Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8u0t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N THR 1.A O no hydrogen 3.042 N/A ALA 6.A N PRO 2.A O no hydrogen 3.168 N/A LYS 7.A N GLU 3.A O no hydrogen 2.958 N/A ILE 8.A N ASP 4.A O no hydrogen 2.949 N/A PHE 9.A N LEU 5.A O no hydrogen 3.029 N/A LEU 10.A N ALA 6.A O no hydrogen 2.996 N/A ASP 11.A N LYS 7.A O no hydrogen 2.840 N/A ASN 12.A N ILE 8.A O no hydrogen 2.996 N/A PHE 13.A N PHE 9.A O no hydrogen 2.966 N/A ASN 14.A N LEU 10.A O no hydrogen 2.818 N/A ASN 14.A ND2 GLN 77.A OE1 no hydrogen 3.146 N/A SER 15.A N ASP 11.A O no hydrogen 3.075 N/A SER 15.A OG ASP 11.A O no hydrogen 2.992 N/A SER 15.A OG ASN 12.A O no hydrogen 3.347 N/A GLU 16.A N ASN 12.A O no hydrogen 3.020 N/A ALA 17.A N PHE 13.A O no hydrogen 2.769 N/A GLU 18.A N ASN 14.A O no hydrogen 3.101 N/A LEU 20.A N ALA 17.A O no hydrogen 2.950 N/A SER 21.A N ALA 17.A O no hydrogen 2.895 N/A SER 21.A OG ALA 17.A O no hydrogen 3.245 N/A HIS 22.A ND1 LEU 332.A O no hydrogen 3.168 N/A GLN 23.A N LEU 20.A O no hydrogen 3.115 N/A SER 24.A N LEU 20.A O no hydrogen 3.468 N/A SER 24.A OG SER 21.A O no hydrogen 2.854 N/A SER 25.A N SER 21.A O no hydrogen 3.017 N/A SER 25.A OG SER 21.A O no hydrogen 3.162 N/A LEU 26.A N HIS 22.A O no hydrogen 2.908 N/A ALA 27.A N GLN 23.A O no hydrogen 3.019 N/A SER 28.A N SER 24.A O no hydrogen 3.208 N/A SER 28.A OG SER 24.A O no hydrogen 3.001 N/A TRP 29.A N SER 25.A O no hydrogen 3.032 N/A GLU 30.A N LEU 26.A O no hydrogen 3.100 N/A TYR 31.A N ALA 27.A O no hydrogen 3.139 N/A ASN 32.A N SER 28.A O no hydrogen 3.149 N/A THR 33.A N TRP 29.A O no hydrogen 3.011 N/A THR 33.A OG1 TRP 29.A O no hydrogen 3.219 N/A ASN 34.A N GLU 30.A O no hydrogen 2.781 N/A ILE 35.A N LYS 322.A O no hydrogen 3.293 N/A ASN 39.A ND2 ASN 34.A O no hydrogen 2.914 N/A ILE 40.A N SER 36.A O no hydrogen 3.158 N/A LYS 42.A N GLU 38.A O no hydrogen 3.277 N/A MET 43.A N ASN 39.A O no hydrogen 2.982 N/A ASP 44.A N ILE 40.A O no hydrogen 3.136 N/A GLU 45.A N GLN 41.A O no hydrogen 2.998 N/A ALA 46.A N LYS 42.A O no hydrogen 3.043 N/A GLY 47.A N MET 43.A O no hydrogen 3.048 N/A ALA 48.A N ASP 44.A O no hydrogen 2.829 N/A LYS 49.A N GLU 45.A O no hydrogen 3.241 N/A TRP 50.A N ALA 46.A O no hydrogen 3.360 N/A SER 51.A N GLY 47.A O no hydrogen 2.936 N/A ASP 52.A N ALA 48.A O no hydrogen 2.984 N/A PHE 53.A N LYS 49.A O no hydrogen 3.126 N/A TYR 54.A N TRP 50.A O no hydrogen 3.000 N/A GLU 55.A N SER 51.A O no hydrogen 2.969 N/A THR 56.A N ASP 52.A O no hydrogen 3.194 N/A THR 56.A OG1 ASP 52.A O no hydrogen 3.317 N/A GLN 57.A N PHE 53.A O no hydrogen 3.084 N/A SER 58.A N TYR 54.A O no hydrogen 2.805 N/A LYS 59.A N GLU 55.A O no hydrogen 3.014 N/A HIS 60.A N THR 56.A O no hydrogen 3.040 N/A ALA 61.A N GLN 57.A O no hydrogen 2.987 N/A LYS 62.A N LYS 59.A O no hydrogen 3.197 N/A LYS 62.A NZ GLN 82.A O no hydrogen 2.591 N/A ASN 63.A N HIS 60.A O no hydrogen 3.349 N/A GLU 68.A N SER 65.A O no hydrogen 3.246 N/A ILE 69.A N LEU 66.A O no hydrogen 3.146 N/A HIS 70.A N GLU 3.A OE1 no hydrogen 2.910 N/A THR 73.A N ASN 71.A OD1 no hydrogen 2.795 N/A THR 73.A OG1 ASN 71.A OD1 no hydrogen 2.974 N/A LYS 75.A N ASN 71.A O no hydrogen 3.010 N/A LEU 76.A N ASP 72.A O no hydrogen 3.164 N/A GLN 77.A NE2 THR 73.A O no hydrogen 2.870 N/A LEU 78.A N