Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ju3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N ARG 24.A O no hydrogen 2.953 N/A ALA 5.A N LEU 22.A O no hydrogen 2.933 N/A ASN 7.A N ASP 21.A OD1 no hydrogen 3.174 N/A VAL 8.A N VAL 20.A O no hydrogen 2.894 N/A VAL 10.A N LEU 18.A O no hydrogen 2.777 N/A MET 12.A N VAL 16.A O no hydrogen 2.839 N/A ARG 13.A N ASP 92.A OD2 no hydrogen 2.943 N/A ARG 13.A NE ASP 92.A OD1 no hydrogen 3.288 N/A ARG 13.A NE ASP 92.A OD2 no hydrogen 3.043 N/A ARG 13.A NH2 ALA 88.A O no hydrogen 3.566 N/A ARG 13.A NH2 GLU 91.A OE1 no hydrogen 2.897 N/A ARG 13.A NH2 ASP 92.A OD1 no hydrogen 3.009 N/A GLY 15.A N MET 12.A O no hydrogen 3.048 N/A ARG 17.A N GLU 77.A OE1 no hydrogen 3.058 N/A LEU 18.A N VAL 10.A O no hydrogen 2.832 N/A ALA 19.A N SER 76.A OG no hydrogen 2.932 N/A VAL 20.A N VAL 8.A O no hydrogen 2.872 N/A ASP 21.A N ILE 67.A O no hydrogen 2.836 N/A LEU 22.A N ALA 5.A O no hydrogen 2.862 N/A TYR 23.A N VAL 65.A O no hydrogen 2.799 N/A ARG 24.A N SER 3.A O no hydrogen 2.955 N/A ASP 26.A N ASN 1.A O no hydrogen 3.012 N/A VAL 31.A N TRP 102.A O no hydrogen 2.845 N/A VAL 33.A N ASN 106.A O no hydrogen 2.953 N/A LEU 34.A N ALA 64.A O no hydrogen 2.744 N/A LEU 35.A N GLY 108.A O no hydrogen 2.817 N/A VAL 36.A N VAL 66.A O no hydrogen 2.826 N/A ARG 37.A NE GLN 68.A OE1 no hydrogen 2.825 N/A ARG 37.A NH1 ASP 86.A OD1 no hydrogen 2.753 N/A ARG 37.A NH2 GLN 68.A OE1 no hydrogen 3.100 N/A ASN 38.A N GLN 68.A O no hydrogen 2.817 N/A TYR 40.A N ASN 38.A OD1 no hydrogen 2.907 N/A LYS 42.A N ASP 69.A OD1 no hydrogen 2.883 N/A LYS 42.A NZ ASN 7.A OD1 no hydrogen 2.727 N/A LYS 42.A NZ ASP 21.A OD1 no hydrogen 2.854 N/A LYS 42.A NZ ASP 21.A OD2 no hydrogen 3.528 N/A PHE 43.A N ASP 41.A OD1 no hydrogen 3.058 N/A ASP 44.A N ASP 41.A O no hydrogen 3.057 N/A VAL 45.A N PHE 43.A O no hydrogen 3.038 N/A SER 49.A N VAL 45.A O no hydrogen 3.184 N/A SER 49.A OG VAL 45.A O no hydrogen 2.614 N/A GLN 51.A N TRP 48.A O no hydrogen 2.993 N/A GLN 51.A NE2 ALA 47.A O no hydrogen 2.934 N/A GLN 51.A NE2 THR 50.A OG1 no hydrogen 2.823 N/A SER 52.A N SER 49.A O no hydrogen 2.955 N/A SER 52.A OG THR 53.A OG1 no hydrogen 3.247 N/A THR 53.A OG1 SER 52.A OG no hydrogen 3.247 N/A ASN 54.A N THR 307.A OG1 no hydrogen 2.755 N/A TRP 55.A NE1 SER 49.A OG no hydrogen 2.806 N/A GLU 57.A N ASN 54.A O no hydrogen 3.083 N/A PHE 58.A N TRP 55.A O no hydrogen 3.000 N/A ARG 60.A N LEU 56.A O no hydrogen 2.979 N/A ASP 61.A N GLU 57.A O no hydrogen 2.980 N/A ASP 61.A N PHE 58.A O no hydrogen 3.257 N/A GLY 62.A N VAL 59.A O no hydrogen 3.247 N/A TYR 63.A N PHE 58.A O no hydrogen 2.870 N/A TYR 63.A OH ASP 315.A OD1 no hydrogen 2.659 N/A ALA 64.A N PRO 32.A O no hydrogen 2.905 N/A VAL 65.A N TYR 23.A O no hydrogen 2.852 N/A VAL 66.A N LEU 34.A O no hydrogen 2.782 N/A ILE 67.A N ASP 21.A O no hydrogen 3.081 N/A GLN 68.A N VAL 36.A O no hydrogen 2.875 N/A GLN 68.A NE2 THR 93.A OG1 no hydrogen 2.850 N/A ASP 69.A N ALA 19.A O no hydrogen 2.986 N/A THR 70.A N ASN 38.A O no hydrogen 3.077 N/A ARG 71.A NE ASP 89.A OD2 no hydrogen 2.925 N/A ARG 71.A NH1 ASP 14.A OD2 no hydrogen 2.879 N/A ARG 71.A NH2 ASP 14.A OD1 no hydrogen 3.075 N/A ARG 71.A NH2 ASP 14.A OD2 no hydrogen 3.549 N/A ARG 71.A