Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8plg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N GLN 4.A OE1 no hydrogen 3.194 N/A TRP 5.A N GLY 1.A O no hydrogen 3.052 N/A TRP 5.A NE1 GLY 453.A O no hydrogen 3.081 N/A LEU 6.A N THR 2.A O no hydrogen 3.044 N/A ARG 7.A N SER 3.A O no hydrogen 3.167 N/A LYS 8.A N GLN 4.A O no hydrogen 3.217 N/A THR 9.A N TRP 5.A O no hydrogen 2.959 N/A THR 9.A OG1 TRP 5.A O no hydrogen 3.023 N/A VAL 10.A N LEU 6.A O no hydrogen 2.950 N/A ASP 11.A N ARG 7.A O no hydrogen 3.103 N/A SER 12.A N LYS 8.A O no hydrogen 3.235 N/A SER 12.A OG LYS 8.A O no hydrogen 3.138 N/A SER 12.A OG LEU 450.A O no hydrogen 2.627 N/A ALA 13.A N THR 9.A O no hydrogen 3.059 N/A ILE 16.A N PHE 71.A O no hydrogen 3.123 N/A LEU 17.A N ALA 41.A O no hydrogen 2.966 N/A PHE 18.A N GLN 69.A O no hydrogen 2.910 N/A SER 19.A N ILE 43.A O no hydrogen 3.027 N/A SER 19.A OG LYS 20.A O no hydrogen 3.265 N/A SER 19.A OG GLU 44.A OE1 no hydrogen 3.125 N/A LYS 20.A NZ GLN 55.A OE1 no hydrogen 2.927 N/A THR 21.A N ASP 46.A OD1 no hydrogen 2.995 N/A THR 21.A OG1 ASP 46.A OD2 no hydrogen 2.566 N/A CYS 23.A N LYS 20.A O no hydrogen 3.411 N/A CYS 23.A SG VAL 67.A O no hydrogen 4.017 N/A LYS 27.A N CYS 23.A O no hydrogen 3.191 N/A LYS 27.A NZ ASP 31.A OD1 no hydrogen 2.935 N/A LYS 27.A NZ ASP 31.A OD2 no hydrogen 3.214 N/A LYS 28.A N PRO 24.A O no hydrogen 3.141 N/A VAL 29.A N TYR 25.A O no hydrogen 3.326 N/A LYS 30.A N CYS 26.A O no hydrogen 2.917 N/A LYS 30.A NZ GLU 44.A OE2 no hydrogen 2.827 N/A ASP 31.A N LYS 27.A O no hydrogen 2.898 N/A VAL 32.A N LYS 28.A O no hydrogen 3.143 N/A LEU 33.A N VAL 29.A O no hydrogen 2.931 N/A ALA 34.A N LYS 30.A O no hydrogen 2.782 N/A GLU 35.A N ASP 31.A O no hydrogen 2.966 N/A ALA 36.A N VAL 32.A O no hydrogen 3.026 N/A LYS 37.A N ALA 34.A O no hydrogen 3.155 N/A ILE 38.A N LEU 33.A O no hydrogen 2.977 N/A LYS 39.A NZ ALA 122.A O no hydrogen 3.119 N/A LYS 39.A NZ GLN 215.A OE1 no hydrogen 2.745 N/A HIS 40.A ND1 ALA 41.A O no hydrogen 3.100 N/A ALA 41.A N VAL 15.A O no hydrogen 2.975 N/A ILE 43.A N LEU 17.A O no hydrogen 3.007 N/A LEU 45.A N SER 19.A O no hydrogen 2.789 N/A GLN 47.A N GLU 44.A O no hydrogen 3.176 N/A LEU 48.A N LEU 45.A O no hydrogen 3.337 N/A ASN 50.A ND2 THR 2.A OG1 no hydrogen 2.969 N/A GLY 51.A N LEU 48.A O no hydrogen 3.061 N/A ILE 54.A N ASN 50.A O no hydrogen 2.967 N/A GLN 55.A N GLY 51.A O no hydrogen 3.000 N/A GLN 55.A NE2 GLU 65.A O no hydrogen 3.004 N/A LYS 56.A N SER 52.A O no hydrogen 3.305 N/A CYS 57.A N ALA 53.A O no hydrogen 3.026 N/A CYS 57.A SG ALA 53.A O no hydrogen 3.677 N/A LEU 58.A N ILE 54.A O no hydrogen 2.946 N/A ALA 59.A N LYS 56.A O no hydrogen 3.247 N/A SER 60.A N CYS 57.A O no hydrogen 3.076 N/A SER 60.A OG CYS 57.A O no hydrogen 3.456 N/A PHE 61.A N LEU 58.A O no hydrogen 2.968 N/A SER 62.A N LEU 58.A O no hydrogen 3.152 N/A SER 62.A OG LEU 58.A O no hydrogen 3.164 N/A SER 62.A OG ILE 64.A O no hydrogen 3.136 N/A SER 62.A OG GLN 69.A OE1 no hydrogen 2.591 N/A LYS 63.A N ALA 59.A O no hydrogen 2.968 N/A ILE 64.A N SER 62.A OG no hydrogen 3.276 N/A GLN 69.A N PHE 18.A O no hydrogen 3.173 N/A