Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2e9b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A NH1 ASP 84.A OD2 no hydrogen 2.620 N/A GLU 9.A N LEU 21.A O no hydrogen 2.956 N/A TYR 11.A N THR 19.A O no hydrogen 2.905 N/A TYR 11.A OH GLU 9.A OE2 no hydrogen 2.852 N/A VAL 12.A N GLN 86.A O no hydrogen 3.293 N/A ASP 13.A N ILE 17.A O no hydrogen 3.130 N/A MET 15.A N ASP 14.A OD2 no hydrogen 2.640 N/A ILE 17.A N ASP 14.A O no hydrogen 3.098 N/A ILE 18.A N CYS 61.A O no hydrogen 2.963 N/A THR 19.A N TYR 11.A O no hydrogen 2.719 N/A THR 19.A OG1 ASP 13.A OD2 no hydrogen 2.953 N/A VAL 20.A N TYR 59.A O no hydrogen 2.935 N/A LEU 21.A N GLU 9.A O no hydrogen 2.862 N/A ILE 22.A N TYR 57.A O no hydrogen 3.008 N/A ALA 24.A N ALA 55.A O no hydrogen 2.969 N/A GLN 26.A N ALA 24.A O no hydrogen 2.691 N/A LYS 27.A N ALA 24.A O no hydrogen 3.069 N/A ILE 29.A N GLN 26.A O no hydrogen 2.729 N/A MET 30.A N GLN 26.A O no hydrogen 2.987 N/A THR 31.A OG1 ILE 29.A O no hydrogen 3.566 N/A THR 31.A OG1 SER 78.A OG no hydrogen 2.857 N/A ARG 35.A N ARG 76.A O no hydrogen 2.991 N/A ARG 35.A NE ASP 42.A OD1 no hydrogen 3.010 N/A ARG 35.A NH2 ASP 42.A OD1 no hydrogen 2.756 N/A LEU 36.A N PHE 43.A O no hydrogen 3.130 N/A GLU 37.A N CYS 74.A O no hydrogen 2.546 N/A THR 41.A N THR 38.A O no hydrogen 2.750 N/A THR 41.A OG1 THR 38.A OG1 no hydrogen 2.584 N/A PHE 43.A N LEU 36.A O no hydrogen 3.179 N/A LEU 45.A N PHE 34.A O no hydrogen 3.154 N/A ALA 46.A N VAL 62.A O no hydrogen 3.085 N/A ARG 48.A N VAL 60.A O no hydrogen 3.033 N/A TYR 51.A N LYS 58.A O no hydrogen 3.019 N/A SER 52.A OG LEU 53.A O no hydrogen 3.027 N/A LEU 53.A N LYS 56.A O no hydrogen 2.755 N/A LYS 56.A NZ GLU 9.A OE1 no hydrogen 2.806 N/A TYR 57.A N ILE 22.A O no hydrogen 2.911 N/A TYR 57.A OH GLU 50.A OE2 no hydrogen 2.438 N/A LYS 58.A N TYR 51.A O no hydrogen 2.883 N/A LYS 58.A NZ TYR 51.A OH no hydrogen 3.006 N/A TYR 59.A N VAL 20.A O no hydrogen 2.964 N/A VAL 60.A N GLU 49.A O no hydrogen 2.920 N/A CYS 61.A N ILE 18.A O no hydrogen 2.850 N/A VAL 62.A N ALA 46.A O no hydrogen 2.727 N/A SER 63.A N ASN 16.A O no hydrogen 3.165 N/A SER 63.A OG ASN 16.A O no hydrogen 3.376 N/A SER 63.A OG HIS 65.A O no hydrogen 2.991 N/A HIS 73.A NE2 THR 68.A O no hydrogen 2.930 N/A CYS 74.A N GLU 37.A O no hydrogen 2.595 N/A VAL 75.A N THR 83.A O no hydrogen 3.051 N/A ARG 76.A N ARG 35.A O no hydrogen 2.805 N/A ALA 77.A N HIS 81.A O no hydrogen 3.043 N/A SER 78.A N THR 31.A O no hydrogen 2.937 N/A SER 78.A OG THR 31.A O no hydrogen 2.802 N/A SER 78.A OG THR 31.A OG1 no hydrogen 2.857 N/A SER 78.A OG PRO 32.A O no hydrogen 3.219 N/A SER 79.A OG HIS 81.A ND1 no hydrogen 2.673 N/A GLY 80.A N ALA 77.A O no hydrogen 2.850 N/A HIS 81.A ND1 SER 79.A OG no hydrogen 2.673 N/A LYS 82.A NZ GLU 37.A OE2 no hydrogen 3.017 N/A THR 83.A N VAL 75.A O no hydrogen 3.266 N/A THR 83.A OG1 PHE 8.A O no hydrogen 2.799 N/A LEU 85.A N HIS 73.A O no hydrogen 2.936 N/A GLN 86.A N ALA 10.A O no hydrogen 2.963 N/A ALA 89.A N ASP 13.A OD1 no hydrogen 2.956 N/A VAL 90.A N VAL 12.A O no hydrogen 3.430 N/A ARG 92.A N ALA 89.A O no hydrogen 2.956 N/A ARG 92.A NE HIS 360.A ND1 no hydrogen 3.218 N/A THR 93.A N VAL 90.A O no hydrogen 3.184 N/A THR 93.A OG1 VAL 90.A O no hydrogen 2.620 N/A PHE 96.A N THR 93.A OG1 no hydrogen 3.290 N/A ASP 97.A N THR 93.A O no hydrogen 3.114 N/A ASP 98.A N ALA 94.A O no hydrogen 2.900 N/A GLU 99.A N ALA 95.A O no hydrogen 3.166 N/A PHE 100.A N PHE 96.A O no hydrogen 3.061 N/A TYR 101.A N ASP 97.A O no hydrogen 2.908 N/A TYR 101.A OH ASP 103.A OD1 no hydrogen 2.846 N/A GLY 107.A N LYS 118.A O no hydrogen 2.992 N/A VAL 109.A N VAL 116.A O no hydrogen 2.938 N/A TYR 110.A OH ASP 158.A OD1 no hydrogen 2.649 N/A HIS 