VAL 74.A O no hydrogen 3.093 N/A GLN 79.A N LYS 75.A O no hydrogen 2.996 N/A ILE 80.A N LEU 76.A O no hydrogen 3.099 N/A LEU 81.A N GLN 77.A O no hydrogen 3.262 N/A GLN 82.A N LEU 78.A O no hydrogen 2.889 N/A GLN 82.A NE2 ALA 61.A O no hydrogen 2.770 N/A GLN 82.A NE2 PHE 64.A O no hydrogen 3.118 N/A GLN 83.A N GLN 79.A O no hydrogen 3.255 N/A SER 84.A N LEU 81.A O no hydrogen 3.302 N/A LYS 93.A N SER 90.A O no hydrogen 2.729 N/A LYS 93.A NZ GLU 170.A OE1 no hydrogen 2.900 N/A LYS 93.A NZ GLU 170.A OE2 no hydrogen 2.941 N/A SER 94.A N SER 90.A O no hydrogen 2.950 N/A SER 94.A N GLU 91.A O no hydrogen 3.141 N/A SER 94.A OG SER 90.A O no hydrogen 3.411 N/A LYS 95.A N GLU 91.A O no hydrogen 2.979 N/A ARG 96.A N ASP 92.A O no hydrogen 3.150 N/A LEU 97.A N LYS 93.A O no hydrogen 3.302 N/A SER 99.A N ARG 96.A O no hydrogen 2.492 N/A ILE 100.A N ARG 96.A O no hydrogen 3.108 N/A ILE 100.A N LEU 97.A O no hydrogen 3.274 N/A LEU 101.A N LEU 97.A O no hydrogen 3.246 N/A MET 104.A N ILE 100.A O no hydrogen 2.831 N/A SER 105.A N LEU 101.A O no hydrogen 3.084 N/A SER 105.A OG ASN 489.A OD1 no hydrogen 3.197 N/A THR 106.A N ASN 102.A O no hydrogen 3.061 N/A THR 106.A OG1 ASN 102.A O no hydrogen 3.000 N/A ILE 107.A N ALA 103.A O no hydrogen 2.961 N/A TYR 108.A N MET 104.A O no hydrogen 3.030 N/A SER 109.A N SER 105.A O no hydrogen 2.931 N/A SER 109.A OG SER 105.A O no hydrogen 3.055 N/A THR 110.A N THR 106.A O no hydrogen 2.915 N/A THR 110.A OG1 THR 106.A O no hydrogen 2.865 N/A GLY 111.A N TYR 108.A O no hydrogen 3.265 N/A VAL 113.A N LEU 123.A O no hydrogen 2.902 N/A CYS 114.A SG PRO 119.A O no hydrogen 3.967 N/A ARG 115.A N ASN 118.A O no hydrogen 3.253 N/A ARG 115.A NH2 GLU 141.A OE2 no hydrogen 3.052 N/A ASN 118.A N ARG 115.A O no hydrogen 2.731 N/A GLN 120.A N ASN 118.A OD1 no hydrogen 2.767 N/A CYS 122.A SG PRO 119.A O no hydrogen 3.268 N/A LEU 123.A N VAL 113.A O no hydrogen 2.984 N/A LEU 129.A N LEU 124.A O no hydrogen 2.874 N/A ASP 130.A N LEU 125.A O no hydrogen 3.043 N/A ASN 131.A N GLY 128.A O no hydrogen 2.984 N/A ILE 132.A N LEU 129.A O no hydrogen 2.977 N/A MET 133.A N LEU 129.A O no hydrogen 3.158 N/A THR 135.A N ILE 132.A O no hydrogen 3.116 N/A THR 135.A OG1 ASN 131.A O no hydrogen 2.869 N/A THR 135.A OG1 ILE 132.A O no hydrogen 3.446 N/A SER 136.A N ILE 132.A O no hydrogen 2.886 N/A ASN 140.A N ASP 138.A OD1 no hydrogen 2.912 N/A GLU 141.A N ASP 138.A O no hydrogen 3.031 N/A ARG 142.A N ASP 138.A O no hydrogen 3.015 N/A ARG 142.A NE HIS 246.A O no hydrogen 2.771 N/A ARG 142.A NH1 MET 133.A O no hydrogen 2.677 N/A ARG 142.A NH1 SER 136.A O no hydrogen 3.040 N/A ARG 142.A NH2 MET 133.A O no hydrogen 2.824 N/A ARG 142.A NH2 HIS 246.A O no hydrogen 2.860 N/A LEU 143.A N TYR 139.A O no hydrogen 3.076 N/A TRP 144.A N ASN 140.A O no hydrogen 3.179 N/A TRP 144.A NE1 CYS 114.A O no hydrogen 3.096 N/A ALA 145.A N GLU 141.A O no hydrogen 3.074 N/A TRP 146.A N ARG 142.A O no hydrogen 2.992 N/A GLU 147.A N LEU 143.A O no hydrogen 2.905 N/A GLY 148.A N TRP 144.A O no hydrogen 2.781 N/A TRP 149.A N ALA 145.A O no hydrogen 3.215 N/A TRP 149.A NE1 SER 483.A O no hydrogen 3.104 N/A ARG 150.A NH1 TRP 146.A O no hydrogen 3.253 N/A ARG 150.A NH1 MET 251.A O no hydrogen 3.042 N/A ARG 150.A NH2 MET 251.A O no hydrogen 2.889 N/A ALA 151.A N GLU 147.A O no