GLN 69.A NE2 ILE 64.A O no hydrogen 3.167 N/A GLN 69.A NE2 THR 66.A O no hydrogen 3.023 N/A MET 70.A N GLY 78.A O no hydrogen 3.117 N/A PHE 71.A N ILE 16.A O no hydrogen 3.014 N/A VAL 72.A N LYS 75.A O no hydrogen 2.943 N/A ARG 73.A N ALA 14.A O no hydrogen 2.972 N/A ARG 73.A NE ASP 104.A OD1 no hydrogen 2.806 N/A ARG 73.A NE ASP 104.A OD2 no hydrogen 3.420 N/A ARG 73.A NH1 VAL 96.A O no hydrogen 2.880 N/A ARG 73.A NH1 GLU 98.A O no hydrogen 3.019 N/A ARG 73.A NH2 VAL 96.A O no hydrogen 3.536 N/A ARG 73.A NH2 ASP 104.A OD2 no hydrogen 2.889 N/A LYS 75.A N VAL 72.A O no hydrogen 3.085 N/A ILE 77.A N MET 70.A O no hydrogen 2.754 N/A THR 82.A N ASP 79.A OD1 no hydrogen 3.099 N/A THR 82.A OG1 ASP 79.A OD1 no hydrogen 3.188 N/A VAL 83.A N ASP 79.A O no hydrogen 3.029 N/A LEU 84.A N SER 80.A O no hydrogen 3.150 N/A LYS 85.A N GLN 81.A O no hydrogen 2.966 N/A LYS 85.A NZ GLU 91.A OE1 no hydrogen 2.848 N/A TYR 86.A N THR 82.A O no hydrogen 3.048 N/A TYR 87.A N VAL 83.A O no hydrogen 3.019 N/A TYR 87.A OH GLU 35.A OE1 no hydrogen 2.339 N/A SER 88.A N LEU 84.A O no hydrogen 2.860 N/A SER 88.A OG LEU 84.A O no hydrogen 2.943 N/A ASN 89.A N LYS 85.A O no hydrogen 3.203 N/A ASN 89.A ND2 LYS 85.A O no hydrogen 2.773 N/A ASP 90.A N TYR 87.A O no hydrogen 3.104 N/A GLU 91.A N TYR 86.A O no hydrogen 2.755 N/A ILE 95.A N GLU 91.A O no hydrogen 3.321 N/A VAL 96.A N LEU 92.A O no hydrogen 3.076 N/A ASN 97.A N ALA 93.A O no hydrogen 3.190 N/A GLU 98.A N ILE 95.A O no hydrogen 3.207 N/A SER 99.A OG TYR 101.A O no hydrogen 3.150 N/A TYR 101.A N SER 99.A OG no hydrogen 2.863 N/A ASP 102.A N THR 244.A OG1 no hydrogen 2.986 N/A TYR 103.A N THR 244.A O no hydrogen 3.087 N/A LEU 105.A N LYS 127.A O no hydrogen 3.124 N/A ILE 106.A N LYS 247.A O no hydrogen 3.112 N/A VAL 107.A N ALA 129.A O no hydrogen 2.868 N/A ILE 108.A N ILE 249.A O no hydrogen 2.948 N/A GLY 109.A N LEU 131.A O no hydrogen 2.784 N/A GLY 110.A N ASP 132.A OD1 no hydrogen 2.851 N/A SER 112.A OG THR 436.A OG1 no hydrogen 3.178 N/A LEU 115.A N GLY 111.A O no hydrogen 2.938 N/A ALA 116.A N SER 112.A O no hydrogen 3.390 N/A ALA 117.A N GLY 113.A O no hydrogen 2.907 N/A GLY 118.A N GLY 114.A O no hydrogen 2.976 N/A LYS 119.A N LEU 115.A O no hydrogen 3.085 N/A GLU 120.A N ALA 116.A O no hydrogen 3.262 N/A ALA 121.A N ALA 117.A O no hydrogen 2.971 N/A ALA 122.A N GLY 118.A O no hydrogen 3.176 N/A LYS 123.A N GLU 120.A O no hydrogen 3.225 N/A LYS 123.A NZ LYS 119.A O no hydrogen 3.419 N/A LYS 123.A NZ ASN 214.A OD1 no hydrogen 3.341 N/A TYR 124.A N ALA 121.A O no hydrogen 3.096 N/A TYR 124.A OH GLU 120.A OE2 no hydrogen 3.050 N/A GLY 125.A N ALA 122.A O no hydrogen 3.143 N/A LYS 127.A N ASP 104.A OD2 no hydrogen 2.893 N/A LYS 127.A NZ ASP 102.A O no hydrogen 2.902 N/A THR 128.A OG1 ALA 126.A O no hydrogen 2.907 N/A ALA 129.A N LEU 105.A O no hydrogen 3.009 N/A VAL 130.A N THR 217.A O no hydrogen 2.891 N/A LEU 131.A N VAL 107.A O no hydrogen 2.877 N/A ASP 132.A N LEU 219.A O no hydrogen 3.135 N/A TYR 133.A OH GLU 135.A OE2 no hydrogen 3.060 N/A THR 137.A N THR 141.A O no hydrogen 3.042 N/A THR 137.A OG1 THR 141.A OG1 no hydrogen 3.351 N/A