114.A ND1 ASP 113.A OD2 no hydrogen 2.780 N/A THR 115.A N VAL 155.A O no hydrogen 2.993 N/A VAL 116.A N VAL 109.A O no hydrogen 2.954 N/A PHE 117.A N VAL 153.A O no hydrogen 2.980 N/A LYS 118.A N GLY 107.A O no hydrogen 2.902 N/A LYS 118.A NZ TYR 102.A OH no hydrogen 3.203 N/A LYS 118.A NZ GLU 105.A O no hydrogen 2.796 N/A VAL 119.A N TYR 151.A O no hydrogen 3.119 N/A TRP 120.A NE1 PHE 100.A O no hydrogen 2.975 N/A ALA 121.A N GLY 149.A O no hydrogen 2.974 N/A ALA 124.A N ALA 121.A O no hydrogen 3.360 N/A THR 125.A N CYS 169.A O no hydrogen 3.062 N/A SER 126.A OG THR 125.A O no hydrogen 2.616 N/A ALA 128.A N CYS 167.A O no hydrogen 3.002 N/A VAL 129.A N PHE 141.A O no hydrogen 3.000 N/A LYS 130.A N LEU 165.A O no hydrogen 2.697 N/A LYS 130.A NZ GLU 176.A OE2 no hydrogen 2.643 N/A LEU 131.A N ARG 139.A O no hydrogen 2.786 N/A SER 132.A N GLU 163.A O no hydrogen 3.150 N/A SER 132.A OG GLU 163.A OE1 no hydrogen 2.552 N/A ARG 139.A N LEU 131.A O no hydrogen 2.959 N/A PHE 141.A N VAL 129.A O no hydrogen 3.125 N/A MET 143.A N ALA 127.A O no hydrogen 2.986 N/A THR 144.A N ALA 152.A O no hydrogen 2.761 N/A ARG 145.A NH1 PRO 122.A O no hydrogen 3.359 N/A ARG 145.A NH1 TYR 151.A OH no hydrogen 3.139 N/A ARG 145.A NH2 PRO 122.A O no hydrogen 3.037 N/A LEU 146.A N VAL 150.A O no hydrogen 2.696 N/A VAL 150.A N GLU 147.A O no hydrogen 3.406 N/A TYR 151.A N VAL 119.A O no hydrogen 3.012 N/A TYR 151.A OH ALA 124.A O no hydrogen 3.341 N/A ALA 152.A N THR 144.A O no hydrogen 2.956 N/A VAL 153.A N PHE 117.A O no hydrogen 3.242 N/A VAL 155.A N THR 115.A O no hydrogen 2.927 N/A GLY 157.A N ASP 113.A O no hydrogen 2.919 N/A HIS 160.A N ASP 158.A OD1 no hydrogen 3.007 N/A GLY 161.A N VAL 194.A O no hydrogen 2.889 N/A TYR 162.A N LEU 159.A O no hydrogen 2.991 N/A GLU 163.A N SER 132.A O no hydrogen 2.924 N/A TYR 164.A N GLY 192.A O no hydrogen 2.946 N/A TYR 164.A OH ASP 179.A OD2 no hydrogen 2.928 N/A LEU 165.A N LYS 130.A O no hydrogen 2.895 N/A PHE 166.A N THR 177.A O no hydrogen 2.827 N/A CYS 167.A N ALA 128.A O no hydrogen 2.839 N/A ILE 168.A N MET 175.A O no hydrogen 2.995 N/A CYS 169.A N SER 126.A O no hydrogen 3.129 N/A ASN 170.A N GLU 173.A O no hydrogen 3.189 N/A ASN 170.A ND2 THR 352.A O no hydrogen 3.154 N/A GLU 173.A N ASN 170.A O no hydrogen 2.910 N/A MET 175.A N ILE 168.A O no hydrogen 3.083 N/A THR 177.A N PHE 166.A O no hydrogen 2.987 N/A THR 177.A OG1 VAL 178.A O no hydrogen 3.275 N/A TYR 181.A N ASP 179.A OD1 no hydrogen 2.802 N/A TYR 181.A OH ASP 389.A OD1 no hydrogen 3.041 N/A ALA 182.A N ASP 179.A O no hydrogen 3.071 N/A THR 186.A N LYS 191.A O no hydrogen 2.859 N/A THR 186.A OG1 LYS 191.A O no hydrogen 3.354 N/A ASN 188.A N GLU 281.A OE1 no hydrogen 2.808 N/A ASN 188.A ND2 ASP 280.A OD1 no hydrogen 3.454 N/A GLY 189.A N THR 186.A O no hydrogen 2.745 N/A LYS 191.A N THR 186.A OG1 no hydrogen 3.027 N/A LYS 191.A NZ SER 132.A OG no hydrogen 3.210 N/A GLY 192.A N TYR 164.A O no hydrogen 3.356 N/A VAL 193.A N ALA 184.A O no hydrogen 2.833 N/A VAL 194.A N TYR 162.A O no hydrogen 2.836 N/A MET 200.A N ASP 198.A OD1 no hydrogen 2.907 N/A THR 203.A N ASN 323.A OD1 no hydrogen 3.267 N/A SER 210.A OG ASP 214.A OD1 no hydrogen 2.890 N/A ASP 214.A N HIS 211.A O no hydrogen 2.892 N/A ALA 215.A N PRO 212.A O no hydrogen 2.960 N/A VAL 216.A N THR 266.A OG1 no hydrogen 2.904 N/A ILE 217.A N PRO 563.A O no hydrogen 3.165 N/A TYR 218.A N HIS 267.A O no hydrogen 2.969 N/A TYR 218.A OH SER 567.A OG no hydrogen 3.213 N/A TYR 218.A OH GLU 570.A OE2 no hydrogen 2.670 N/A GLU 219.A N ILE 565.A O no hydrogen 2.901 N/A THR 220.A N GLU 269.A O no hydrogen 2.902 N/A THR 220.A OG1 HIS 221.A O no hydrogen 3.452 N/A ARG 223.A NE ASP 586.A OD1 no hydrogen 3.034 N/A ARG 223.A