hydrogen 2.781 N/A GLU 152.A N TRP 149.A O no hydrogen 3.136 N/A VAL 153.A N TRP 149.A O no hydrogen 2.903 N/A LYS 155.A NZ THR 477.A OG1 no hydrogen 3.106 N/A GLN 156.A N VAL 153.A O no hydrogen 3.033 N/A GLN 156.A NE2 GLU 152.A O no hydrogen 2.866 N/A LEU 157.A N VAL 153.A O no hydrogen 3.280 N/A ARG 158.A NE GLU 162.A OE2 no hydrogen 2.991 N/A ARG 158.A NH1 GLU 476.A OE1 no hydrogen 3.335 N/A ARG 158.A NH1 TYR 478.A O no hydrogen 2.877 N/A ARG 158.A NH2 GLU 476.A OE1 no hydrogen 3.399 N/A TYR 161.A N LEU 157.A O no hydrogen 2.908 N/A GLU 162.A N ARG 158.A O no hydrogen 3.171 N/A GLU 163.A N PRO 159.A O no hydrogen 3.444 N/A TYR 164.A N LEU 160.A O no hydrogen 2.928 N/A TYR 164.A OH ASP 490.A OD1 no hydrogen 2.903 N/A VAL 165.A N TYR 161.A O no hydrogen 2.915 N/A VAL 166.A N GLU 162.A O no hydrogen 3.408 N/A LEU 167.A N GLU 163.A O no hydrogen 3.062 N/A LYS 168.A N TYR 164.A O no hydrogen 2.941 N/A LYS 168.A NZ TYR 180.A OH no hydrogen 3.357 N/A LYS 168.A NZ ASP 490.A OD2 no hydrogen 2.672 N/A ASN 169.A N VAL 165.A O no hydrogen 3.138 N/A ASN 169.A ND2 PHE 445.A O no hydrogen 2.887 N/A GLU 170.A N VAL 166.A O no hydrogen 3.294 N/A MET 171.A N LEU 167.A O no hydrogen 3.045 N/A ALA 172.A N LYS 168.A O no hydrogen 2.897 N/A ARG 173.A N ASN 169.A O no hydrogen 3.026 N/A GLY 174.A N MET 171.A O no hydrogen 2.968 N/A TYR 175.A N ALA 172.A O no hydrogen 3.071 N/A HIS 176.A N ARG 173.A O no hydrogen 3.137 N/A TYR 177.A N ALA 172.A O no hydrogen 3.346 N/A TYR 177.A OH GLN 83.A OE1 no hydrogen 3.338 N/A TYR 180.A N ASN 169.A OD1 no hydrogen 2.943 N/A TYR 180.A OH ASP 490.A OD1 no hydrogen 2.880 N/A ASP 182.A N ASP 179.A OD1 no hydrogen 2.730 N/A TYR 183.A N ASP 179.A O no hydrogen 3.091 N/A TRP 184.A N TYR 180.A O no hydrogen 3.003 N/A ARG 185.A NH1 ARG 200.A O no hydrogen 3.257 N/A ARG 186.A N TYR 183.A O no hydrogen 3.179 N/A TYR 188.A N ARG 185.A O no hydrogen 3.317 N/A TYR 188.A OH THR 498.A OG1 no hydrogen 2.955 N/A GLU 189.A N ARG 186.A O no hydrogen 3.122 N/A THR 190.A N TYR 198.A O no hydrogen 2.998 N/A THR 190.A OG1 LEU 196.A O no hydrogen 3.351 N/A LEU 196.A N SER 193.A O no hydrogen 2.796 N/A TYR 198.A N THR 190.A O no hydrogen 3.426 N/A SER 199.A N GLN 202.A OE1 no hydrogen 3.180 N/A ARG 200.A N GLU 189.A OE2 no hydrogen 3.183 N/A ARG 200.A NE ASP 182.A OD1 no hydrogen 3.422 N/A ARG 200.A NE ASP 182.A OD2 no hydrogen 2.856 N/A ARG 200.A NH1 GLU 189.A OE2 no hydrogen 2.988 N/A GLN 202.A N SER 199.A O no hydrogen 2.841 N/A LEU 203.A N ARG 200.A O no hydrogen 3.351 N/A THR 204.A OG1 ASP 201.A O no hydrogen 3.311 N/A LYS 205.A N GLN 202.A O no hydrogen 3.008 N/A ASP 206.A N GLN 202.A O no hydrogen 3.018 N/A VAL 207.A N LEU 203.A O no hydrogen 3.155 N/A ARG 209.A N LYS 205.A O no hydrogen 3.270 N/A ARG 209.A NE ASP 206.A OD1 no hydrogen 3.105 N/A ARG 209.A NH2 ASP 206.A OD1 no hydrogen 2.886 N/A ARG 209.A NH2 MET 560.A O no hydrogen 3.261 N/A ILE 210.A N ASP 206.A O no hydrogen 3.111 N/A PHE 211.A N VAL 207.A O no hydrogen 3.027 N/A ALA 212.A N GLU 208.A O no hydrogen 3.061 N/A GLU 213.A N ARG 209.A O no hydrogen 3.377 N/A ILE 214.A N ILE 210.A O no hydrogen 3.042 N/A ILE 214.A N PHE 211.A O no hydrogen 2.885 N/A LYS 215.A N PHE 211.A O no hydrogen 2.929 N/A LEU 217.A N ILE 214.A O no hydrogen 2.894 N/A TYR 218.A N ILE 214.A O no hydrogen 