THR 137.A OG1 ASP 273.A OD1 no hydrogen 2.776 N/A GLY 140.A N THR 137.A O no hydrogen 2.910 N/A THR 141.A N THR 137.A OG1 no hydrogen 3.089 N/A THR 141.A OG1 THR 137.A OG1 no hydrogen 3.351 N/A THR 141.A OG1 ASP 273.A OD1 no hydrogen 2.682 N/A THR 142.A OG1 VAL 134.A O no hydrogen 3.458 N/A GLY 146.A N GLY 110.A O no hydrogen 3.223 N/A ASN 151.A N GLY 147.A O no hydrogen 3.229 N/A ASN 151.A ND2 GLY 144.A O no hydrogen 3.068 N/A ASN 151.A ND2 GLY 147.A O no hydrogen 2.964 N/A VAL 152.A N THR 148.A O no hydrogen 2.827 N/A CYS 154.A SG THR 436.A OG1 no hydrogen 3.627 N/A ILE 155.A N CYS 149.A O no hydrogen 3.080 N/A LYS 157.A N GLY 153.A O no hydrogen 3.037 N/A LYS 157.A NZ GLU 295.A OE1 no hydrogen 2.858 N/A LYS 157.A NZ GLU 295.A OE2 no hydrogen 3.330 N/A LYS 158.A N CYS 154.A O no hydrogen 3.042 N/A LEU 159.A N ILE 155.A O no hydrogen 3.124 N/A MET 160.A N PRO 156.A O no hydrogen 2.917 N/A HIS 161.A N LYS 157.A O no hydrogen 2.913 N/A HIS 161.A NE2 GLU 472.A OE2 no hydrogen 2.692 N/A GLN 162.A N LYS 158.A O no hydrogen 2.867 N/A ALA 163.A N LEU 159.A O no hydrogen 3.083 N/A GLY 164.A N MET 160.A O no hydrogen 2.987 N/A LEU 165.A N HIS 161.A O no hydrogen 2.825 N/A LEU 166.A N GLN 162.A O no hydrogen 3.039 N/A SER 167.A N GLY 164.A O no hydrogen 3.045 N/A SER 167.A OG GLY 164.A O no hydrogen 2.621 N/A HIS 168.A N LEU 165.A O no hydrogen 3.025 N/A ALA 169.A N LEU 165.A O no hydrogen 3.058 N/A LEU 170.A N LEU 166.A O no hydrogen 2.912 N/A GLU 171.A N SER 167.A O no hydrogen 3.245 N/A ASP 172.A N HIS 168.A O no hydrogen 2.873 N/A ALA 173.A N ALA 169.A O no hydrogen 2.929 N/A GLU 174.A N GLU 171.A O no hydrogen 3.333 N/A PHE 176.A N ASP 172.A O no hydrogen 3.191 N/A GLY 177.A N GLU 174.A O no hydrogen 3.152 N/A TRP 178.A N ALA 173.A O no hydrogen 2.934 N/A ARG 182.A N GLU 174.A OE2 no hydrogen 2.769 N/A ARG 182.A NH1 ARG 182.A O no hydrogen 2.932 N/A SER 183.A N ASP 181.A OD1 no hydrogen 3.197 N/A SER 183.A OG ASP 181.A OD1 no hydrogen 3.133 N/A SER 183.A OG ASP 181.A OD2 no hydrogen 3.448 N/A LYS 184.A N ASP 181.A O no hydrogen 3.057 N/A ILE 185.A N ARG 182.A O no hydrogen 3.048 N/A TRP 189.A NE1 LEU 277.A O no hydrogen 3.069 N/A SER 190.A OG ASN 188.A OD1 no hydrogen 2.909 N/A THR 191.A N ASN 188.A OD1 no hydrogen 3.111 N/A MET 192.A N ASN 188.A O no hydrogen 3.277 N/A VAL 193.A N TRP 189.A O no hydrogen 2.884 N/A GLU 194.A N SER 190.A O no hydrogen 2.931 N/A GLY 195.A N THR 191.A O no hydrogen 3.314 N/A VAL 196.A N MET 192.A O no hydrogen 2.986 N/A GLN 197.A N VAL 193.A O no hydrogen 2.875 N/A GLN 197.A NE2 PHE 275.A O no hydrogen 2.913 N/A SER 198.A N GLU 194.A O no hydrogen 2.961 N/A HIS 199.A N GLY 195.A O no hydrogen 3.189 N/A ILE 200.A N VAL 196.A O no hydrogen 2.978 N/A GLY 201.A N GLN 197.A O no hydrogen 2.842 N/A SER 202.A N SER 198.A O no hydrogen 3.101 N/A SER 202.A OG HIS 199.A O no hydrogen 2.797 N/A LEU 203.A N HIS 199.A O no hydrogen 3.168 N/A ASN 204.A N ILE 200.A O no hydrogen 2.924 N/A ASN 204.A ND2 LEU 145.A O no hydrogen 2.816 N/A ASN 204.A ND2 ASN 151.A OD1 no hydrogen 3.053 N/A TRP 205.A N GLY 201.A O no hydrogen 3.106 N/A GLY 206.A N SER 202.A O no