NH2 ASP 89.A OD1 no hydrogen 2.855 N/A GLY 72.A N GLU 77.A O no hydrogen 2.954 N/A LEU 73.A N THR 70.A O no hydrogen 3.244 N/A ALA 75.A N ASP 69.A OD2 no hydrogen 3.056 N/A SER 76.A N LEU 73.A O no hydrogen 3.103 N/A SER 76.A OG ASP 69.A O no hydrogen 2.701 N/A GLU 77.A N ARG 17.A O no hydrogen 3.040 N/A HIS 83.A N TYR 114.A OH no hydrogen 3.161 N/A VAL 84.A N PRO 82.A O no hydrogen 2.867 N/A ASP 86.A N HIS 83.A O no hydrogen 3.297 N/A ASP 89.A N ASP 85.A O no hydrogen 2.963 N/A ALA 90.A N ASP 86.A O no hydrogen 3.033 N/A GLU 91.A N GLU 87.A O no hydrogen 3.138 N/A ASP 92.A N ALA 88.A O no hydrogen 3.023 N/A THR 93.A N ASP 89.A O no hydrogen 3.053 N/A THR 93.A OG1 ASP 89.A O no hydrogen 2.701 N/A LEU 94.A N ALA 90.A O no hydrogen 2.864 N/A SER 95.A N GLU 91.A O no hydrogen 2.983 N/A SER 95.A OG GLU 91.A O no hydrogen 2.989 N/A TRP 96.A N ASP 92.A O no hydrogen 3.095 N/A ILE 97.A N THR 93.A O no hydrogen 2.947 N/A LEU 98.A N LEU 94.A O no hydrogen 3.050 N/A GLU 99.A N SER 95.A O no hydrogen 3.242 N/A GLU 99.A N TRP 96.A O no hydrogen 3.101 N/A GLN 100.A N ILE 97.A O no hydrogen 3.090 N/A CYS 103.A N GLN 100.A O no hydrogen 3.286 N/A ASP 104.A N VAL 31.A O no hydrogen 3.017 N/A ASN 106.A N ASP 104.A OD1 no hydrogen 3.130 N/A ASN 106.A ND2 ASP 104.A OD1 no hydrogen 3.067 N/A VAL 107.A N GLY 129.A O no hydrogen 2.809 N/A GLY 108.A N VAL 33.A O no hydrogen 2.756 N/A MET 109.A N ALA 132.A O no hydrogen 3.162 N/A SER 113.A N SER 136.A O no hydrogen 2.852 N/A SER 113.A OG HIS 283.A NE2 no hydrogen 2.814 N/A TYR 114.A OH ASP 86.A OD2 no hydrogen 3.142 N/A LEU 115.A N VAL 112.A O no hydrogen 3.067 N/A GLY 116.A N SER 113.A O no hydrogen 2.855 N/A VAL 117.A N SER 113.A O no hydrogen 2.890 N/A THR 118.A N TYR 114.A O no hydrogen 3.116 N/A THR 118.A OG1 TYR 114.A O no hydrogen 2.971 N/A GLN 119.A N GLY 116.A O no hydrogen 3.118 N/A GLN 119.A NE2 LEU 115.A O no hydrogen 2.878 N/A GLN 119.A NE2 ALA 134.A O no hydrogen 3.182 N/A TRP 120.A N VAL 117.A O no hydrogen 3.104 N/A GLN 121.A N VAL 117.A O no hydrogen 3.245 N/A GLN 121.A NE2 HIS 83.A O no hydrogen 3.039 N/A ALA 122.A N THR 118.A O no hydrogen 3.113 N/A ALA 122.A N GLN 119.A O no hydrogen 3.219 N/A ALA 123.A N GLN 119.A O no hydrogen 2.894 N/A VAL 124.A N TRP 120.A O no hydrogen 3.396 N/A SER 125.A N ALA 122.A O no hydrogen 3.378 N/A SER 125.A OG ALA 122.A O no hydrogen 2.657 N/A LEU 130.A N VAL 127.A O no hydrogen 3.245 N/A LYS 131.A N VAL 107.A O no hydrogen 2.819 N/A LYS 131.A NZ GLY 128.A O no hydrogen 3.043 N/A ILE 133.A N PRO 246.A O no hydrogen 3.016 N/A ALA 134.A N GLN 119.A OE1 no hydrogen 2.815 N/A SER 136.A N GLY 111.A O no hydrogen 3.046 N/A MET 137.A N THR 250.A O no hydrogen 2.865 N/A SER 139.A OG ASP 141.A O no hydrogen 2.870 N/A SER 139.A OG ALA 145.A O no hydrogen 2.939 N/A ASP 141.A N SER 139.A OG no hydrogen 3.119 N/A TYR 143.A OH PRO 225.A O no hydrogen 2.660 N/A ARG 144.A N ASP 141.A OD1 no hydrogen 3.235 N/A ARG 144.A NE GLU 260.A OE2 no hydrogen 2.873 N/A ALA 145.A N ASP 141.A O no hydrogen 3.082 N/A TRP 147.A N LEU 142.A O no hydrogen 3.388 N/A TYR 148.A N TYR 143.A O no hydrogen 2.867 N/A TYR 148.A OH VAL 221.A O no hydrogen 2.627 N/A GLY 152.A N GLY 149.A O no hydrogen 3.123 N/A LEU 154.A N ASP 529.A OD1 