NH1 PRO 284.A O no hydrogen 3.195 N/A ARG 223.A NH1 ALA 287.A O no hydrogen 3.057 N/A ARG 223.A NH1 ASP 586.A OD2 no hydrogen 3.095 N/A ARG 223.A NH2 PRO 284.A O no hydrogen 2.853 N/A ARG 223.A NH2 ALA 287.A O no hydrogen 3.005 N/A PHE 225.A N HIS 221.A O no hydrogen 3.036 N/A ILE 227.A N ARG 223.A O no hydrogen 3.151 N/A ASN 230.A N HIS 228.A ND1 no hydrogen 2.998 N/A SER 231.A N HIS 228.A O no hydrogen 3.055 N/A SER 231.A OG SER 226.A O no hydrogen 2.928 N/A SER 231.A OG HIS 228.A O no hydrogen 3.185 N/A ILE 234.A N GLU 244.A OE1 no hydrogen 2.670 N/A ASN 235.A N GLU 244.A OE2 no hydrogen 2.926 N/A ASN 235.A ND2 GLU 244.A OE2 no hydrogen 3.020 N/A LYS 236.A N ILE 234.A O no hydrogen 2.900 N/A LYS 236.A NZ MET 233.A O no hydrogen 2.577 N/A GLY 237.A N SER 226.A OG no hydrogen 2.948 N/A LYS 238.A N ASN 235.A O no hydrogen 3.128 N/A LYS 238.A NZ SER 303.A O no hydrogen 3.296 N/A LYS 238.A NZ ALA 305.A O no hydrogen 2.918 N/A TYR 239.A N TYR 304.A O no hydrogen 2.801 N/A TYR 239.A OH GLU 301.A O no hydrogen 2.953 N/A ALA 241.A N LYS 238.A O no hydrogen 3.119 N/A THR 243.A N LEU 240.A O no hydrogen 3.118 N/A THR 243.A OG1 LEU 240.A O no hydrogen 2.652 N/A GLU 244.A N ALA 241.A O no hydrogen 3.273 N/A THR 247.A OG1 GLY 232.A O no hydrogen 3.187 N/A THR 249.A N SER 253.A O no hydrogen 2.694 N/A THR 249.A OG1 ASN 251.A OD1 no hydrogen 2.898 N/A THR 249.A OG1 SER 253.A O no hydrogen 3.362 N/A THR 249.A OG1 GLU 597.A OE2 no hydrogen 3.200 N/A ASN 251.A N GLU 597.A OE2 no hydrogen 3.299 N/A GLY 252.A N THR 249.A O no hydrogen 2.984 N/A SER 253.A N THR 249.A OG1 no hydrogen 3.018 N/A SER 253.A N ASN 251.A OD1 no hydrogen 3.155 N/A SER 253.A OG ASN 251.A OD1 no hydrogen 2.842 N/A SER 254.A OG GLU 262.A OE1 no hydrogen 3.372 N/A SER 254.A OG GLU 262.A OE2 no hydrogen 3.480 N/A SER 255.A N THR 247.A O no hydrogen 3.059 N/A SER 255.A OG SER 231.A O no hydrogen 2.856 N/A TYR 259.A N SER 255.A O no hydrogen 3.234 N/A TYR 259.A OH GLU 570.A OE2 no hydrogen 2.804 N/A VAL 260.A N GLY 256.A O no hydrogen 3.020 N/A LYS 261.A N LEU 257.A O no hydrogen 3.088 N/A LYS 261.A NZ HIS 328.A O no hydrogen 2.999 N/A GLU 262.A N ALA 258.A O no hydrogen 3.169 N/A LEU 263.A N TYR 259.A O no hydrogen 3.103 N/A THR 266.A N VAL 216.A O no hydrogen 2.946 N/A THR 266.A OG1 VAL 216.A O no hydrogen 3.393 N/A THR 266.A OG1 HIS 267.A ND1 no hydrogen 2.721 N/A HIS 267.A N VAL 216.A O no hydrogen 3.229 N/A HIS 267.A ND1 THR 266.A OG1 no hydrogen 2.721 N/A VAL 268.A N ARG 331.A O no hydrogen 2.898 N/A GLU 269.A N TYR 218.A O no hydrogen 2.978 N/A LEU 270.A N ILE 333.A O no hydrogen 3.097 N/A LEU 271.A N THR 220.A O no hydrogen 3.191 N/A ASP 275.A N ALA 299.A O no hydrogen 2.855 N/A PHE 276.A N GLU 301.A OE2 no hydrogen 3.139 N/A ALA 277.A N ASN 293.A O no hydrogen 3.087 N/A GLU 281.A N ASN 188.A OD1 no hydrogen 3.199 N/A GLU 282.A N ASP 280.A OD1 no hydrogen 2.660 N/A LYS 283.A N ASP 280.A O no hydrogen 3.047 N/A LYS 283.A NZ ASP 280.A OD2 no hydrogen 2.951 N/A ASP 286.A N LYS 283.A O no hydrogen 3.217 N/A TYR 288.A OH ASP 224.A OD1 no hydrogen 3.099 N/A TYR 288.A OH ASP 224.A OD2 no hydrogen 2.641 N/A TRP 290.A N TYR 582.A O no hydrogen 3.183 N/A GLY 291.A N ASN 289.A OD1 no hydrogen 2.924 N/A TYR 292.A OH ASP 335.A OD2 no hydrogen 2.727 N/A ASN 293.A ND2 ALA 277.A O no hydrogen 3.086 N/A LEU 295.A N ASP 275.A O no hydrogen 3.021 N/A HIS 296.A N ASP 275.A O no hydrogen 3.304 N/A HIS 296.A NE2 GLY 189.A O no hydrogen 3.044 N/A GLU 301.A N VAL 273.A O no hydrogen 2.828 N/A GLY 302.A N GLU 281.A OE2 no hydrogen 2.949 N/A SER 303.A N GLU 301.A OE1 no hydrogen 3.151 N/A SER 303.A OG GLU 301.A OE1 no hydrogen 2.981 N/A ALA 305.A N GLY 302.A O no hydrogen 3.182 N/A SER 306.A N GLU 317.A OE1 