hydrogen 2.930 N/A TYR 207.A N LEU 203.A O no hydrogen 2.967 N/A LYS 208.A N ASN 204.A O no hydrogen 3.288 N/A VAL 209.A N TRP 205.A O no hydrogen 2.941 N/A ALA 210.A N GLY 206.A O no hydrogen 2.889 N/A LEU 211.A N TYR 207.A O no hydrogen 2.941 N/A ARG 212.A N LYS 208.A O no hydrogen 3.083 N/A ASP 213.A N VAL 209.A O no hydrogen 2.858 N/A ASN 214.A N ALA 210.A O no hydrogen 3.111 N/A ASN 214.A N LEU 211.A O no hydrogen 3.125 N/A ASN 214.A ND2 ALA 210.A O no hydrogen 2.987 N/A GLN 215.A N ARG 212.A O no hydrogen 3.029 N/A GLN 215.A NE2 ASP 213.A O no hydrogen 3.299 N/A VAL 216.A N LEU 211.A O no hydrogen 2.954 N/A THR 217.A N THR 128.A O no hydrogen 3.024 N/A LEU 219.A N VAL 130.A O no hydrogen 3.002 N/A LYS 222.A N THR 234.A O no hydrogen 2.999 N/A ARG 224.A N GLN 232.A O no hydrogen 2.907 N/A LEU 225.A N VAL 394.A O no hydrogen 2.896 N/A ILE 226.A N GLU 230.A O no hydrogen 3.127 N/A SER 227.A OG GLU 230.A OE1 no hydrogen 3.170 N/A HIS 229.A ND1 GLY 245.A O no hydrogen 2.791 N/A GLU 230.A N SER 227.A O no hydrogen 3.336 N/A VAL 231.A N ILE 243.A O no hydrogen 2.834 N/A GLN 232.A N ARG 224.A O no hydrogen 2.841 N/A ILE 233.A N SER 241.A O no hydrogen 2.878 N/A THR 234.A N LYS 222.A O no hydrogen 3.017 N/A ASP 235.A N LYS 239.A O no hydrogen 3.119 N/A GLN 238.A N ASP 235.A O no hydrogen 3.065 N/A LYS 239.A N ASP 235.A OD1 no hydrogen 2.812 N/A SER 241.A N ILE 233.A O no hydrogen 3.071 N/A ILE 243.A N VAL 231.A O no hydrogen 2.941 N/A THR 244.A N ASP 102.A OD2 no hydrogen 3.013 N/A GLY 245.A N HIS 229.A O no hydrogen 2.952 N/A ASN 246.A N TYR 103.A O no hydrogen 2.972 N/A LYS 247.A N ASP 104.A O no hydrogen 2.961 N/A ILE 248.A N ASN 421.A O no hydrogen 2.995 N/A ILE 249.A N ILE 106.A O no hydrogen 3.036 N/A LEU 250.A N TYR 423.A O no hydrogen 2.781 N/A ALA 251.A N ILE 108.A O no hydrogen 2.846 N/A ARG 255.A N GLU 388.A O no hydrogen 3.048 N/A ARG 255.A NE ASP 272.A OD2 no hydrogen 2.974 N/A ARG 255.A NH1 GLU 135.A O no hydrogen 2.822 N/A ARG 255.A NH2 GLU 135.A O no hydrogen 3.007 N/A ARG 255.A NH2 ASP 272.A OD2 no hydrogen 3.098 N/A LYS 257.A N GLY 386.A O no hydrogen 2.878 N/A ILE 261.A N PRO 259.A O no hydrogen 2.995 N/A ALA 264.A N ILE 261.A O no hydrogen 3.381 N/A GLU 266.A N GLU 266.A OE1 no hydrogen 2.664 N/A TYR 267.A N GLY 263.A O no hydrogen 3.005 N/A GLY 268.A N ALA 264.A O no hydrogen 3.069 N/A ILE 269.A N VAL 381.A O no hydrogen 2.926 N/A THR 270.A N ASP 273.A OD2 no hydrogen 3.364 N/A ASP 272.A N THR 270.A OG1 no hydrogen 3.141 N/A ASP 273.A N THR 270.A O no hydrogen 2.963 N/A LEU 274.A N THR 270.A O no hydrogen 3.152 N/A SER 276.A N ASP 273.A O no hydrogen 3.417 N/A LEU 277.A N LEU 274.A O no hydrogen 3.239 N/A LYS 283.A N GLU 379.A OE1 no hydrogen 2.851 N/A LYS 283.A NZ GLU 376.A OE2 no hydrogen 2.930 N/A LYS 283.A NZ GLU 377.A O no hydrogen 2.813 N/A THR 284.A N ASP 306.A O no hydrogen 2.924 N/A THR 284.A OG1 GLY 282.A O no hydrogen 2.770 N/A LEU 285.A N THR 380.A O no hydrogen 3.006 N/A VAL 286.A N THR 308.A O no hydrogen 2.817 N/A ILE 287.A N ILE 382.A O no hydrogen 2.895 N/A GLY 288.A N MET 310.A O no hydrogen 3.201 N/A ALA 293.A N SER 290.A OG no hydrogen 