3.346 N/A TYR 218.A OH VAL 466.A O no hydrogen 2.754 N/A GLU 219.A N LYS 215.A O no hydrogen 2.880 N/A GLN 220.A N LEU 217.A O no hydrogen 3.161 N/A LEU 221.A N LEU 217.A O no hydrogen 3.158 N/A HIS 222.A N TYR 218.A O no hydrogen 2.781 N/A ALA 223.A N GLU 219.A O no hydrogen 3.000 N/A TYR 224.A N GLN 220.A O no hydrogen 3.163 N/A VAL 225.A N LEU 221.A O no hydrogen 3.032 N/A ARG 226.A N HIS 222.A O no hydrogen 2.918 N/A ARG 226.A NH1 GLY 241.A O no hydrogen 2.776 N/A ARG 226.A NH1 GLY 586.A O no hydrogen 2.912 N/A ARG 226.A NH2 GLY 586.A O no hydrogen 3.056 N/A THR 227.A N ALA 223.A O no hydrogen 3.079 N/A THR 227.A OG1 ALA 223.A O no hydrogen 3.400 N/A THR 227.A OG1 TYR 224.A O no hydrogen 3.004 N/A LYS 228.A N TYR 224.A O no hydrogen 3.103 N/A LEU 229.A N VAL 225.A O no hydrogen 2.743 N/A MET 230.A N ARG 226.A O no hydrogen 3.056 N/A ASP 231.A N LYS 228.A O no hydrogen 3.294 N/A THR 232.A N LEU 229.A O no hydrogen 2.923 N/A TYR 233.A N LEU 229.A O no hydrogen 3.095 N/A HIS 236.A N TYR 233.A O no hydrogen 3.395 N/A CYS 242.A SG ARG 463.A O no hydrogen 4.029 N/A LEU 243.A N GLY 467.A O no hydrogen 3.039 N/A ALA 245.A N VAL 469.A O no hydrogen 2.879 N/A LEU 247.A N PRO 244.A O no hydrogen 3.260 N/A TRP 252.A N ASP 250.A OD1 no hydrogen 2.922 N/A TRP 252.A NE1 SER 483.A O no hydrogen 2.938 N/A GLY 253.A N ASP 250.A OD1 no hydrogen 2.803 N/A ARG 254.A N ASP 250.A OD1 no hydrogen 3.131 N/A TRP 256.A N LEU 425.A O no hydrogen 3.064 N/A THR 257.A OG1 THR 426.A OG1 no hydrogen 3.041 N/A ASN 258.A ND2 GLY 249.A O no hydrogen 2.858 N/A LEU 259.A N TRP 256.A O no hydrogen 3.079 N/A TYR 260.A N THR 257.A O no hydrogen 3.137 N/A LEU 262.A N LEU 259.A O no hydrogen 2.950 N/A THR 263.A N LEU 259.A O no hydrogen 3.034 N/A THR 263.A N TYR 260.A O no hydrogen 2.921 N/A THR 263.A OG1 LEU 259.A O no hydrogen 2.745 N/A PHE 266.A N ASN 418.A OD1 no hydrogen 3.080 N/A LYS 269.A N PHE 266.A O no hydrogen 2.926 N/A LYS 269.A NZ ASP 412.A OD2 no hydrogen 3.227 N/A ASN 271.A ND2 TYR 260.A OH no hydrogen 3.200 N/A THR 275.A N ASP 273.A OD1 no hydrogen 2.967 N/A THR 275.A OG1 ASP 273.A OD1 no hydrogen 2.905 N/A MET 278.A N VAL 274.A O no hydrogen 2.877 N/A LEU 279.A N THR 275.A O no hydrogen 3.097 N/A ASN 280.A N ASP 276.A O no hydrogen 2.813 N/A GLN 281.A N ALA 277.A O no hydrogen 2.976 N/A GLN 281.A NE2 GLY 403.A O no hydrogen 2.783 N/A THR 282.A N LEU 279.A O no hydrogen 2.824 N/A TRP 283.A N MET 278.A O no hydrogen 2.872 N/A TRP 283.A NE1 GLN 281.A OE1 no hydrogen 3.059 N/A PHE 289.A N LYS 286.A O no hydrogen 2.942 N/A LYS 290.A N LYS 286.A O no hydrogen 3.166 N/A GLU 291.A N ARG 287.A O no hydrogen 2.975 N/A ALA 292.A N ILE 288.A O no hydrogen 3.076 N/A GLU 293.A N PHE 289.A O no hydrogen 2.899 N/A LYS 294.A N LYS 290.A O no hydrogen 3.075 N/A LYS 294.A NZ GLU 291.A OE2 no hydrogen 3.471 N/A PHE 295.A N GLU 291.A O no hydrogen 3.148 N/A PHE 296.A N ALA 292.A O no hydrogen 3.369 N/A VAL 297.A N GLU 293.A O no hydrogen 2.898 N/A SER 298.A N LYS 294.A O no hydrogen 2.956 N/A SER 298.A OG PHE 295.A O no hydrogen 2.741 N/A ILE 299.A N PHE 296.A O no hydrogen 3.187 N/A GLY 300.A N VAL 297.A O no hydrogen 2.975 N/A LEU 301.A N PHE 296.A O no hydrogen 3.241 N/A MET 304.A N GLU 293.A OE2 no hydrogen 2.841 N/A PHE 308.A N THR 305.A O no hydrogen 3.137 N/A TRP 309.A N