no hydrogen 2.877 N/A SER 306.A OG GLU 317.A OE2 no hydrogen 2.665 N/A THR 313.A N ASP 310.A O no hydrogen 3.116 N/A THR 313.A N ASP 310.A OD1 no hydrogen 3.135 N/A THR 313.A OG1 ASP 310.A OD1 no hydrogen 2.721 N/A ARG 314.A NH1 PRO 300.A O no hydrogen 3.013 N/A ARG 314.A NH2 GLU 281.A OE1 no hydrogen 3.403 N/A ARG 314.A NH2 PRO 308.A O no hydrogen 3.042 N/A LYS 315.A N GLN 312.A O no hydrogen 3.008 N/A THR 316.A N GLN 312.A O no hydrogen 3.076 N/A THR 316.A OG1 GLN 312.A O no hydrogen 3.501 N/A THR 316.A OG1 GLN 312.A OE1 no hydrogen 2.984 N/A GLU 317.A N THR 313.A O no hydrogen 3.027 N/A LEU 318.A N ARG 314.A O no hydrogen 3.240 N/A LYS 319.A N LYS 315.A O no hydrogen 3.240 N/A LYS 319.A NZ ASP 198.A OD1 no hydrogen 3.542 N/A LYS 319.A NZ ASP 198.A OD2 no hydrogen 2.874 N/A LYS 319.A NZ GLU 397.A OE2 no hydrogen 3.441 N/A GLN 320.A N THR 316.A O no hydrogen 3.039 N/A MET 321.A N GLU 317.A O no hydrogen 3.086 N/A ILE 322.A N LEU 318.A O no hydrogen 3.018 N/A ASN 323.A N LYS 319.A O no hydrogen 2.833 N/A ASN 323.A ND2 THR 203.A OG1 no hydrogen 3.393 N/A THR 324.A N GLN 320.A O no hydrogen 2.804 N/A THR 324.A OG1 GLN 320.A O no hydrogen 2.724 N/A LEU 325.A N MET 321.A O no hydrogen 3.103 N/A HIS 326.A N ILE 322.A O no hydrogen 3.171 N/A HIS 326.A NE2 ASP 401.A OD2 no hydrogen 3.046 N/A GLN 327.A N ASN 323.A O no hydrogen 2.985 N/A HIS 328.A N THR 324.A O no hydrogen 3.172 N/A HIS 328.A N LEU 325.A O no hydrogen 2.983 N/A GLY 329.A N HIS 326.A O no hydrogen 2.944 N/A LEU 330.A N LEU 325.A O no hydrogen 2.875 N/A ARG 331.A N THR 266.A O no hydrogen 2.986 N/A ARG 331.A NH1 LYS 207.A O no hydrogen 2.899 N/A VAL 332.A N ASP 401.A OD2 no hydrogen 2.736 N/A ILE 333.A N VAL 268.A O no hydrogen 2.955 N/A LEU 334.A N GLY 402.A O no hydrogen 2.996 N/A ASP 335.A N LEU 270.A O no hydrogen 3.258 N/A VAL 336.A N ARG 404.A O no hydrogen 3.051 N/A HIS 340.A ND1 VAL 341.A O no hydrogen 3.102 N/A TYR 342.A N PRO 294.A O no hydrogen 3.183 N/A ASN 346.A N LYS 343.A O no hydrogen 3.295 N/A SER 347.A N ARG 344.A O no hydrogen 3.111 N/A SER 347.A OG ARG 344.A O no hydrogen 2.901 N/A GLU 350.A N SER 347.A OG no hydrogen 3.277 N/A LYS 351.A N SER 347.A O no hydrogen 3.007 N/A THR 352.A N PRO 348.A O no hydrogen 3.176 N/A THR 352.A OG1 PRO 348.A O no hydrogen 2.711 N/A VAL 353.A N PHE 349.A O no hydrogen 3.150 N/A GLY 355.A N GLU 350.A OE1 no hydrogen 3.192 N/A GLY 355.A N GLU 350.A OE2 no hydrogen 3.235 N/A TYR 356.A N VAL 353.A O no hydrogen 3.270 N/A TYR 356.A OH ASP 97.A OD1 no hydrogen 2.538 N/A ARG 359.A N ASP 375.A O no hydrogen 3.065 N/A ARG 359.A NE GLU 379.A OE2 no hydrogen 2.906 N/A ARG 359.A NH1 ILE 410.A O no hydrogen 2.740 N/A ARG 359.A NH1 THR 441.A OG1 no hydrogen 3.102 N/A ARG 359.A NH2 GLU 379.A OE2 no hydrogen 3.156 N/A ARG 359.A NH2 ILE 410.A O no hydrogen 2.839 N/A ASP 361.A N LYS 365.A O no hydrogen 2.825 N/A GLU 362.A N GLU 362.A OE1 no hydrogen 2.477 N/A CYS 363.A N ASP 361.A OD2 no hydrogen 2.830 N/A GLY 364.A N ASP 361.A O no hydrogen 2.973 N/A LYS 365.A N ASP 361.A OD2 no hydrogen 3.001 N/A SER 367.A N ARG 359.A O no hydrogen 3.107 N/A SER 367.A OG ASP 375.A OD1 no hydrogen 2.977 N/A GLY 369.A N ASP 375.A OD1 no hydrogen 2.706 N/A THR 370.A N ASP 375.A OD2 no hydrogen 3.040 N/A THR 370.A OG1 ASN 374.A O no hydrogen 2.942 N/A THR 370.A OG1 ASP 375.A OD2 no hydrogen 2.975 N/A GLY 371.A N ASN 368.A O no hydrogen 3.182 N/A VAL 372.A N THR 370.A OG1 no hydrogen 3.429 N/A GLY 373.A N ASN 368.A OD1 no hydrogen 2.515 N/A ILE 376.A N ASN 339.A O no hydrogen 2.906 N/A ALA 377.A N PHE 357.A O no hydrogen 3.072 N/A SER 378.A OG ASP 412.A OD1 no hydrogen 2.681 N/A GLU 379.A N GLU 379.A OE2 no hydrogen 2.763 N/A ARG 380.A N ALA 377.A O no hydrogen 2.957 