no hydrogen 3.146 N/A SER 155.A N TRP 147.A O no hydrogen 2.838 N/A SER 155.A OG TYR 148.A O no hydrogen 2.807 N/A GLU 157.A N PRO 526.A O no hydrogen 3.175 N/A LEU 159.A N SER 155.A O no hydrogen 3.099 N/A LEU 160.A N VAL 156.A O no hydrogen 2.982 N/A GLY 161.A N GLU 157.A O no hydrogen 2.986 N/A TRP 162.A N ALA 158.A O no hydrogen 3.048 N/A TRP 162.A NE1 TYR 40.A OH no hydrogen 2.793 N/A SER 163.A N LEU 159.A O no hydrogen 3.019 N/A SER 163.A OG LEU 159.A O no hydrogen 2.718 N/A ALA 164.A N LEU 160.A O no hydrogen 3.065 N/A LEU 165.A N GLY 161.A O no hydrogen 3.086 N/A ILE 166.A N TRP 162.A O no hydrogen 2.892 N/A GLY 167.A N SER 163.A O no hydrogen 2.838 N/A THR 168.A N ALA 164.A O no hydrogen 3.162 N/A THR 168.A OG1 ALA 164.A O no hydrogen 2.870 N/A GLY 169.A N LEU 165.A O no hydrogen 3.272 N/A LEU 170.A N ILE 166.A O no hydrogen 2.740 N/A ILE 171.A N GLY 167.A O no hydrogen 3.297 N/A SER 173.A OG GLY 169.A O no hydrogen 2.816 N/A SER 173.A OG LEU 170.A O no hydrogen 3.542 N/A ARG 174.A NH2 ASP 181.A OD1 no hydrogen 2.790 N/A ARG 178.A N ASP 181.A OD2 no hydrogen 3.061 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.851 N/A ASP 181.A N ARG 178.A O no hydrogen 3.264 N/A ASP 184.A N GLU 180.A O no hydrogen 2.983 N/A PHE 185.A N ASP 181.A O no hydrogen 3.003 N/A GLN 187.A N ALA 183.A O no hydrogen 3.203 N/A GLN 187.A NE2 ALA 183.A O no hydrogen 3.287 N/A LEU 188.A N ASP 184.A O no hydrogen 2.926 N/A ALA 189.A N PHE 185.A O no hydrogen 3.138 N/A ALA 190.A N VAL 186.A O no hydrogen 3.048 N/A ILE 191.A N GLN 187.A O no hydrogen 3.307 N/A LEU 192.A N LEU 188.A O no hydrogen 3.147 N/A ASN 193.A N ALA 189.A O no hydrogen 2.959 N/A ASP 194.A N ALA 190.A O no hydrogen 3.264 N/A ASP 194.A N ILE 191.A O no hydrogen 3.188 N/A GLY 197.A N ASP 194.A OD1 no hydrogen 3.043 N/A ALA 198.A N ASP 194.A O no hydrogen 3.159 N/A ALA 199.A N VAL 195.A O no hydrogen 2.914 N/A SER 200.A N GLY 197.A O no hydrogen 3.318 N/A SER 200.A OG ALA 196.A O no hydrogen 2.702 N/A ALA 205.A N ALA 539.A O no hydrogen 2.926 N/A GLU 206.A N PRO 203.A O no hydrogen 3.146 N/A GLN 207.A NE2 LEU 204.A O no hydrogen 2.974 N/A GLY 211.A N GLN 207.A O no hydrogen 2.953 N/A ARG 212.A N LEU 209.A O no hydrogen 3.180 N/A ARG 212.A NH1 ASP 184.A OD2 no hydrogen 3.063 N/A ARG 212.A NH2 ASP 184.A OD1 no hydrogen 2.878 N/A ARG 212.A NH2 ASP 184.A OD2 no hydrogen 3.431 N/A LEU 213.A N LEU 209.A O no hydrogen 3.082 N/A ILE 214.A N LEU 210.A O no hydrogen 2.873 N/A VAL 217.A N ILE 214.A O no hydrogen 3.138 N/A ILE 218.A N PRO 215.A O no hydrogen 3.057 N/A ASP 219.A N PRO 215.A O no hydrogen 2.923 N/A GLN 220.A N TRP 216.A O no hydrogen 2.952 N/A VAL 221.A N TRP 216.A O no hydrogen 3.242 N/A VAL 222.A N VAL 217.A O no hydrogen 3.019 N/A ASP 223.A N ILE 218.A O no hydrogen 2.921 N/A HIS 224.A N VAL 221.A O no hydrogen 3.320 N/A HIS 224.A ND1 ASP 228.A OD2 no hydrogen 2.715 N/A ASN 227.A N LEU 485.A O no hydrogen 2.912 N/A SER 230.A N ASP 228.A OD1 no hydrogen 3.256 N/A SER 230.A OG GLN 220.A OE1 no hydrogen 3.005 N/A SER 230.A OG ASP 228.A OD1 no hydrogen 2.644 N/A TRP 231.A N ASP 228.A O no hydrogen 3.138 N/A TRP 231.A NE1 HIS 224.A O no hydrogen 2.938 N/A GLN 232.A N ASP 228.A O no hydrogen 3.078 N/A SER 233.A N GLU 229.A