3.257 N/A LEU 294.A N SER 290.A O no hydrogen 3.051 N/A GLU 295.A N TYR 291.A O no hydrogen 2.917 N/A CYS 296.A N VAL 292.A O no hydrogen 3.073 N/A CYS 296.A SG VAL 292.A O no hydrogen 3.399 N/A ALA 297.A N ALA 293.A O no hydrogen 3.016 N/A GLY 298.A N LEU 294.A O no hydrogen 2.915 N/A PHE 299.A N GLU 295.A O no hydrogen 3.176 N/A LEU 300.A N CYS 296.A O no hydrogen 3.168 N/A ALA 301.A N ALA 297.A O no hydrogen 3.148 N/A SER 302.A N GLY 298.A O no hydrogen 3.202 N/A SER 302.A OG GLY 298.A O no hydrogen 3.417 N/A LEU 303.A N PHE 299.A O no hydrogen 2.958 N/A GLY 304.A N ALA 301.A O no hydrogen 3.026 N/A GLY 305.A N LEU 300.A O no hydrogen 2.926 N/A THR 308.A N THR 284.A O no hydrogen 2.996 N/A VAL 309.A N LYS 337.A O no hydrogen 2.824 N/A MET 310.A N VAL 286.A O no hydrogen 2.848 N/A VAL 311.A N ALA 339.A O no hydrogen 2.945 N/A LEU 316.A N ALA 289.A O no hydrogen 2.973 N/A ARG 317.A NH2 SER 313.A OG no hydrogen 2.883 N/A PHE 319.A N LEU 316.A O no hydrogen 2.961 N/A GLN 321.A N GLU 481.A OE2 no hydrogen 2.973 N/A GLN 321.A NE2 LEU 315.A O no hydrogen 3.021 N/A GLN 321.A NE2 PHE 319.A O no hydrogen 3.225 N/A GLN 322.A NE2 TYR 514.A OH no hydrogen 3.118 N/A MET 323.A N ASP 320.A OD1 no hydrogen 3.015 N/A ALA 324.A N ASP 320.A O no hydrogen 2.950 N/A GLU 325.A N GLN 321.A O no hydrogen 3.045 N/A LYS 326.A N GLN 322.A O no hydrogen 3.152 N/A VAL 327.A N MET 323.A O no hydrogen 2.927 N/A GLY 328.A N ALA 324.A O no hydrogen 3.037 N/A ASP 329.A N GLU 325.A O no hydrogen 2.822 N/A TYR 330.A N LYS 326.A O no hydrogen 3.146 N/A MET 331.A N VAL 327.A O no hydrogen 3.304 N/A GLU 332.A N GLY 328.A O no hydrogen 2.974 N/A ASN 333.A N ASP 329.A O no hydrogen 3.068 N/A HIS 334.A N MET 331.A O no hydrogen 3.050 N/A VAL 336.A N MET 331.A O no hydrogen 3.111 N/A LYS 337.A N VAL 307.A O no hydrogen 3.083 N/A LYS 337.A NZ ASP 306.A OD1 no hydrogen 2.483 N/A ALA 339.A N VAL 309.A O no hydrogen 2.836 N/A LYS 340.A NZ GLU 332.A OE2 no hydrogen 2.821 N/A CYS 342.A N VAL 311.A O no hydrogen 3.012 N/A CYS 342.A SG HIS 367.A O no hydrogen 3.762 N/A VAL 343.A N HIS 367.A O no hydrogen 3.099 N/A ASP 345.A N LYS 365.A O no hydrogen 2.728 N/A ILE 346.A N PRO 262.A O no hydrogen 3.025 N/A LYS 347.A N LEU 363.A O no hydrogen 2.864 N/A LEU 349.A N LEU 361.A O no hydrogen 2.834 N/A LYS 350.A N LEU 361.A O no hydrogen 3.072 N/A ASP 353.A N LYS 358.A O no hydrogen 3.022 N/A GLU 355.A N ASP 353.A OD1 no hydrogen 2.991 N/A ASN 356.A N ASP 353.A OD1 no hydrogen 2.861 N/A LYS 358.A N ASP 353.A O no hydrogen 3.172 N/A LEU 361.A N LYS 350.A O no hydrogen 3.109 N/A LEU 362.A N PHE 378.A O no hydrogen 2.720 N/A LEU 363.A N LYS 347.A O no hydrogen 2.857 N/A VAL 364.A N GLU 376.A O no hydrogen 3.042 N/A GLY 366.A N PHE 374.A O no hydrogen 2.829 N/A HIS 367.A N VAL 343.A O no hydrogen 3.015 N/A HIS 367.A ND1 ASP 345.A OD2 no hydrogen 2.891 N/A TYR 368.A N LYS 372.A O no hydrogen 3.022 N/A THR 369.A N LEU 341.A O no hydrogen 3.017 N/A GLY 371.A N TYR 368.A O no hydrogen 3.005 N/A LYS 372.A N ASP 370.A OD1 no hydrogen 3.055 N/A LYS 372.A NZ ASP 370.A OD2 no hydrogen 3.106 N/A LYS 373.A NZ GLY 371.A O no hydrogen 3.342 