2.818 N/A TRP 493.A NE1 SER 490.A OG no hydrogen 2.984 N/A GLY 496.A N GLY 492.A O no hydrogen 2.825 N/A GLU 497.A N GLU 494.A O no hydrogen 3.424 N/A LEU 498.A N TRP 493.A O no hydrogen 3.002 N/A GLY 500.A N LYS 535.A O no hydrogen 2.785 N/A TYR 501.A OH GLU 61.A OE1 no hydrogen 2.546 N/A GLU 502.A N ASP 514.A O no hydrogen 2.830 N/A LEU 503.A N PHE 533.A O no hydrogen 2.932 N/A TYR 504.A N ILE 512.A O no hydrogen 2.927 N/A TYR 504.A OH GLU 482.A OE1 no hydrogen 3.233 N/A MET 505.A N LEU 531.A O no hydrogen 2.842 N/A MET 506.A N SER 509.A O no hydrogen 2.723 N/A ASP 507.A N SER 529.A O no hydrogen 3.217 N/A LEU 511.A N TYR 504.A O no hydrogen 2.902 N/A ILE 512.A N TYR 504.A O no hydrogen 3.304 N/A ASP 514.A N GLU 502.A O no hydrogen 2.843 N/A TRP 518.A NE1 SER 323.A OG no hydrogen 2.942 N/A ASN 519.A N CYS 486.A O no hydrogen 2.856 N/A THR 520.A N CYS 486.A O no hydrogen 3.409 N/A PHE 521.A N ILE 314.A O no hydrogen 2.819 N/A ASN 522.A N THR 484.A O no hydrogen 2.880 N/A ASN 522.A ND2 GLU 502.A OE1 no hydrogen 3.138 N/A ASN 522.A ND2 ASP 514.A OD2 no hydrogen 3.290 N/A LEU 523.A N LEU 312.A O no hydrogen 2.784 N/A VAL 524.A N GLU 482.A O no hydrogen 2.889 N/A LEU 525.A N SER 310.A O no hydrogen 3.145 N/A ARG 526.A N VAL 480.A O no hydrogen 2.813 N/A ARG 526.A NH1 GLU 482.A OE2 no hydrogen 2.898 N/A ARG 526.A NH2 THR 462.A O no hydrogen 2.922 N/A ARG 526.A NH2 VAL 530.A O no hydrogen 2.781 N/A SER 529.A N ASP 527.A OD1 no hydrogen 2.754 N/A SER 529.A OG ASP 527.A OD1 no hydrogen 2.870 N/A VAL 530.A N ASP 527.A O no hydrogen 3.242 N/A LEU 531.A N MET 505.A O no hydrogen 2.683 N/A GLU 532.A N THR 462.A O no hydrogen 3.016 N/A PHE 533.A N LEU 503.A O no hydrogen 3.061 N/A VAL 534.A N THR 459.A OG1 no hydrogen 2.980 N/A LYS 535.A N TYR 501.A O no hydrogen 3.013 N/A LYS 535.A NZ THR 62.A O no hydrogen 2.791 N/A LYS 535.A NZ ASP 63.A O no hydrogen 3.084 N/A LYS 535.A NZ TYR 65.A O no hydrogen 3.400 N/A LYS 535.A NZ HIS 132.A NE2 no hydrogen 2.916 N/A TYR 536.A OH GLU 208.A OE1 no hydrogen 2.715 N/A VAL 537.A N ASP 457.A O no hydrogen 2.958 N/A SER 538.A N LEU 498.A O no hydrogen 2.973 N/A SER 538.A OG GLU 208.A OE2 no hydrogen 2.667 N/A TRP 539.A N GLU 208.A OE1 no hydrogen 2.759 N/A SER 540.A N SER 538.A OG no hydrogen 2.962 N/A ALA 541.A N SER 538.A O no hydrogen 3.038 N/A LYS 542.A NZ ALA 491.A O no hydrogen 3.196 N/A SER 543.A OG SER 490.A OG no hydrogen 2.818 N/A SER 543.A OG SER 544.A O no hydrogen 2.716 N/A SER 544.A N GLU 334.A OE2 no hydrogen 2.797 N/A SER 544.A OG GLU 334.A OE2 no hydrogen 3.491 N/A ARG 545.A N PHE 452.A O no hydrogen 3.056 N/A ARG 545.A NE ASP 547.A OD2 no hydrogen 2.857 N/A ARG 545.A NH1 ASP 547.A OD2 no hydrogen 2.850 N/A ARG 545.A NH2 GLY 500.A O no hydrogen 2.855 N/A TRP 546.A NE1 GLU 334.A OE2 no hydrogen 2.711 N/A ASP 547.A N ARG 450.A O no hydrogen 3.052 N/A VAL 548.A N LEU 485.A O no hydrogen 2.905 N/A LYS 549.A N LEU 448.A O no hydrogen 2.766 N/A LYS 549.A NZ GLU 482.A OE1 no hydrogen 2.641 N/A LYS 549.A NZ THR 484.A OG1 no hydrogen 2.860 N/A LYS 549.A NZ GLU 502.A OE2 no hydrogen 3.405 N/A MET 550.A N GLY 483.A O no hydrogen 2.856 N/A LYS 551.A N GLN 446.A O no hydrogen 2.918 N/A LYS 551.A NZ ASP 256.A OD2 no hydrogen 2.995 N/A TRP 552.A N LEU 481.A O no hydrogen 2.823 N/A ASP 553.A N SER 444.A OG no hydrogen 2.891 N/A LYS 555.A N CYS 441.A O no hydrogen 2.865 N/A LYS 555.A NZ GLU 270.A OE2 no hydrogen 2.416 N/A SER 556.A N ASP 475.A O no hydrogen 3.424 N/A