O no hydrogen 3.044 N/A ILE 234.A N TRP 231.A O no hydrogen 3.213 N/A SER 235.A N GLN 232.A O no hydrogen 3.353 N/A SER 235.A OG ASP 141.A OD2 no hydrogen 3.249 N/A LEU 236.A N ALA 140.A O no hydrogen 2.807 N/A PHE 237.A N ALA 140.A O no hydrogen 2.950 N/A ARG 239.A N LEU 236.A O no hydrogen 3.014 N/A ARG 239.A NH1 GLU 87.A OE1 no hydrogen 2.933 N/A ARG 239.A NH2 GLU 87.A OE2 no hydrogen 2.999 N/A ARG 239.A NH2 SER 235.A O no hydrogen 2.906 N/A LEU 240.A N PHE 237.A O no hydrogen 3.121 N/A GLY 242.A N ARG 239.A O no hydrogen 3.375 N/A LEU 243.A N LEU 240.A O no hydrogen 3.228 N/A ALA 247.A N ASP 273.A O no hydrogen 3.262 N/A LEU 248.A N ILE 133.A O no hydrogen 3.049 N/A ILE 249.A N ARG 275.A O no hydrogen 2.853 N/A THR 250.A N PRO 135.A O no hydrogen 3.261 N/A ALA 251.A N VAL 277.A O no hydrogen 2.914 N/A TRP 253.A N GLY 279.A O no hydrogen 2.840 N/A TRP 253.A NE1 PHE 334.A O no hydrogen 2.896 N/A TYR 254.A N TRP 281.A O no hydrogen 3.051 N/A TYR 254.A OH ALA 471.A O no hydrogen 2.652 N/A ASP 255.A N GLY 252.A O no hydrogen 3.035 N/A PHE 257.A N ASP 255.A OD1 no hydrogen 3.082 N/A VAL 258.A N ASP 255.A O no hydrogen 3.042 N/A SER 261.A N PHE 257.A O no hydrogen 2.825 N/A SER 261.A OG ALA 138.A O no hydrogen 2.673 N/A SER 261.A OG PHE 257.A O no hydrogen 3.064 N/A LEU 262.A N VAL 258.A O no hydrogen 3.041 N/A ARG 263.A N GLY 259.A O no hydrogen 3.152 N/A THR 264.A N GLU 260.A O no hydrogen 3.085 N/A THR 264.A OG1 SER 261.A O no hydrogen 2.618 N/A PHE 265.A N LEU 262.A O no hydrogen 3.122 N/A VAL 266.A N LEU 262.A O no hydrogen 3.238 N/A ALA 267.A N ARG 263.A O no hydrogen 3.054 N/A VAL 268.A N THR 264.A O no hydrogen 3.194 N/A VAL 268.A N PHE 265.A O no hydrogen 3.343 N/A LYS 269.A N PHE 265.A O no hydrogen 3.009 N/A LYS 269.A NZ ASP 346.A OD1 no hydrogen 2.995 N/A LYS 269.A NZ ASP 346.A OD2 no hydrogen 3.460 N/A LYS 269.A NZ TRP 347.A O no hydrogen 2.811 N/A ASN 271.A ND2 LEU 243.A O no hydrogen 3.632 N/A ARG 275.A N ALA 247.A O no hydrogen 2.868 N/A ARG 275.A NE ASP 273.A OD1 no hydrogen 2.805 N/A ARG 275.A NH1 VAL 328.A O no hydrogen 2.903 N/A ARG 275.A NH1 PRO 329.A O no hydrogen 3.068 N/A ARG 275.A NH2 ASP 273.A OD1 no hydrogen 3.145 N/A LEU 276.A N LYS 330.A O no hydrogen 2.960 N/A VAL 277.A N ILE 249.A O no hydrogen 2.973 N/A VAL 278.A N ARG 332.A O no hydrogen 2.916 N/A GLY 279.A N ALA 251.A O no hydrogen 3.166 N/A TRP 281.A NE1 ALA 299.A O no hydrogen 2.700 N/A SER 282.A N ASN 285.A O no hydrogen 3.062 N/A SER 282.A OG GLY 407.A O no hydrogen 2.763 N/A HIS 283.A ND1 ASP 255.A OD2 no hydrogen 2.497 N/A HIS 283.A NE2 SER 113.A OG no hydrogen 2.814 N/A SER 284.A OG GLY 407.A O no hydrogen 3.274 N/A ASN 285.A N SER 282.A O no hydrogen 3.343 N/A ASN 285.A ND2 ARG 289.A O no hydrogen 2.866 N/A ASN 285.A ND2 ASP 408.A O no hydrogen 2.949 N/A THR 287.A N ASN 285.A OD1 no hydrogen 3.041 N/A THR 287.A OG1 ASN 285.A OD1 no hydrogen 2.634 N/A ARG 289.A N THR 287.A OG1 no hydrogen 3.046 N/A ASN 290.A N ARG 293.A O no hydrogen 2.952 N/A ASN 290.A ND2 ARG 293.A O no hydrogen 3.485 N/A ARG 293.A N ASN 290.A O no hydrogen 3.432 N/A ARG 293.A NH1 ASP 339.A OD2 no hydrogen 2.872 N/A ARG 293.A NH2 ASP 339.A OD1 no hydrogen 2.912 N/A ARG 293.A NH2 ASP 339.A OD2 no hydrogen 3.393 N/A