N/A PHE 374.A N GLY 366.A O no hydrogen 2.853 N/A GLU 376.A N VAL 364.A O no hydrogen 3.222 N/A PHE 378.A N LEU 362.A O no hydrogen 2.927 N/A GLU 379.A N LYS 283.A O no hydrogen 2.789 N/A THR 380.A N LYS 283.A O no hydrogen 3.206 N/A THR 380.A OG1 PRO 281.A O no hydrogen 2.834 N/A ILE 382.A N LEU 285.A O no hydrogen 2.898 N/A PHE 383.A N ILE 269.A O no hydrogen 2.868 N/A ALA 384.A N ILE 287.A O no hydrogen 2.866 N/A GLU 388.A N ARG 255.A O no hydrogen 2.998 N/A LYS 393.A N GLN 390.A O no hydrogen 3.210 N/A LYS 393.A NZ GLN 390.A OE1 no hydrogen 3.368 N/A VAL 394.A N LEU 391.A O no hydrogen 2.851 N/A CYS 396.A N LEU 225.A O no hydrogen 3.102 N/A CYS 396.A SG THR 398.A OG1 no hydrogen 2.817 N/A VAL 399.A N CYS 396.A O no hydrogen 3.001 N/A LYS 402.A N THR 418.A OG1 no hydrogen 2.992 N/A ASP 404.A N ARG 408.A O no hydrogen 2.846 N/A ASN 406.A N ASP 404.A OD1 no hydrogen 2.887 N/A GLY 407.A N ASP 404.A O no hydrogen 3.097 N/A ARG 408.A N ASP 404.A OD1 no hydrogen 2.890 N/A ARG 408.A NE GLU 254.A OE2 no hydrogen 2.855 N/A ARG 408.A NH2 GLU 254.A OE2 no hydrogen 2.702 N/A VAL 409.A N ILE 428.A O no hydrogen 2.782 N/A VAL 410.A N LYS 402.A O no hydrogen 3.125 N/A CYS 411.A SG VAL 409.A O no hydrogen 3.821 N/A CYS 411.A SG GLU 415.A O no hydrogen 3.712 N/A THR 412.A N GLN 416.A O no hydrogen 3.025 N/A THR 412.A OG1 ASP 414.A OD1 no hydrogen 2.324 N/A THR 412.A OG1 GLN 416.A O no hydrogen 3.507 N/A GLU 415.A N THR 412.A O no hydrogen 2.957 N/A GLN 416.A N ASP 414.A OD1 no hydrogen 3.386 N/A GLN 416.A NE2 SER 420.A O no hydrogen 2.952 N/A THR 417.A N VAL 422.A O no hydrogen 2.984 N/A THR 417.A OG1 VAL 419.A O no hydrogen 2.951 N/A THR 417.A OG1 VAL 422.A O no hydrogen 3.002 N/A THR 418.A OG1 GLY 400.A O no hydrogen 2.651 N/A VAL 419.A N THR 417.A OG1 no hydrogen 2.973 N/A ASN 421.A ND2 PRO 228.A O no hydrogen 2.885 N/A ASN 421.A ND2 ASN 246.A O no hydrogen 3.103 N/A VAL 422.A N VAL 419.A O no hydrogen 2.845 N/A TYR 423.A N ILE 248.A O no hydrogen 2.870 N/A ALA 424.A N GLU 415.A O no hydrogen 3.075 N/A ILE 425.A N LEU 250.A O no hydrogen 3.148 N/A ASN 429.A N GLY 426.A O no hydrogen 3.060 N/A ASN 429.A ND2 ALA 424.A O no hydrogen 3.159 N/A ALA 430.A N VAL 409.A O no hydrogen 2.945 N/A LYS 432.A N ASN 429.A O no hydrogen 3.375 N/A LYS 432.A NZ ASN 429.A OD1 no hydrogen 2.911 N/A LYS 432.A NZ ALA 430.A O no hydrogen 3.293 N/A GLN 434.A NE2 GLU 254.A OE2 no hydrogen 3.260 N/A GLN 434.A NE2 ASP 427.A O no hydrogen 2.899 N/A THR 436.A OG1 SER 112.A OG no hydrogen 3.178 N/A ALA 439.A N LEU 435.A O no hydrogen 3.189 N/A ILE 440.A N THR 436.A O no hydrogen 3.053 N/A GLN 441.A N PRO 437.A O no hydrogen 3.030 N/A ALA 442.A N VAL 438.A O no hydrogen 2.862 N/A GLY 443.A N ALA 439.A O no hydrogen 2.989 N/A ARG 444.A N ILE 440.A O no hydrogen 2.969 N/A TYR 445.A N GLN 441.A O no hydrogen 2.955 N/A LEU 446.A N ALA 442.A O no hydrogen 2.946 N/A ALA 447.A N GLY 443.A O no hydrogen 3.071 N/A ARG 448.A N ARG 444.A O no hydrogen 3.197 N/A ARG 448.A NE GLU 120.A OE2 no hydrogen 2.735 N/A ARG 448.A NH2 GLU 120.A OE2 no hydrogen 3.502 N/A ARG 449.A N TYR 445.A O no hydrogen 3.120 N/A ARG 449.A NH1 GLU 