THR 305.A O no hydrogen 3.406 N/A ASN 310.A N GLU 306.A O no hydrogen 3.083 N/A ASN 311.A N GLY 307.A O no hydrogen 3.109 N/A SER 312.A N PHE 308.A O no hydrogen 3.119 N/A VAL 324.A N ASN 32.A O no hydrogen 3.100 N/A HIS 326.A N VAL 324.A O no hydrogen 2.884 N/A THR 328.A N LYS 340.A O no hydrogen 3.153 N/A THR 328.A OG1 ALA 329.A O no hydrogen 3.451 N/A TRP 330.A N ARG 338.A O no hydrogen 2.774 N/A LEU 332.A N ASP 336.A O no hydrogen 2.895 N/A GLY 333.A N ASP 331.A OD1 no hydrogen 2.891 N/A ASP 336.A N GLY 333.A O no hydrogen 3.065 N/A ARG 338.A N TRP 330.A O no hydrogen 3.127 N/A ARG 338.A NE ASP 336.A OD1 no hydrogen 2.910 N/A ARG 338.A NH2 ASP 336.A OD2 no hydrogen 3.000 N/A LYS 340.A N THR 328.A O no hydrogen 3.000 N/A LYS 340.A NZ VAL 324.A O no hydrogen 2.832 N/A LYS 340.A NZ HIS 326.A O no hydrogen 3.199 N/A MET 341.A N MET 313.A O no hydrogen 2.823 N/A THR 343.A N LEU 314.A O no hydrogen 3.126 N/A THR 343.A OG1 LEU 314.A O no hydrogen 2.856 N/A LYS 344.A N ASP 349.A OD2 no hydrogen 2.903 N/A THR 346.A N LYS 344.A O no hydrogen 2.816 N/A MET 347.A N THR 275.A OG1 no hydrogen 3.101 N/A ASP 349.A N THR 346.A OG1 no hydrogen 3.210 N/A PHE 350.A N MET 347.A O no hydrogen 2.991 N/A LEU 351.A N MET 347.A O no hydrogen 3.248 N/A THR 352.A N GLU 348.A O no hydrogen 3.347 N/A THR 352.A OG1 GLU 348.A O no hydrogen 2.965 N/A ALA 353.A N ASP 349.A O no hydrogen 3.315 N/A HIS 354.A N PHE 350.A O no hydrogen 3.373 N/A HIS 355.A N LEU 351.A O no hydrogen 3.052 N/A GLU 356.A N THR 352.A O no hydrogen 2.852 N/A MET 357.A N ALA 353.A O no hydrogen 3.036 N/A GLY 358.A N HIS 354.A O no hydrogen 2.982 N/A HIS 359.A N HIS 355.A O no hydrogen 3.394 N/A HIS 359.A N GLU 356.A O no hydrogen 2.952 N/A ILE 360.A N GLU 356.A O no hydrogen 3.319 N/A GLN 361.A N MET 357.A O no hydrogen 3.156 N/A GLN 361.A NE2 PRO 302.A O no hydrogen 2.988 N/A TYR 362.A N GLY 358.A O no hydrogen 3.420 N/A ASP 363.A N HIS 359.A O no hydrogen 2.958 N/A MET 364.A N ILE 360.A O no hydrogen 3.071 N/A ALA 365.A N GLN 361.A O no hydrogen 3.091 N/A TYR 366.A N TYR 362.A O no hydrogen 3.392 N/A ALA 367.A N MET 364.A O no hydrogen 3.099 N/A GLN 369.A N TYR 366.A O no hydrogen 3.091 N/A GLN 369.A NE2 SER 540.A O no hydrogen 3.102 N/A LEU 373.A N PRO 370.A O no hydrogen 2.764 N/A ARG 374.A N TYR 371.A O no hydrogen 3.179 N/A ARG 374.A NE GLN 369.A O no hydrogen 2.841 N/A ARG 374.A NH2 GLU 18.A OE2 no hydrogen 3.153 N/A ASN 375.A N LEU 373.A O no hydrogen 2.902 N/A GLY 376.A N ASN 375.A OD1 no hydrogen 2.742 N/A PHE 381.A N ASN 378.A O no hydrogen 3.115 N/A ALA 384.A N GLY 380.A O no hydrogen 3.214 N/A VAL 385.A N PHE 381.A O no hydrogen 2.838 N/A GLY 386.A N HIS 382.A O no hydrogen 3.382 N/A GLU 387.A N GLU 383.A O no hydrogen 3.385 N/A VAL 388.A N ALA 384.A O no hydrogen 2.993 N/A SER 390.A N GLU 387.A O no hydrogen 2.915 N/A THR 395.A OG1 LEU 391.A O no hydrogen 3.444 N/A HIS 398.A N THR 395.A O no hydrogen 2.767 N/A LYS 400.A N PRO 396.A O no hydrogen 2.847 N/A LYS 400.A NZ GLU 411.A OE2 no hydrogen 2.865 N/A THR 401.A N LYS 397.A O no hydrogen 3.273 N/A THR 401.A OG1 LYS 397.A O no hydrogen 3.496 N/A THR 401.A OG1 HIS 398.A O no hydrogen 2.909 N/A MET 402.A N HIS 398.A O no hydrogen 2.941 N/A GLY 403.A N LEU 399.A O no hydrogen 2.880 N/A LEU 404.A N LEU 399.A O no hydrogen 2.950 N/A LEU 