N/A ARG 381.A N ASP 97.A OD2 no hydrogen 3.030 N/A ARG 381.A NH1 ASP 98.A OD2 no hydrogen 2.917 N/A MET 382.A N TYR 356.A OH no hydrogen 3.036 N/A ALA 383.A N ARG 380.A O no hydrogen 3.230 N/A ARG 384.A N ARG 380.A O no hydrogen 3.039 N/A ARG 384.A NE THR 415.A OG1 no hydrogen 3.031 N/A ARG 384.A NH2 ASP 412.A OD2 no hydrogen 3.311 N/A LYS 385.A N ARG 381.A O no hydrogen 3.155 N/A LYS 385.A NZ TYR 102.A O no hydrogen 3.359 N/A LYS 385.A NZ GLY 104.A O no hydrogen 2.896 N/A PHE 386.A N MET 382.A O no hydrogen 2.919 N/A ILE 387.A N ALA 383.A O no hydrogen 2.944 N/A ALA 388.A N ARG 384.A O no hydrogen 3.087 N/A ASP 389.A N LYS 385.A O no hydrogen 2.814 N/A CYS 390.A N PHE 386.A O no hydrogen 2.860 N/A CYS 390.A SG PHE 297.A O no hydrogen 3.448 N/A VAL 391.A N ILE 387.A O no hydrogen 3.078 N/A VAL 392.A N ALA 388.A O no hydrogen 3.057 N/A TYR 393.A N ASP 389.A O no hydrogen 3.050 N/A TYR 393.A OH GLU 397.A OE2 no hydrogen 3.218 N/A TRP 394.A N CYS 390.A O no hydrogen 3.165 N/A TRP 394.A NE1 PHE 297.A O no hydrogen 3.074 N/A LEU 395.A N VAL 391.A O no hydrogen 3.264 N/A GLU 396.A N VAL 392.A O no hydrogen 2.868 N/A GLU 397.A N TYR 393.A O no hydrogen 2.733 N/A TYR 398.A N TRP 394.A O no hydrogen 2.894 N/A ASP 401.A N VAL 332.A O no hydrogen 2.765 N/A PHE 403.A N LEU 431.A O no hydrogen 2.863 N/A ARG 404.A N LEU 334.A O no hydrogen 2.826 N/A ARG 404.A NH1 ASP 335.A OD1 no hydrogen 3.498 N/A ARG 404.A NH1 ASP 406.A OD1 no hydrogen 3.031 N/A PHE 405.A N PHE 433.A O no hydrogen 2.849 N/A ASP 406.A N VAL 336.A O no hydrogen 2.911 N/A LEU 407.A N GLU 435.A OE1 no hydrogen 2.893 N/A GLY 409.A N GLU 435.A O no hydrogen 3.324 N/A ILE 410.A N LEU 407.A O no hydrogen 2.937 N/A LEU 411.A N LEU 408.A O no hydrogen 3.085 N/A ASP 412.A N SER 378.A OG no hydrogen 3.109 N/A ILE 413.A N GLN 447.A O no hydrogen 2.810 N/A THR 415.A N ASP 412.A OD2 no hydrogen 2.979 N/A THR 415.A OG1 SER 378.A O no hydrogen 3.034 N/A THR 415.A OG1 ASP 412.A OD1 no hydrogen 2.536 N/A THR 415.A OG1 ASP 412.A OD2 no hydrogen 3.205 N/A VAL 416.A N ASP 412.A O no hydrogen 3.207 N/A LEU 417.A N ILE 413.A O no hydrogen 2.904 N/A TYR 418.A N ASP 414.A O no hydrogen 2.985 N/A MET 419.A N THR 415.A O no hydrogen 3.018 N/A LYS 420.A N VAL 416.A O no hydrogen 3.013 N/A LYS 420.A NZ PRO 458.A O no hydrogen 2.793 N/A GLU 421.A N LEU 417.A O no hydrogen 3.183 N/A LYS 422.A N TYR 418.A O no hydrogen 3.463 N/A ALA 423.A N MET 419.A O no hydrogen 2.848 N/A THR 424.A N LYS 420.A O no hydrogen 3.041 N/A THR 424.A OG1 LYS 420.A O no hydrogen 2.885 N/A THR 424.A OG1 GLU 421.A O no hydrogen 3.300 N/A ALA 426.A N LYS 422.A O no hydrogen 3.207 N/A LYS 427.A N ALA 423.A O no hydrogen 2.926 N/A LYS 427.A NZ ASN 399.A OD1 no hydrogen 3.026 N/A LYS 427.A NZ VAL 400.A O no hydrogen 2.800 N/A ILE 430.A N LYS 427.A O no hydrogen 3.456 N/A LEU 431.A N ASP 401.A O no hydrogen 3.150 N/A PHE 433.A N PHE 403.A O no hydrogen 3.289 N/A GLY 434.A N GLY 461.A O no hydrogen 3.036 N/A TRP 437.A NE1 GLU 435.A OE2 no hydrogen 3.009 N/A THR 441.A N LEU 439.A O no hydrogen 2.996 N/A THR 441.A OG1 ASP 375.A OD1 no hydrogen 3.011 N/A LEU 443.A N THR 441.A O no hydrogen 2.786 N/A GLN 447.A N PRO 444.A O no hydrogen 2.906 N/A LYS 448.A NZ LEU 439.A O no hydrogen 2.894 N/A ALA 449.A N LEU 411.A O no hydrogen 3.042 N/A LEU 451.A N GLY 436.A O no hydrogen 2.924 N/A ASN 453.A N ALA 450.A O no hydrogen 2.993 N/A ASN 453.A ND2 HIS 445.A O no hydrogen 3.135 N/A ASN 453.A ND2 LYS 448.A O no hydrogen 2.877 N/A ALA 454.A N LEU 451.A O no hydrogen 3.016 N/A ARG 456.A N ASN 453.A O no hydrogen 2.884 N/A MET 457.A N ALA 454.A O no hydrogen 2.912 N/A ILE 460.A N MET 457.A O no hydrogen 3.087 N/A GLY 461.A N LEU 432.A O no hydrogen 2.860 N/A PHE 