PHE 295.A N GLY 288.A O no hydrogen 2.926 N/A ALA 299.A N GLY 296.A O no hydrogen 3.026 N/A THR 300.A N ILE 297.A O no hydrogen 3.225 N/A THR 300.A OG1 THR 287.A O no hydrogen 2.860 N/A THR 300.A OG1 ILE 297.A O no hydrogen 3.226 N/A TYR 301.A N LEU 286.A O no hydrogen 2.946 N/A TYR 301.A OH SER 52.A O no hydrogen 2.669 N/A ILE 303.A N TYR 301.A O no hydrogen 2.862 N/A GLN 304.A NE2 GLU 57.A OE1 no hydrogen 2.882 N/A ALA 306.A N PRO 302.A O no hydrogen 2.840 N/A THR 307.A N ILE 303.A O no hydrogen 2.932 N/A THR 307.A OG1 ILE 303.A O no hydrogen 2.688 N/A THR 308.A N GLN 304.A O no hydrogen 2.976 N/A THR 308.A OG1 GLN 304.A O no hydrogen 3.052 N/A MET 309.A N GLU 305.A O no hydrogen 2.973 N/A HIS 310.A N ALA 306.A O no hydrogen 2.880 N/A LYS 311.A N THR 307.A O no hydrogen 2.937 N/A LYS 311.A NZ ASP 61.A OD2 no hydrogen 3.300 N/A ALA 312.A N THR 308.A O no hydrogen 3.038 N/A PHE 313.A N MET 309.A O no hydrogen 2.944 N/A PHE 314.A N HIS 310.A O no hydrogen 2.856 N/A ASP 315.A N LYS 311.A O no hydrogen 2.784 N/A ARG 316.A N ALA 312.A O no hydrogen 3.107 N/A HIS 317.A N PHE 313.A O no hydrogen 3.191 N/A HIS 317.A NE2 ASP 273.A OD2 no hydrogen 2.758 N/A LEU 318.A N PHE 314.A O no hydrogen 2.803 N/A ARG 319.A NH1 ASP 61.A O no hydrogen 3.413 N/A ARG 319.A NH1 ASP 315.A OD1 no hydrogen 3.255 N/A ARG 319.A NH2 ASP 61.A O no hydrogen 2.738 N/A GLU 321.A N ASP 315.A O no hydrogen 3.049 N/A ALA 324.A N GLU 321.A O no hydrogen 3.100 N/A ALA 326.A N ASP 323.A O no hydrogen 3.281 N/A VAL 328.A N LEU 325.A O no hydrogen 3.304 N/A LYS 330.A NZ ASP 273.A OD1 no hydrogen 2.763 N/A LYS 330.A NZ ALA 274.A O no hydrogen 3.424 N/A VAL 331.A N GLU 344.A O no hydrogen 3.150 N/A ARG 332.A N LEU 276.A O no hydrogen 2.784 N/A ARG 332.A NH1 ASP 343.A OD1 no hydrogen 2.862 N/A LEU 333.A N ARG 342.A O no hydrogen 2.942 N/A PHE 334.A N VAL 278.A O no hydrogen 2.881 N/A VAL 335.A N GLU 340.A O no hydrogen 2.876 N/A MET 336.A N SER 507.A O no hydrogen 2.956 N/A GLY 337.A N ASP 339.A OD1 no hydrogen 2.936 N/A GLU 340.A N VAL 335.A O no hydrogen 3.163 N/A TRP 341.A NE1 ALA 298.A O no hydrogen 2.778 N/A ARG 342.A N LEU 333.A O no hydrogen 2.773 N/A ARG 342.A NE GLU 344.A OE2 no hydrogen 2.702 N/A ARG 342.A NH1 GLU 436.A OE1 no hydrogen 2.835 N/A ARG 342.A NH1 GLU 436.A OE2 no hydrogen 3.385 N/A ARG 342.A NH2 GLU 344.A OE2 no hydrogen 2.931 N/A ARG 342.A NH2 GLU 436.A OE1 no hydrogen 3.559 N/A ARG 342.A NH2 GLU 436.A OE2 no hydrogen 2.671 N/A GLU 344.A N VAL 331.A O no hydrogen 2.764 N/A TRP 347.A N ASP 346.A OD1 no hydrogen 2.901 N/A ASP 351.A N ASP 351.A OD1 no hydrogen 2.598 N/A THR 352.A N LEU 349.A O no hydrogen 3.295 N/A THR 352.A OG1 LEU 349.A O no hydrogen 2.663 N/A ALA 353.A N ILE 567.A O no hydrogen 2.954 N/A THR 355.A N LEU 565.A O no hydrogen 2.908 N/A THR 355.A OG1 ALA 353.A O no hydrogen 2.907 N/A PHE 357.A N ILE 563.A O no hydrogen 2.810 N/A TYR 358.A N SER 375.A O no hydrogen 2.701 N/A LEU 359.A N SER 561.A O no hydrogen 3.041 N/A GLY 360.A N THR 373.A O no hydrogen 2.965 N/A ALA 365.A N ASP 385.A OD1 no hydrogen 3.021 N/A ASN 366.A ND2 THR 386.A O no hydrogen 2.966 N/A ASN 366.A ND2 ASP 421.A O no hydrogen 2.873 N/A THR 367.A N VAL 423.A O no hydrogen 3.013 N/A THR 367.A OG1 ASN 366.A O no