405.A N LEU 399.A O no hydrogen 3.266 N/A PHE 409.A N SER 406.A O no hydrogen 3.333 N/A THR 415.A N ASP 412.A OD1 no hydrogen 2.921 N/A THR 415.A OG1 ASP 412.A O no hydrogen 3.215 N/A THR 415.A OG1 ASP 412.A OD1 no hydrogen 3.083 N/A ASN 418.A N GLU 414.A O no hydrogen 3.460 N/A ASN 418.A ND2 ASN 271.A OD1 no hydrogen 3.211 N/A PHE 419.A N THR 415.A O no hydrogen 3.107 N/A LEU 420.A N GLU 416.A O no hydrogen 2.840 N/A PHE 421.A N ILE 417.A O no hydrogen 2.841 N/A GLN 423.A N PHE 419.A O no hydrogen 3.211 N/A ALA 424.A N LEU 420.A O no hydrogen 2.818 N/A LEU 425.A N PHE 421.A O no hydrogen 3.215 N/A THR 426.A N GLN 423.A O no hydrogen 2.910 N/A THR 426.A OG1 THR 257.A OG1 no hydrogen 3.041 N/A ILE 427.A N GLN 423.A O no hydrogen 2.883 N/A VAL 428.A N ALA 424.A O no hydrogen 2.850 N/A GLY 429.A N ALA 424.A O no hydrogen 3.044 N/A THR 430.A OG1 ARG 254.A O no hydrogen 2.950 N/A LEU 431.A N VAL 428.A O no hydrogen 3.154 N/A THR 434.A N THR 430.A O no hydrogen 3.095 N/A THR 434.A OG1 THR 430.A O no hydrogen 3.175 N/A TYR 435.A N LEU 431.A O no hydrogen 2.898 N/A MET 436.A N PRO 432.A O no hydrogen 3.192 N/A LEU 437.A N PHE 433.A O no hydrogen 3.017 N/A GLU 438.A N THR 434.A O no hydrogen 3.221 N/A LYS 439.A N TYR 435.A O no hydrogen 3.094 N/A TRP 440.A N MET 436.A O no hydrogen 2.957 N/A ARG 441.A N LEU 437.A O no hydrogen 3.200 N/A ARG 441.A NH1 GLU 438.A OE1 no hydrogen 3.087 N/A ARG 441.A NH1 TYR 491.A O no hydrogen 2.921 N/A ARG 441.A NH2 TYR 491.A O no hydrogen 2.949 N/A TRP 442.A N GLU 438.A O no hydrogen 2.952 N/A MET 443.A N LYS 439.A O no hydrogen 3.173 N/A VAL 444.A N TRP 440.A O no hydrogen 3.008 N/A PHE 445.A N ARG 441.A O no hydrogen 2.975 N/A LYS 446.A N TRP 442.A O no hydrogen 2.951 N/A GLY 447.A N MET 443.A O no hydrogen 2.948 N/A GLU 448.A N MET 443.A O no hydrogen 2.976 N/A GLU 453.A N PRO 450.A O no hydrogen 2.867 N/A TRP 454.A N LYS 451.A O no hydrogen 3.337 N/A MET 455.A N GLU 476.A OE1 no hydrogen 3.131 N/A THR 456.A OG1 GLU 453.A O no hydrogen 3.098 N/A LYS 457.A N GLU 453.A O no hydrogen 3.071 N/A LYS 457.A NZ GLU 460.A OE2 no hydrogen 2.933 N/A TRP 458.A N TRP 454.A O no hydrogen 3.072 N/A TRP 459.A N MET 455.A O no hydrogen 3.329 N/A TRP 459.A NE1 ASP 480.A OD2 no hydrogen 2.934 N/A GLU 460.A N THR 456.A O no hydrogen 3.086 N/A MET 461.A N LYS 457.A O no hydrogen 3.022 N/A LYS 462.A N TRP 458.A O no hydrogen 3.109 N/A ARG 463.A N TRP 459.A O no hydrogen 3.099 N/A LYS 464.A N GLU 460.A O no hydrogen 3.379 N/A ILE 465.A N MET 461.A O no hydrogen 2.849 N/A VAL 466.A N LYS 462.A O no hydrogen 2.866 N/A GLY 467.A N LYS 462.A O no hydrogen 3.245 N/A VAL 469.A N LEU 243.A O no hydrogen 2.838 N/A GLU 470.A N GLU 470.A OE1 no hydrogen 2.602 N/A THR 477.A N ASP 475.A OD1 no hydrogen 2.983 N/A THR 477.A OG1 ASP 475.A OD1 no hydrogen 2.860 N/A SER 483.A N ASP 480.A O no hydrogen 3.177 N/A SER 483.A OG ASP 480.A O no hydrogen 2.914 N/A HIS 486.A NE2 TYR 496.A OH no hydrogen 3.020 N/A ALA 488.A N LEU 484.A O no hydrogen 3.136 N/A ASN 489.A N PHE 485.A O no hydrogen 3.074 N/A TYR 491.A N HIS 486.A O no hydrogen 2.897 N/A SER 492.A OG GLU 438.A OE2 no hydrogen 3.531 N/A PHE 493.A N GLU 438.A OE2 no hydrogen 3.449 N/A TYR 496.A N PHE 493.A O no hydrogen 3.420 N/A TYR 496.A OH HIS 486.A NE2 no hydrogen 3.020 N/A TYR 497.A N ILE 494.A