462.A N GLN 516.A O no hydrogen 2.965 N/A PHE 463.A N GLY 434.A O no hydrogen 3.216 N/A ASN 464.A N ILE 518.A O no hydrogen 2.967 N/A ASN 464.A ND2 SER 501.A OG no hydrogen 2.772 N/A ASN 464.A ND2 SER 517.A OG no hydrogen 2.910 N/A PHE 467.A N ASN 464.A OD1 no hydrogen 2.893 N/A ARG 468.A N ASN 464.A O no hydrogen 3.187 N/A ARG 468.A NE ASP 469.A OD2 no hydrogen 2.904 N/A ARG 468.A NH1 TYR 520.A OH no hydrogen 2.936 N/A ARG 468.A NH2 ASP 469.A OD1 no hydrogen 3.402 N/A ARG 468.A NH2 ASP 469.A OD2 no hydrogen 3.122 N/A ASP 469.A N ASP 465.A O no hydrogen 3.050 N/A ALA 470.A N MET 466.A O no hydrogen 2.993 N/A VAL 471.A N PHE 467.A O no hydrogen 3.103 N/A LYS 472.A N ARG 468.A O no hydrogen 2.997 N/A LYS 472.A NZ VAL 521.A O no hydrogen 3.527 N/A PHE 476.A N ASN 474.A OD1 no hydrogen 2.679 N/A ALA 480.A N HIS 477.A O no hydrogen 2.835 N/A PHE 483.A N ALA 470.A O no hydrogen 3.081 N/A ALA 484.A N VAL 471.A O no hydrogen 3.129 N/A LEU 485.A N GLY 482.A O no hydrogen 2.865 N/A GLY 486.A N PHE 483.A O no hydrogen 3.127 N/A ASN 487.A N GLY 482.A O no hydrogen 2.979 N/A ASN 487.A ND2 THR 481.A OG1 no hydrogen 3.196 N/A GLU 489.A N ASN 487.A OD1 no hydrogen 2.940 N/A SER 490.A OG ALA 470.A O no hydrogen 3.394 N/A SER 490.A OG ASN 487.A O no hydrogen 3.408 N/A ALA 491.A N GLY 488.A O no hydrogen 3.335 N/A MET 495.A N ALA 491.A O no hydrogen 3.146 N/A HIS 496.A N GLN 492.A O no hydrogen 3.052 N/A GLY 497.A N ALA 493.A O no hydrogen 3.094 N/A ILE 498.A N VAL 494.A O no hydrogen 2.912 N/A ALA 499.A N MET 495.A O no hydrogen 3.019 N/A ALA 499.A N HIS 496.A O no hydrogen 3.148 N/A GLY 500.A N GLY 497.A O no hydrogen 3.047 N/A SER 501.A N HIS 496.A O no hydrogen 3.021 N/A SER 502.A OG GLY 500.A O no hydrogen 3.271 N/A SER 502.A OG VAL 511.A O no hydrogen 3.252 N/A SER 502.A OG PRO 512.A O no hydrogen 3.358 N/A TRP 504.A N LEU 507.A O no hydrogen 3.269 N/A LYS 505.A NZ GLN 492.A OE1 no hydrogen 3.304 N/A LEU 507.A N TRP 504.A O no hydrogen 2.759 N/A ILE 510.A N SER 501.A O no hydrogen 2.881 N/A VAL 511.A N SER 501.A O no hydrogen 3.222 N/A GLN 516.A N GLU 513.A O no hydrogen 3.037 N/A SER 517.A N PRO 514.A O no hydrogen 2.969 N/A SER 517.A OG ASN 519.A OD1 no hydrogen 2.801 N/A ILE 518.A N PHE 462.A O no hydrogen 3.046 N/A ASN 519.A N VAL 562.A O no hydrogen 2.866 N/A ASN 519.A ND2 GLN 560.A O no hydrogen 2.980 N/A HIS 524.A ND1 GLU 219.A OE1 no hydrogen 2.946 N/A ASP 525.A N SER 523.A OG no hydrogen 3.156 N/A THR 528.A OG1 ARG 573.A O no hydrogen 2.971 N/A PHE 529.A N GLU 522.A OE1 no hydrogen 2.830 N/A ASP 531.A N THR 528.A OG1 no hydrogen 3.175 N/A LYS 532.A N THR 528.A O no hydrogen 2.972 N/A LYS 532.A NZ ASN 474.A O no hydrogen 2.941 N/A LYS 532.A NZ LEU 478.A O no hydrogen 2.780 N/A LYS 532.A NZ ALA 480.A O no hydrogen 2.891 N/A MET 533.A N PHE 529.A O no hydrogen 3.086 N/A SER 534.A N TRP 530.A O no hydrogen 3.043 N/A SER 534.A OG TRP 530.A O no hydrogen 2.771 N/A PHE 535.A N ASP 531.A O no hydrogen 3.226 N/A PHE 535.A N LYS 532.A O no hydrogen 3.011 N/A ALA 536.A N LYS 532.A O no hydrogen 3.036 N/A LEU 537.A N MET 533.A O no hydrogen 2.906 N/A GLU 540.A N LEU 537.A O no hydrogen 3.318 N/A ARG 544.A N ASN 541.A OD1 no hydrogen 2.841 N/A LYS 545.A N ASN 541.A O no hydrogen 3.371 N/A LYS 545.A NZ SER 534.A OG no hydrogen 3.171 N/A ARG 546.A N ASP 542.A O no hydrogen 2.948 N/A SER 547.A N SER 543.A O no hydrogen 3.245 N/A SER 547.A OG SER 543.A O no hydrogen 3.439 N/A SER 547.A OG ARG 544.A O no hydrogen 2.664 N/A ARG 548.A N ARG 544.A O no hydrogen 3.178 N/A ARG 548.A NE ALA 484.A O no hydrogen 2.775 N/A ARG 548.A NH2 ALA 484.A O no hydrogen 3.390 N/A GLN 549.A N LYS 545.A O no hydrogen 3.061 N/A ARG 550.A N ARG 546.A O no hydrogen 3.033 N/A ARG 550.A