hydrogen 2.652 N/A THR 367.A OG1 THR 369.A OG1 no hydrogen 3.100 N/A SER 368.A N HIS 418.A O no hydrogen 3.237 N/A THR 369.A OG1 THR 367.A OG1 no hydrogen 3.100 N/A GLY 370.A N THR 367.A O no hydrogen 3.253 N/A GLY 371.A N ALA 364.A O no hydrogen 3.027 N/A THR 373.A N GLY 360.A O no hydrogen 2.896 N/A LEU 374.A N SER 427.A O no hydrogen 3.041 N/A SER 375.A N TYR 358.A O no hydrogen 3.132 N/A SER 377.A N SER 375.A OG no hydrogen 3.192 N/A SER 379.A OG LEU 359.A O no hydrogen 2.764 N/A SER 383.A N ARG 555.A O no hydrogen 2.801 N/A ASP 385.A N ILE 553.A O no hydrogen 2.923 N/A TYR 387.A N ASN 551.A O no hydrogen 3.035 N/A TYR 387.A OH SER 522.A OG no hydrogen 2.689 N/A TYR 389.A N ALA 549.A O no hydrogen 2.788 N/A TYR 389.A OH ASN 531.A O no hydrogen 2.834 N/A ALA 392.A N ASP 390.A OD1 no hydrogen 3.070 N/A ASP 393.A N ASP 390.A O no hydrogen 2.900 N/A VAL 395.A N SER 523.A OG no hydrogen 2.911 N/A SER 397.A N PHE 525.A O no hydrogen 2.832 N/A SER 397.A OG ASN 524.A OD1 no hydrogen 2.730 N/A GLY 400.A N GLY 410.A O no hydrogen 2.791 N/A LEU 403.A N GLU 157.A OE2 no hydrogen 2.739 N/A PHE 404.A N GLU 157.A OE1 no hydrogen 2.709 N/A HIS 405.A N GLU 157.A OE1 no hydrogen 2.878 N/A GLN 414.A N ALA 469.A O no hydrogen 2.705 N/A GLN 414.A NE2 LEU 398.A O no hydrogen 2.982 N/A GLN 414.A NE2 ALA 412.A O no hydrogen 3.020 N/A ARG 415.A N ASP 413.A OD1 no hydrogen 3.246 N/A ARG 415.A NE ASP 413.A OD1 no hydrogen 3.340 N/A ARG 415.A NE ASP 413.A OD2 no hydrogen 2.894 N/A ARG 415.A NH2 ASP 413.A OD2 no hydrogen 2.861 N/A ILE 417.A N GLN 414.A O no hydrogen 3.136 N/A HIS 418.A N ARG 415.A O no hydrogen 3.298 N/A ARG 420.A N ILE 417.A O no hydrogen 3.373 N/A ARG 420.A NE ASP 422.A OD1 no hydrogen 2.815 N/A ARG 420.A NH1 ASP 393.A OD1 no hydrogen 3.103 N/A ARG 420.A NH2 ASP 393.A O no hydrogen 2.889 N/A ARG 420.A NH2 ASP 422.A OD1 no hydrogen 3.348 N/A ARG 420.A NH2 ASP 422.A OD2 no hydrogen 2.889 N/A VAL 423.A N ARG 420.A O no hydrogen 3.227 N/A LEU 424.A N VAL 520.A O no hydrogen 2.851 N/A CYS 425.A N ALA 365.A O no hydrogen 2.946 N/A CYS 425.A SG VAL 423.A O no hydrogen 3.910 N/A TYR 426.A N VAL 518.A O no hydrogen 2.936 N/A TYR 426.A OH ASP 385.A OD2 no hydrogen 2.650 N/A SER 427.A N GLY 372.A O no hydrogen 3.160 N/A THR 428.A N ILE 516.A O no hydrogen 2.972 N/A THR 428.A OG1 GLU 429.A O no hydrogen 3.094 N/A THR 428.A OG1 ILE 516.A O no hydrogen 3.547 N/A LEU 431.A N HIS 514.A O no hydrogen 2.957 N/A THR 432.A OG1 ASP 433.A OD1 no hydrogen 3.516 N/A VAL 435.A N PHE 510.A O no hydrogen 2.998 N/A VAL 437.A N ASN 508.A O no hydrogen 2.812 N/A THR 438.A N PRO 566.A O no hydrogen 2.995 N/A THR 438.A OG1 GLU 436.A OE2 no hydrogen 2.763 N/A THR 438.A OG1 SER 507.A OG no hydrogen 2.821 N/A GLY 439.A N THR 506.A O no hydrogen 3.021 N/A VAL 441.A N LEU 504.A O no hydrogen 2.986 N/A ALA 443.A N ILE 501.A O no hydrogen 2.892 N/A ARG 444.A N HIS 562.A O no hydrogen 2.840 N/A ARG 444.A NE GLU 498.A OE2 no hydrogen 3.121 N/A ARG 444.A NH2 GLU 498.A OE2 no hydrogen 3.073 N/A LEU 445.A N VAL 499.A O no hydrogen 2.916 N/A PHE 446.A N SER 561.A OG no hydrogen 2.875 N/A VAL 447.A N TYR 497.A O no hydrogen 2.813 N/A SER 448.A N ARG 552.A O no hydrogen 3.023 N/A SER 449.A OG ASN 551.A OD1 no hydrogen 2.767 