456.A O no hydrogen 2.962 N/A ARG 449.A NH2 ASP 414.A O no hydrogen 3.009 N/A ARG 449.A NH2 GLU 415.A OE1 no hydrogen 2.894 N/A LEU 450.A N LEU 446.A O no hydrogen 2.869 N/A PHE 451.A N ALA 447.A O no hydrogen 3.010 N/A ALA 452.A N ARG 448.A O no hydrogen 2.941 N/A ALA 454.A N ARG 448.A O no hydrogen 3.172 N/A TYR 460.A OH GLU 415.A OE2 no hydrogen 2.726 N/A SER 461.A N ASP 459.A OD1 no hydrogen 3.008 N/A SER 461.A OG ASP 459.A OD1 no hydrogen 2.747 N/A THR 465.A N ALA 475.A O no hydrogen 2.915 N/A THR 466.A OG1 THR 465.A O no hydrogen 2.916 N/A VAL 467.A N TYR 473.A O no hydrogen 2.879 N/A PHE 468.A N GLU 295.A OE2 no hydrogen 2.763 N/A THR 469.A OG1 LEU 471.A O no hydrogen 2.855 N/A TYR 473.A N VAL 467.A O no hydrogen 3.095 N/A TYR 473.A OH HIS 531.A ND1 no hydrogen 2.815 N/A GLY 474.A N VAL 532.A O no hydrogen 2.909 N/A ALA 475.A N THR 465.A O no hydrogen 3.027 N/A CYS 476.A N LEU 530.A O no hydrogen 2.933 N/A CYS 476.A SG ASN 462.A O no hydrogen 3.306 N/A LEU 478.A N LEU 528.A O no hydrogen 2.905 N/A GLU 480.A N ASP 320.A OD2 no hydrogen 3.011 N/A GLU 481.A N GLU 481.A OE1 no hydrogen 2.850 N/A ASP 482.A N SER 479.A OG no hydrogen 3.118 N/A ALA 483.A N SER 479.A O no hydrogen 3.028 N/A ILE 484.A N GLU 480.A O no hydrogen 3.050 N/A GLU 485.A N GLU 481.A O no hydrogen 3.007 N/A LYS 486.A N ASP 482.A O no hydrogen 3.059 N/A LYS 486.A NZ TYR 487.A OH no hydrogen 3.287 N/A TYR 487.A N ALA 483.A O no hydrogen 3.064 N/A GLY 488.A N ILE 484.A O no hydrogen 2.923 N/A ASP 491.A N GLY 488.A O no hydrogen 3.033 N/A ILE 492.A N ASP 489.A O no hydrogen 3.443 N/A GLU 493.A N CYS 519.A O no hydrogen 3.043 N/A TYR 495.A N LEU 517.A O no hydrogen 3.030 N/A HIS 496.A N VAL 576.A O no hydrogen 2.981 N/A HIS 496.A ND1 TYR 514.A OH no hydrogen 2.767 N/A SER 497.A N MET 515.A O no hydrogen 3.085 N/A SER 497.A OG ASN 498.A O no hydrogen 2.786 N/A ASN 498.A N PRO 584.A O no hydrogen 3.027 N/A ASN 498.A ND2 CYS 513.A O no hydrogen 2.953 N/A PHE 499.A N CYS 513.A O no hydrogen 3.122 N/A LYS 500.A NZ ASP 510.A OD1 no hydrogen 2.540 N/A TRP 504.A N PRO 501.A O no hydrogen 2.966 N/A THR 505.A N LEU 502.A O no hydrogen 3.039 N/A THR 505.A OG1 LEU 502.A O no hydrogen 2.746 N/A HIS 508.A N THR 505.A O no hydrogen 3.010 N/A TYR 514.A N LEU 533.A O no hydrogen 3.140 N/A TYR 514.A OH HIS 496.A ND1 no hydrogen 2.767 N/A MET 515.A N SER 497.A O no hydrogen 2.953 N/A LYS 516.A N HIS 531.A O no hydrogen 2.971 N/A LYS 516.A NZ ASP 320.A OD1 no hydrogen 3.237 N/A LYS 516.A NZ ASP 320.A OD2 no hydrogen 2.846 N/A LYS 516.A NZ GLN 322.A OE1 no hydrogen 2.782 N/A LYS 516.A NZ GLU 480.A OE1 no hydrogen 2.881 N/A LEU 517.A N TYR 495.A O no hydrogen 2.857 N/A VAL 518.A N GLY 529.A O no hydrogen 2.923 N/A CYS 519.A N GLU 493.A O no hydrogen 2.831 N/A CYS 519.A SG MET 525.A O no hydrogen 3.972 N/A ARG 520.A N ARG 526.A O no hydrogen 2.931 N/A ARG 520.A NE ASP 491.A OD2 no hydrogen 3.116 N/A LYS 521.A N ASP 491.A O no hydrogen 2.860 N/A SER 522.A N ASP 491.A OD1 no hydrogen 2.923 N/A SER 522.A OG ASP 491.A OD1 no hydrogen 3.216 N/A SER 522.A OG ASP 491.A OD2 no hydrogen 2.953 N/A ASP 523.A N ARG 520.A O no hydrogen 