O no hydrogen 2.930 N/A TYR 497.A OH VAL 207.A O no hydrogen 3.087 N/A THR 498.A N ILE 494.A O no hydrogen 3.189 N/A THR 498.A OG1 TYR 188.A OH no hydrogen 2.955 N/A THR 500.A N TYR 497.A O no hydrogen 3.249 N/A THR 500.A OG1 TYR 496.A O no hydrogen 3.491 N/A PHE 502.A N THR 498.A O no hydrogen 2.958 N/A GLU 503.A N ARG 499.A O no hydrogen 2.850 N/A GLN 505.A N ILE 501.A O no hydrogen 3.434 N/A PHE 506.A N PHE 502.A O no hydrogen 2.898 N/A HIS 507.A N GLU 503.A O no hydrogen 2.983 N/A HIS 507.A NE2 LEU 520.A O no hydrogen 3.112 N/A GLU 508.A N PHE 504.A O no hydrogen 3.010 N/A ALA 509.A N GLN 505.A O no hydrogen 3.195 N/A LEU 510.A N PHE 506.A O no hydrogen 2.973 N/A CYS 511.A N HIS 507.A O no hydrogen 2.974 N/A CYS 511.A SG HIS 507.A O no hydrogen 3.255 N/A ARG 512.A N GLU 508.A O no hydrogen 2.984 N/A ILE 513.A N ALA 509.A O no hydrogen 3.094 N/A ALA 514.A N LEU 510.A O no hydrogen 3.123 N/A LYS 515.A N ARG 512.A O no hydrogen 2.955 N/A HIS 516.A N CYS 511.A O no hydrogen 3.043 N/A HIS 516.A NE2 PRO 519.A O no hydrogen 2.893 N/A HIS 521.A NE2 GLU 416.A OE2 no hydrogen 2.870 N/A LYS 522.A N PRO 519.A O no hydrogen 3.287 N/A CYS 523.A SG HIS 507.A NE2 no hydrogen 3.227 N/A CYS 523.A SG LEU 520.A O no hydrogen 3.553 N/A SER 526.A N ASP 524.A OD1 no hydrogen 2.839 N/A SER 526.A OG ASP 524.A OD1 no hydrogen 3.016 N/A ASN 527.A N SER 298.A OG no hydrogen 3.266 N/A SER 528.A N ILE 525.A O no hydrogen 3.203 N/A GLY 532.A N SER 528.A O no hydrogen 3.238 N/A LYS 533.A N THR 529.A O no hydrogen 2.977 N/A LYS 534.A NZ ASP 553.A O no hydrogen 3.048 N/A LEU 535.A N ALA 531.A O no hydrogen 3.078 N/A HIS 536.A N GLY 532.A O no hydrogen 2.980 N/A GLN 537.A N LYS 533.A O no hydrogen 3.147 N/A MET 538.A N LEU 535.A O no hydrogen 2.802 N/A LEU 539.A N LEU 535.A O no hydrogen 3.051 N/A LEU 539.A N HIS 536.A O no hydrogen 3.101 N/A SER 540.A N HIS 536.A O no hydrogen 3.008 N/A GLY 542.A N LEU 539.A O no hydrogen 3.239 N/A LYS 543.A N LEU 373.A O no hydrogen 3.269 N/A SER 544.A N VAL 541.A O no hydrogen 3.158 N/A SER 544.A OG VAL 541.A O no hydrogen 2.803 N/A TRP 547.A NE1 TYR 188.A O no hydrogen 3.043 N/A THR 548.A OG1 LEU 196.A O no hydrogen 3.139 N/A SER 549.A N PRO 546.A O no hydrogen 2.871 N/A VAL 550.A N PRO 546.A O no hydrogen 3.172 N/A LEU 551.A N TRP 547.A O no hydrogen 2.905 N/A LYS 552.A N THR 548.A O no hydrogen 3.183 N/A ASP 553.A N SER 549.A O no hydrogen 3.231 N/A PHE 554.A N LEU 551.A O no hydrogen 2.909 N/A VAL 555.A N LEU 551.A O no hydrogen 2.747 N/A ASP 556.A N LYS 552.A O no hydrogen 2.859 N/A LYS 558.A NZ ASP 195.A O no hydrogen 2.869 N/A ASP 561.A N GLN 505.A OE1 no hydrogen 2.921 N/A GLY 563.A N ASP 561.A OD1 no hydrogen 2.836 N/A LEU 565.A N VAL 562.A O no hydrogen 2.736 N/A LEU 566.A N VAL 562.A O no hydrogen 3.121 N/A ARG 567.A N GLY 563.A O no hydrogen 2.972 N/A ARG 567.A NE GLU 508.A OE2 no hydrogen 3.133 N/A ARG 567.A NH2 GLU 508.A OE1 no hydrogen 2.916 N/A TYR 568.A N PRO 564.A O no hydrogen 3.005 N/A TYR 568.A OH GLN 423.A OE1 no hydrogen 2.800 N/A PHE 569.A N LEU 565.A O no hydrogen 3.202 N/A GLU 570.A N ARG 567.A O no hydrogen 3.039 N/A TYR 573.A N PHE 569.A O no hydrogen 3.024 N/A THR 574.A N GLU 570.A O no hydrogen 2.965 N/A THR 574.A OG1 GLU 570.A O no hydrogen 3.546 N/A THR 574.A OG1 PRO 571.A O no hydrogen 2.741 N/A TRP 