N/A SER 450.A N VAL 550.A O no hydrogen 3.175 N/A ALA 451.A N SER 449.A OG no hydrogen 3.065 N/A THR 454.A OG1 ASN 533.A OD1 no hydrogen 2.890 N/A ASP 455.A N THR 454.A OG1 no hydrogen 2.877 N/A PHE 456.A N VAL 477.A O no hydrogen 3.003 N/A THR 457.A N SER 521.A O no hydrogen 2.765 N/A ALA 458.A N GLY 475.A O no hydrogen 3.158 N/A LYS 459.A N GLN 519.A O no hydrogen 2.855 N/A LYS 459.A NZ GLN 414.A OE1 no hydrogen 2.667 N/A LYS 459.A NZ GLN 519.A OE1 no hydrogen 3.271 N/A LEU 460.A N CYS 473.A O no hydrogen 2.815 N/A VAL 461.A N MET 517.A O no hydrogen 2.741 N/A ASP 462.A N ILE 470.A O no hydrogen 2.854 N/A VAL 463.A N ARG 515.A O no hydrogen 3.065 N/A PHE 464.A N ARG 468.A O no hydrogen 2.716 N/A GLY 467.A N PHE 464.A O no hydrogen 3.092 N/A ARG 468.A N ASP 466.A OD1 no hydrogen 3.222 N/A ARG 468.A NE ASP 466.A OD1 no hydrogen 2.912 N/A ARG 468.A NE ASP 466.A OD2 no hydrogen 3.367 N/A ARG 468.A NH1 ASP 292.A O no hydrogen 2.856 N/A ARG 468.A NH2 ASP 466.A OD2 no hydrogen 2.826 N/A ALA 469.A N ASP 413.A OD1 no hydrogen 3.012 N/A ILE 470.A N ASP 462.A O no hydrogen 2.915 N/A ALA 471.A N ALA 412.A O no hydrogen 3.101 N/A LEU 472.A N LEU 460.A O no hydrogen 2.866 N/A GLY 475.A N ALA 458.A O no hydrogen 3.003 N/A VAL 477.A N PHE 456.A O no hydrogen 2.902 N/A ARG 478.A N GLY 151.A O no hydrogen 2.941 N/A ARG 478.A NE ASP 455.A OD1 no hydrogen 2.873 N/A ARG 478.A NH1 ASP 529.A OD1 no hydrogen 2.787 N/A ARG 478.A NH2 ASP 455.A OD2 no hydrogen 2.835 N/A ARG 478.A NH2 ASP 529.A O no hydrogen 2.860 N/A ARG 478.A NH2 ASP 529.A OD1 no hydrogen 3.054 N/A MET 479.A N THR 454.A O no hydrogen 2.929 N/A ARG 480.A NE ASP 453.A OD2 no hydrogen 2.850 N/A ARG 480.A NH1 GLY 536.A O no hydrogen 2.899 N/A ARG 480.A NH2 ASP 453.A OD2 no hydrogen 2.925 N/A ARG 480.A NH2 GLY 536.A O no hydrogen 2.874 N/A TYR 481.A N ARG 478.A O no hydrogen 2.845 N/A TYR 481.A OH ASP 226.A OD2 no hydrogen 2.621 N/A ARG 482.A N MET 479.A O no hydrogen 3.165 N/A ARG 482.A NH1 MET 479.A O no hydrogen 2.897 N/A ARG 482.A NH1 THR 489.A O no hydrogen 2.801 N/A ARG 482.A NH2 THR 489.A OG1 no hydrogen 3.075 N/A ARG 482.A NH2 LEU 490.A O no hydrogen 3.514 N/A VAL 486.A N THR 484.A OG1 no hydrogen 2.988 N/A ASN 487.A N THR 484.A OG1 no hydrogen 3.368 N/A THR 489.A N ARG 480.A O no hydrogen 3.180 N/A ILE 491.A N VAL 452.A O no hydrogen 2.995 N/A GLU 492.A N TYR 497.A OH no hydrogen 2.899 N/A GLY 494.A N SER 449.A O no hydrogen 2.851 N/A GLU 495.A N GLU 492.A O no hydrogen 3.358 N/A TYR 497.A N VAL 447.A O no hydrogen 2.824 N/A VAL 499.A N LEU 445.A O no hydrogen 2.844 N/A ILE 501.A N ALA 443.A O no hydrogen 2.844 N/A MET 503.A N VAL 441.A O no hydrogen 2.956 N/A LEU 504.A N ASP 502.A OD1 no hydrogen 2.949 N/A THR 506.A N GLY 439.A O no hydrogen 3.196 N/A SER 507.A OG THR 438.A OG1 no hydrogen 2.821 N/A ASN 508.A N VAL 437.A O no hydrogen 2.842 N/A ASN 508.A ND2 ASP 462.A OD2 no hydrogen 2.968 N/A VAL 509.A N MET 336.A O no hydrogen 2.810 N/A PHE 510.A N VAL 435.A O no hydrogen 2.826 N/A GLY 513.A N LEU 431.A O no hydrogen 2.877 N/A HIS 514.A N LEU 511.A O no hydrogen 3.048 N/A HIS 514.A ND1 ASP 462.A OD1 no hydrogen 2.675 N/A ARG 515.A N VAL 463.A O no hydrogen 3.097 N/A ARG 515.A NH1 THR 428.A O no hydrogen 2.893 N/A ILE 