3.279 N/A ARG 526.A N ASP 523.A O no hydrogen 3.048 N/A ARG 526.A NE ASP 523.A OD2 no hydrogen 3.050 N/A ARG 526.A NH1 GLY 551.A O no hydrogen 2.949 N/A ARG 526.A NH2 ASP 523.A OD1 no hydrogen 2.956 N/A VAL 527.A N ALA 552.A O no hydrogen 2.956 N/A LEU 528.A N VAL 518.A O no hydrogen 2.766 N/A GLY 529.A N VAL 518.A O no hydrogen 3.234 N/A LEU 530.A N CYS 476.A O no hydrogen 2.797 N/A HIS 531.A N LYS 516.A O no hydrogen 3.102 N/A HIS 531.A ND1 TYR 473.A OH no hydrogen 2.815 N/A HIS 531.A NE2 LEU 478.A O no hydrogen 2.941 N/A VAL 532.A N GLY 474.A O no hydrogen 2.974 N/A LEU 533.A N TYR 514.A O no hydrogen 2.844 N/A GLY 534.A N GLU 472.A O no hydrogen 2.989 N/A ALA 537.A N GLU 472.A OE1 no hydrogen 3.002 N/A ILE 540.A N ASN 536.A O no hydrogen 3.071 N/A THR 541.A N ALA 537.A O no hydrogen 3.047 N/A THR 541.A OG1 ALA 537.A O no hydrogen 2.825 N/A GLN 542.A N GLY 538.A O no hydrogen 3.212 N/A GLN 542.A NE2 GLN 542.A O no hydrogen 3.106 N/A TYR 544.A OH SER 568.A O no hydrogen 3.025 N/A TYR 544.A OH SER 568.A OG no hydrogen 2.874 N/A ALA 545.A N GLN 542.A O no hydrogen 3.047 N/A VAL 546.A N GLY 543.A O no hydrogen 3.217 N/A ILE 548.A N TYR 544.A O no hydrogen 2.898 N/A LYS 549.A N ALA 545.A O no hydrogen 2.963 N/A LYS 549.A NZ ASP 459.A OD2 no hydrogen 2.875 N/A LYS 549.A NZ SER 461.A O no hydrogen 2.862 N/A MET 550.A N VAL 546.A O no hydrogen 3.127 N/A GLY 551.A N ILE 548.A O no hydrogen 2.952 N/A ALA 552.A N ALA 547.A O no hydrogen 3.002 N/A THR 553.A N ASP 556.A OD2 no hydrogen 2.985 N/A THR 553.A OG1 ASP 556.A OD2 no hydrogen 3.287 N/A LYS 554.A N MET 525.A O no hydrogen 2.963 N/A LYS 554.A NZ ASP 558.A OD1 no hydrogen 2.652 N/A LYS 554.A NZ ASP 558.A OD2 no hydrogen 3.297 N/A LYS 554.A NZ LEU 574.A O no hydrogen 2.869 N/A ASP 556.A N THR 553.A OG1 no hydrogen 3.327 N/A PHE 557.A N THR 553.A O no hydrogen 3.305 N/A ASP 558.A N LYS 554.A O no hydrogen 2.947 N/A ARG 559.A N ALA 555.A O no hydrogen 3.023 N/A ARG 559.A NE ASP 556.A OD1 no hydrogen 3.066 N/A ARG 559.A NH2 ASP 556.A OD1 no hydrogen 3.098 N/A THR 560.A OG1 ASP 556.A O no hydrogen 2.829 N/A HIS 564.A ND1 GLU 569.A OE2 no hydrogen 2.643 N/A THR 566.A N GLU 569.A OE2 no hydrogen 3.292 N/A THR 566.A OG1 ILE 563.A O no hydrogen 2.800 N/A SER 568.A OG TYR 544.A OH no hydrogen 2.874 N/A GLU 569.A N THR 566.A OG1 no hydrogen 3.150 N/A THR 570.A N CYS 567.A O no hydrogen 3.212 N/A THR 570.A OG1 CYS 567.A O no hydrogen 3.410 N/A PHE 571.A N SER 568.A O no hydrogen 3.088 N/A THR 572.A N GLU 569.A O no hydrogen 2.905 N/A THR 572.A OG1 GLU 569.A O no hydrogen 2.672 N/A THR 573.A N THR 570.A O no hydrogen 3.404 N/A LYS 578.A N VAL 494.A O no hydrogen 2.921 N/A LYS 578.A NZ GLN 322.A OE1 no hydrogen 2.878 N/A LYS 578.A NZ GLU 480.A OE1 no hydrogen 2.761 N/A LYS 578.A NZ GLU 480.A OE2 no hydrogen 3.520 N/A SER 580.A N THR 577.A O no hydrogen 3.322 N/A SER 580.A N THR 577.A OG1 no hydrogen 3.164 N/A SER 580.A OG THR 577.A O no hydrogen 2.781 N/A GLY 581.A N LYS 578.A O no hydrogen 3.073 N/A VAL 582.A N SER 580.A OG no hydrogen 3.276 N/A ILE 585.A N SER 583.A OG no hydrogen 3.170 N/A VAL 586.A N ASN 511.A OD1 no hydrogen 2.950 N/A