NH2 ASP 602.A OD1 no hydrogen 2.951 N/A LEU 551.A N SER 547.A O no hydrogen 3.068 N/A ALA 552.A N ARG 548.A O no hydrogen 3.045 N/A VAL 553.A N GLN 549.A O no hydrogen 3.242 N/A ALA 554.A N ARG 550.A O no hydrogen 3.103 N/A ILE 555.A N LEU 551.A O no hydrogen 3.125 N/A ILE 556.A N ALA 552.A O no hydrogen 3.357 N/A LEU 557.A N VAL 553.A O no hydrogen 2.703 N/A LEU 558.A N ALA 554.A O no hydrogen 2.946 N/A ALA 559.A N ILE 556.A O no hydrogen 3.268 N/A GLN 560.A N ILE 498.A O no hydrogen 3.134 N/A GLN 560.A NE2 ALA 618.A O no hydrogen 3.213 N/A VAL 562.A N SER 517.A O no hydrogen 3.006 N/A PHE 564.A N ASN 519.A O no hydrogen 2.986 N/A ILE 565.A N ILE 217.A O no hydrogen 2.768 N/A HIS 566.A N GLN 569.A OE1 no hydrogen 3.270 N/A HIS 566.A ND1 GLU 522.A OE2 no hydrogen 2.567 N/A SER 567.A N GLU 219.A O no hydrogen 2.919 N/A SER 567.A OG TYR 218.A OH no hydrogen 3.213 N/A GLY 568.A N GLU 570.A OE1 no hydrogen 3.112 N/A GLN 569.A N HIS 566.A O no hydrogen 2.864 N/A GLU 570.A N GLU 570.A OE1 no hydrogen 2.611 N/A PHE 571.A N GLY 568.A O no hydrogen 3.068 N/A PHE 572.A N GLN 569.A O no hydrogen 3.178 N/A ARG 573.A N GLY 568.A O no hydrogen 2.822 N/A ARG 573.A NH1 SER 567.A O no hydrogen 2.829 N/A ARG 573.A NH2 ASP 224.A OD1 no hydrogen 3.396 N/A THR 574.A OG1 ASP 531.A OD1 no hydrogen 2.808 N/A LYS 575.A N ASP 531.A OD2 no hydrogen 3.103 N/A LYS 575.A NZ SER 581.A OG no hydrogen 3.295 N/A GLN 576.A N THR 574.A OG1 no hydrogen 3.188 N/A GLY 577.A N ASP 531.A OD2 no hydrogen 2.801 N/A VAL 578.A N LYS 575.A O no hydrogen 3.184 N/A SER 581.A OG ASN 589.A OD1 no hydrogen 2.851 N/A SER 584.A N SER 581.A O no hydrogen 3.193 N/A SER 585.A OG SER 587.A OG no hydrogen 3.111 N/A SER 587.A OG SER 585.A OG no hydrogen 3.111 N/A ILE 588.A N SER 585.A O no hydrogen 3.137 N/A ASN 589.A N SER 585.A O no hydrogen 3.107 N/A ASN 589.A ND2 SER 581.A O no hydrogen 3.349 N/A ASN 589.A ND2 SER 584.A O no hydrogen 3.117 N/A ASN 589.A ND2 SER 585.A O no hydrogen 3.465 N/A GLN 590.A N ASP 586.A O no hydrogen 2.752 N/A LEU 591.A N ASP 224.A O no hydrogen 3.045 N/A TRP 593.A NE1 PHE 225.A O no hydrogen 2.991 N/A ASP 594.A N ASP 592.A OD1 no hydrogen 2.872 N/A ARG 595.A N ASP 592.A O no hydrogen 3.126 N/A ARG 595.A N ASP 592.A OD1 no hydrogen 3.350 N/A ARG 596.A N ASP 592.A O no hydrogen 3.221 N/A ARG 596.A NE SER 254.A O no hydrogen 2.835 N/A ARG 596.A NH1 SER 254.A O no hydrogen 3.537 N/A ARG 596.A NH1 SER 254.A OG no hydrogen 2.981 N/A ARG 596.A NH2 ARG 596.A O no hydrogen 2.851 N/A GLU 597.A N ASP 594.A O no hydrogen 3.266 N/A THR 598.A N ASP 594.A O no hydrogen 3.062 N/A THR 598.A OG1 ASP 594.A O no hydrogen 3.166 N/A PHE 599.A N ARG 595.A O no hydrogen 3.005 N/A LYS 600.A N GLU 597.A O no hydrogen 3.335 N/A LYS 600.A NZ GLU 597.A O no hydrogen 2.871 N/A VAL 603.A N PHE 599.A O no hydrogen 3.131 N/A HIS 604.A N LYS 600.A O no hydrogen 2.974 N/A TYR 605.A N GLU 601.A O no hydrogen 3.231 N/A ILE 606.A N ASP 602.A O no hydrogen 3.411 N/A ARG 607.A N VAL 603.A O no hydrogen 2.999 N/A ARG 608.A N HIS 604.A O no hydrogen 2.927 N/A LEU 609.A N TYR 605.A O no hydrogen 3.119 N/A ILE 610.A N ILE 606.A O no hydrogen 3.041 N/A SER 611.A N ARG 607.A O no hydrogen 3.100 N/A SER 611.A OG ARG 607.A O no hydrogen 3.237 N/A LEU 612.A N ARG 608.A O no hydrogen 3.044 N/A ARG 613.A N LEU 609.A O no hydrogen 3.095 N/A ARG 613.A NH1 LEU 557.A O no hydrogen 3.103 N/A ARG 613.A NH1 ALA 559.A O no hydrogen 2.932 N/A ARG 613.A NH2 VAL 213.A O no hydrogen 3.239 N/A LYS 614.A N ILE 610.A O no hydrogen 3.094 N/A ALA 615.A N SER 611.A O no hydrogen 2.964 N/A HIS 616.A N LEU 612.A O no hydrogen 3.047 N/A HIS 616.A ND1 ASP 652.A OD1 no hydrogen 2.732 N/A ALA 618.A N ASP 652.A OD2 no hydrogen 3.042 N/A PHE 