516.A N THR 428.A OG1 no hydrogen 2.987 N/A MET 517.A N VAL 461.A O no hydrogen 2.898 N/A VAL 518.A N TYR 426.A O no hydrogen 2.822 N/A GLN 519.A N LYS 459.A O no hydrogen 2.879 N/A VAL 520.A N LEU 424.A O no hydrogen 2.812 N/A SER 521.A N THR 457.A O no hydrogen 3.195 N/A SER 521.A OG ASP 422.A O no hydrogen 2.642 N/A SER 522.A OG TYR 387.A OH no hydrogen 2.689 N/A SER 522.A OG ASP 455.A O no hydrogen 2.787 N/A PHE 525.A N VAL 395.A O no hydrogen 2.996 N/A LYS 527.A N SER 397.A OG no hydrogen 2.976 N/A LYS 527.A NZ THR 401.A O no hydrogen 3.032 N/A LYS 527.A NZ THR 401.A OG1 no hydrogen 3.003 N/A TYR 528.A N ASN 524.A O no hydrogen 2.899 N/A ASP 529.A N LEU 154.A O no hydrogen 2.837 N/A ARG 530.A NH1 PRO 391.A O no hydrogen 2.941 N/A ARG 530.A NH2 SER 200.A O no hydrogen 3.248 N/A ASN 531.A ND2 ASP 453.A OD2 no hydrogen 3.481 N/A SER 532.A OG THR 534.A OG1 no hydrogen 2.796 N/A SER 532.A OG GLU 541.A OE2 no hydrogen 2.768 N/A ASN 533.A ND2 CYS 547.A O no hydrogen 2.879 N/A THR 534.A OG1 SER 532.A OG no hydrogen 2.796 N/A THR 534.A OG1 GLU 541.A OE1 no hydrogen 2.738 N/A THR 534.A OG1 GLU 541.A OE2 no hydrogen 2.953 N/A GLY 536.A N THR 534.A OG1 no hydrogen 3.041 N/A ARG 540.A N VAL 537.A O no hydrogen 2.980 N/A ARG 540.A NH2 ASP 223.A OD1 no hydrogen 3.000 N/A GLU 541.A N ILE 538.A O no hydrogen 3.301 N/A GLN 542.A N GLU 545.A OE2 no hydrogen 3.154 N/A LEU 543.A N THR 202.A OG1 no hydrogen 3.277 N/A GLU 545.A N GLN 542.A O no hydrogen 3.137 N/A MET 546.A N LEU 543.A O no hydrogen 3.253 N/A CYS 547.A N SER 532.A O no hydrogen 2.995 N/A ALA 549.A N TYR 389.A O no hydrogen 2.882 N/A VAL 550.A N SER 450.A OG no hydrogen 2.905 N/A ASN 551.A N TYR 387.A O no hydrogen 2.934 N/A ASN 551.A ND2 THR 454.A OG1 no hydrogen 3.044 N/A ASN 551.A ND2 SER 522.A OG no hydrogen 2.808 N/A ARG 552.A N SER 448.A O no hydrogen 2.889 N/A ARG 552.A NE THR 386.A OG1 no hydrogen 2.778 N/A ILE 553.A N ASP 385.A O no hydrogen 2.907 N/A HIS 554.A N PHE 446.A O no hydrogen 2.824 N/A ARG 555.A N SER 383.A O no hydrogen 3.000 N/A ARG 555.A NE ASP 385.A OD2 no hydrogen 2.622 N/A ARG 555.A NH1 GLY 361.A O no hydrogen 2.873 N/A ARG 555.A NH2 GLY 361.A O no hydrogen 3.534 N/A ARG 555.A NH2 GLY 363.A O no hydrogen 2.889 N/A ARG 555.A NH2 ASP 385.A OD1 no hydrogen 2.967 N/A ARG 555.A NH2 ASP 385.A OD2 no hydrogen 3.458 N/A GLY 556.A N HIS 559.A O no hydrogen 3.132 N/A GLU 558.A N GLU 382.A OE2 no hydrogen 3.237 N/A HIS 559.A N GLU 382.A OE2 no hydrogen 3.149 N/A HIS 559.A ND1 GLU 382.A OE1 no hydrogen 2.964 N/A HIS 559.A ND1 GLU 382.A OE2 no hydrogen 3.205 N/A SER 561.A N HIS 559.A O no hydrogen 2.863 N/A SER 561.A OG HIS 554.A O no hydrogen 2.643 N/A HIS 562.A N ARG 444.A O no hydrogen 2.869 N/A HIS 562.A ND1 PRO 560.A O no hydrogen 2.669 N/A ILE 563.A N PHE 357.A O no hydrogen 3.009 N/A VAL 564.A N SER 442.A O no hydrogen 2.755 N/A LEU 565.A N THR 355.A O no hydrogen 2.888 N/A ILE 567.A N ALA 353.A O no hydrogen 2.902 N/A ILE 568.A N GLU 436.A O no hydrogen 2.984 N/A ARG 570.A NE ASP 351.A OD2 no hydrogen 3.249 N/A ARG 570.A NH1 GLU 344.A OE1 no hydrogen 3.295 N/A ARG 570.A NH1 GLU 344.A OE2 no hydrogen 2.797 N/A ARG 570.A NH2 GLU 344.A OE1 no hydrogen 2.756 N/A ARG 570.A NH2 ASP 351.A OD1 no hydrogen 3.219 N/A