575.A N PRO 571.A O no hydrogen 3.032 N/A TRP 575.A N LEU 572.A O no hydrogen 2.901 N/A LEU 576.A N LEU 572.A O no hydrogen 2.853 N/A LYS 577.A N TYR 573.A O no hydrogen 3.094 N/A GLU 578.A N TRP 575.A O no hydrogen 3.162 N/A GLN 579.A N LEU 576.A O no hydrogen 2.933 N/A ASN 580.A N LEU 576.A O no hydrogen 3.000 N/A ASN 580.A ND2 GLN 220.A O no hydrogen 3.180 N/A ASN 580.A ND2 GLN 220.A OE1 no hydrogen 2.970 N/A ARG 581.A NE GLU 578.A O no hydrogen 2.868 N/A TRP 587.A NE1 ARG 463.A O no hydrogen 2.916 N/A ASP 590.A N ASN 588.A O no hydrogen 2.900 N/A TYR 594.A OH GLU 470.A OE2 no hydrogen 3.243 N/A ALA 595.A N SER 592.A O no hydrogen 2.984 N/A ILE 599.A N PHE 651.A O no hydrogen 2.844 N/A VAL 601.A N PHE 649.A O no hydrogen 2.776 N/A ASN 606.A N ASN 604.A OD1 no hydrogen 2.805 N/A GLU 607.A N ASN 604.A O no hydrogen 2.988 N/A MET 608.A N ASN 604.A O no hydrogen 3.270 N/A TYR 609.A N ASN 605.A O no hydrogen 3.118 N/A LEU 610.A N ASN 606.A O no hydrogen 3.458 N/A PHE 611.A N GLU 607.A O no hydrogen 3.041 N/A ARG 612.A N MET 608.A O no hydrogen 2.969 N/A ARG 612.A NH1 GLU 635.A O no hydrogen 3.032 N/A ARG 612.A NH1 GLU 635.A OE1 no hydrogen 2.585 N/A SER 613.A N TYR 609.A O no hydrogen 3.003 N/A SER 614.A N LEU 610.A O no hydrogen 2.931 N/A VAL 615.A N PHE 611.A O no hydrogen 3.018 N/A ALA 616.A N ARG 612.A O no hydrogen 3.061 N/A TYR 617.A N SER 613.A O no hydrogen 2.926 N/A TYR 617.A OH GLU 621.A OE2 no hydrogen 3.214 N/A ALA 618.A N SER 614.A O no hydrogen 2.981 N/A MET 619.A N VAL 615.A O no hydrogen 3.010 N/A ARG 620.A N ALA 616.A O no hydrogen 2.988 N/A ARG 620.A NE PHE 633.A O no hydrogen 2.785 N/A ARG 620.A NH2 PHE 633.A O no hydrogen 2.807 N/A GLU 621.A N TYR 617.A O no hydrogen 3.224 N/A TYR 622.A N ALA 618.A O no hydrogen 2.967 N/A PHE 623.A N MET 619.A O no hydrogen 3.122 N/A LEU 624.A N ARG 620.A O no hydrogen 3.241 N/A LYS 625.A N GLU 621.A O no hydrogen 2.875 N/A THR 626.A N TYR 622.A O no hydrogen 2.888 N/A LYS 627.A N PHE 623.A O no hydrogen 2.969 N/A GLN 629.A N PHE 623.A O no hydrogen 3.179 N/A GLY 634.A N ASP 637.A OD2 no hydrogen 2.790 N/A GLU 636.A N GLU 636.A OE1 no hydrogen 2.668 N/A ASP 637.A N GLY 634.A O no hydrogen 3.134 N/A VAL 638.A N GLU 635.A O no hydrogen 3.248 N/A TRP 639.A N TYR 652.A O no hydrogen 2.890 N/A SER 641.A N ASN 650.A O no hydrogen 2.618 N/A LYS 644.A N SER 648.A O no hydrogen 2.836 N/A ILE 647.A N LYS 644.A O no hydrogen 2.936 N/A SER 648.A N LYS 644.A O no hydrogen 3.111 N/A PHE 649.A N VAL 601.A O no hydrogen 2.996 N/A ASN 650.A N SER 641.A O no hydrogen 2.794 N/A PHE 651.A N ILE 599.A O no hydrogen 2.948 N/A TYR 652.A N TRP 639.A O no hydrogen 3.081 N/A THR 654.A N ASP 637.A O no hydrogen 3.155 N/A SER 655.A N ASP 661.A O no hydrogen 3.023 N/A ARG 657.A N ASP 637.A OD1 no hydrogen 3.271 N/A ASN 658.A N SER 655.A O no hydrogen 2.987 N/A ILE 663.A N VAL 653.A O no hydrogen 3.037 N/A ARG 665.A N GLN 597.A OE1 no hydrogen 2.885 N/A GLU 667.A N PRO 664.A O no hydrogen 2.833 N/A VAL 668.A N PRO 664.A O no hydrogen 3.203 N/A GLU 669.A N ARG 665.A O no hydrogen 2.892 N/A ALA 671.A N GLU 667.A O no hydrogen 3.153 N/A ILE 672.A N VAL 668.A O no hydrogen 3.031 N/A ARG 673.A N GLU 669.A O no hydrogen 2.935 N/A MET 674.A N GLY 670.A O no hydrogen 2.794 N/A SER 675.A N ALA 671.A O no hydrogen 3.122 N/A