619.A N HIS 616.A O no hydrogen 3.184 N/A ARG 620.A N PRO 617.A O no hydrogen 2.668 N/A ARG 620.A NE ARG 613.A O no hydrogen 3.081 N/A ARG 620.A NH1 ASP 214.A OD2 no hydrogen 2.836 N/A ARG 620.A NH2 LYS 614.A O no hydrogen 3.136 N/A LEU 621.A N GLN 560.A OE1 no hydrogen 2.898 N/A ARG 622.A NH1 ASP 214.A OD1 no hydrogen 2.820 N/A SER 623.A OG ASP 626.A OD2 no hydrogen 3.053 N/A ALA 624.A N GLU 513.A OE2 no hydrogen 2.863 N/A ASP 626.A N SER 623.A OG no hydrogen 3.413 N/A ILE 627.A N SER 623.A O no hydrogen 3.127 N/A GLN 628.A N ALA 624.A O no hydrogen 3.138 N/A ARG 629.A N ASP 626.A O no hydrogen 3.025 N/A HIS 630.A N ILE 627.A O no hydrogen 3.231 N/A HIS 630.A ND1 ASP 626.A O no hydrogen 3.249 N/A LEU 631.A N ILE 627.A O no hydrogen 2.963 N/A GLU 632.A N ARG 644.A O no hydrogen 3.140 N/A CYS 633.A SG THR 635.A O no hydrogen 3.865 N/A LEU 634.A N ALA 642.A O no hydrogen 2.773 N/A THR 635.A N ALA 642.A O no hydrogen 2.995 N/A LYS 637.A N LEU 640.A O no hydrogen 2.772 N/A ILE 641.A N HIS 661.A O no hydrogen 3.104 N/A ALA 642.A N THR 635.A O no hydrogen 2.920 N/A TYR 643.A N VAL 659.A O no hydrogen 3.189 N/A TYR 643.A OH LEU 558.A O no hydrogen 3.162 N/A ARG 644.A N GLU 632.A O no hydrogen 2.980 N/A ARG 644.A NE ASP 656.A OD2 no hydrogen 3.079 N/A ARG 644.A NH1 GLU 632.A OE2 no hydrogen 2.956 N/A ARG 644.A NH2 ASP 656.A OD1 no hydrogen 2.856 N/A ARG 644.A NH2 ASP 656.A OD2 no hydrogen 3.459 N/A LEU 645.A N ILE 657.A O no hydrogen 2.873 N/A TYR 646.A N HIS 630.A O no hydrogen 2.897 N/A TRP 654.A N ASP 652.A OD1 no hydrogen 3.001 N/A LYS 655.A N LEU 710.A O no hydrogen 2.744 N/A ASP 656.A N LEU 710.A O no hydrogen 3.389 N/A ILE 657.A N LEU 645.A O no hydrogen 3.084 N/A ILE 658.A N LEU 708.A O no hydrogen 2.764 N/A VAL 659.A N TYR 643.A O no hydrogen 3.045 N/A ILE 660.A N VAL 706.A O no hydrogen 2.931 N/A HIS 661.A N ILE 641.A O no hydrogen 2.845 N/A HIS 662.A N GLY 704.A O no hydrogen 2.931 N/A ALA 663.A N HIS 639.A O no hydrogen 2.866 N/A SER 664.A OG HIS 662.A NE2 no hydrogen 2.501 N/A SER 664.A OG ASP 666.A OD2 no hydrogen 3.071 N/A SER 667.A OG ASN 701.A OD1 no hydrogen 2.395 N/A VAL 668.A N VAL 700.A O no hydrogen 3.103 N/A TRP 670.A N VAL 698.A O no hydrogen 3.029 N/A TRP 670.A NE1 THR 635.A OG1 no hydrogen 3.052 N/A ARG 671.A NH1 ASN 674.A O no hydrogen 3.287 N/A ARG 671.A NH1 LYS 696.A O no hydrogen 3.123 N/A ARG 671.A NH2 ASP 675.A OD1 no hydrogen 3.162 N/A LEU 672.A N LYS 696.A O no hydrogen 2.797 N/A ASN 674.A ND2 TYR 678.A OH no hydrogen 3.330 N/A ILE 676.A N ASN 674.A OD1 no hydrogen 2.888 N/A TYR 678.A N ILE 694.A O no hydrogen 3.116 N/A TYR 678.A OH ASP 656.A OD1 no hydrogen 2.559 N/A ARG 679.A N TYR 709.A O no hydrogen 3.040 N/A LEU 680.A N THR 692.A O no hydrogen 2.742 N/A LEU 681.A N ILE 707.A O no hydrogen 2.985 N/A CYS 682.A SG ASP 683.A O no hydrogen 3.799 N/A CYS 682.A SG THR 705.A O no hydrogen 3.683 N/A ASP 683.A N GLY 686.A O no hydrogen 3.393 N/A SER 685.A N ASP 683.A OD2 no hydrogen 2.787 N/A SER 685.A OG ASP 683.A OD2 no hydrogen 3.012 N/A GLY 686.A N ASP 683.A O no hydrogen 2.688 N/A GLN 688.A N LEU 681.A O no hydrogen 3.125 N/A GLN 688.A NE2 GLY 686.A O no hydrogen 2.846 N/A ILE 694.A N TYR 678.A O no hydrogen 3.131 N/A THR 697.A N LYS 695.A O no hydrogen 2.362 N/A VAL 698.A N TRP 670.A O no hydrogen 3.194 N/A VAL 700.A N VAL 668.A O no hydrogen 2.803 N/A GLY 702.A N ASP 666.A O no hydrogen 2.855 N/A GLY 704.A N HIS 662.A O no hydrogen 3.127 N/A VAL 706.A N ILE 660.A O no hydrogen 3.016 N/A ILE 707.A N CYS 682.A O no hydrogen 2.975 N/A LEU 708.A N ILE 658.A O no hydrogen 2.844 N/A TYR 709.A N ARG 679.A O no hydrogen 3.306 N/A LEU 710.A N ASP 656.A O no hydrogen 2.833 N/A SER 712.A OG GLU 653.A O no hydrogen 3.342 N/A