Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ffl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 6.A N LEU 25.A O no hydrogen 2.725 N/A GLY 7.A N PRO 54.A O no hydrogen 3.257 N/A HIS 8.A N LEU 23.A O no hydrogen 2.935 N/A CYS 9.A N GLU 51.A O no hydrogen 2.790 N/A CYS 9.A SG PRO 120.A O no hydrogen 3.512 N/A THR 11.A N TYR 49.A O no hydrogen 2.754 N/A THR 11.A OG1 CYS 9.A O no hydrogen 3.488 N/A THR 11.A OG1 HIS 20.A ND1 no hydrogen 3.159 N/A VAL 12.A N SER 19.A O no hydrogen 3.004 N/A VAL 13.A N GLU 47.A O no hydrogen 2.700 N/A THR 14.A N GLY 17.A O no hydrogen 3.054 N/A THR 14.A OG1 GLY 17.A O no hydrogen 3.439 N/A ARG 16.A N THR 14.A OG1 no hydrogen 3.252 N/A ARG 16.A NH1 GLN 255.A OE1 no hydrogen 3.203 N/A GLY 17.A N THR 14.A O no hydrogen 3.146 N/A SER 19.A N VAL 12.A O no hydrogen 2.810 N/A HIS 20.A ND1 THR 11.A OG1 no hydrogen 3.159 N/A TRP 21.A N CYS 10.A O no hydrogen 2.939 N/A LEU 22.A N LEU 115.A O no hydrogen 2.769 N/A LEU 23.A N HIS 8.A O no hydrogen 2.858 N/A LEU 24.A N ALA 113.A O no hydrogen 2.924 N/A LEU 25.A N LEU 6.A O no hydrogen 2.940 N/A PHE 35.A N VAL 48.A O no hydrogen 3.048 N/A LYS 36.A N THR 314.A O no hydrogen 3.231 N/A VAL 37.A N ALA 46.A O no hydrogen 2.786 N/A SER 38.A N TRP 312.A O no hydrogen 2.863 N/A SER 38.A OG ALA 39.A O no hydrogen 3.294 N/A ARG 41.A NH2 GLU 262.A OE2 no hydrogen 2.518 N/A ALA 46.A N VAL 37.A O no hydrogen 3.029 N/A GLU 47.A N VAL 13.A O no hydrogen 2.903 N/A VAL 48.A N PHE 35.A O no hydrogen 2.691 N/A TYR 49.A N THR 11.A O no hydrogen 2.958 N/A GLY 53.A N GLY 7.A O no hydrogen 3.227 N/A SER 59.A OG ASP 62.A OD2 no hydrogen 2.690 N/A ALA 63.A N SER 59.A O no hydrogen 2.844 N/A THR 64.A N ARG 60.A O no hydrogen 3.224 N/A THR 64.A OG1 THR 61.A O no hydrogen 2.998 N/A VAL 66.A N ASP 62.A O no hydrogen 3.097 N/A ALA 67.A N ALA 63.A O no hydrogen 3.139 N/A VAL 68.A N THR 64.A O no hydrogen 3.101 N/A TYR 69.A N ILE 65.A O no hydrogen 3.284 N/A GLN 70.A N VAL 66.A O no hydrogen 3.004 N/A GLN 70.A NE2 PHE 114.A O no hydrogen 3.240 N/A SER 71.A N ALA 67.A O no hydrogen 3.319 N/A SER 71.A OG VAL 68.A O no hydrogen 2.694 N/A ILE 72.A N VAL 68.A O no hydrogen 3.178 N/A LEU 73.A N TYR 69.A O no hydrogen 2.993 N/A PHE 74.A N GLN 70.A O no hydrogen 2.786 N/A GLN 75.A N SER 71.A O no hydrogen 3.019 N/A LEU 76.A N ILE 72.A O no hydrogen 3.304 N/A LEU 77.A N LEU 73.A O no hydrogen 2.964 N/A GLY 78.A N PHE 74.A O no hydrogen 3.305 N/A GLY 78.A N GLN 75.A O no hydrogen 2.971 N/A PHE 81.A N GLY 78.A O no hydrogen 3.473 N/A SER 84.A N PRO 82.A O no hydrogen 2.666 N/A THR 86.A OG1 ALA 110.A O no hydrogen 2.967 N/A ILE 88.A N SER 84.A O no hydrogen 3.241 N/A ILE 88.A N TRP 85.A O no hydrogen 3.212 N/A GLY 89.A N TRP 85.A O no hydrogen 3.426 N/A ALA 90.A N THR 86.A O no hydrogen 2.739 N/A THR 91.A OG1 GLU 87.A O no hydrogen 2.663 N/A THR 91.A OG1 ILE 88.A O no hydrogen 3.518 N/A MET 92.A N GLY 89.A O no hydrogen 2.933 N/A GLU 96.A N PRO 93.A O no hydrogen 2.976 N/A TYR 97.A N HIS 94.A O no hydrogen 3.022 N/A THR 98.A N ASP 269.A OD1 no hydrogen 3.140 N/A THR 98.A OG1 ASP 269.A OD1 no hydrogen 3.451 N/A THR 98.A OG1 ASP 269.A OD2 no hydrogen 2.795 N/A THR 98.A OG1 TYR 292.A OH no hydrogen 2.578 N/A ARG 101.A NH1 GLN 382.A O no hydrogen 3.521 N/A ARG 101.A NH2 GLN 382.A O no hydrogen 3.343 N/A PHE 102.A N PHE 99.A O no hydrogen 2.844 N/A THR 111.A N ASP 26.A OD1 no hydrogen 2.646 N/A THR 111.A OG1 ASP 26.A OD1 no hydrogen 3.413 N/A THR 111.A OG1 ASP 26.A OD2 no hydrogen 3.221 N/A ALA 113.A N LEU 24.A O no hydrogen 3.140 N/A LEU 115.A N LEU 22.A O no hydrogen 3.181 N/A LEU 117.A N HIS 20.A O no hydrogen 3.062 N/A LEU 118.A N SER 122.A OG no hydrogen 3.338 N/A SER 119.A OG THR 121.A OG1 no hydrogen 2.987 N/A THR 121.A N SER 119.A OG no hydrogen 3.361 N/A THR 121.A OG1 SER 119.A OG no hydrogen 2.987 N/A SER 122.A N SER 119.A O no hydrogen 3.146 N/A SER 122.A N SER 119.A OG no hydrogen 3.380 N/A SER 122.A OG SER 119.A O no hydrogen 3.367 N/A ALA 128.A N ASP 125.A OD1 no hydrogen 2.796 N/A MET 130.A N LEU 126.A O no hydrogen 3.454 N/A VAL 131.A N ARG 127.A O no hydrogen 3.199 N/A THR 132.A N ALA 128.A O no hydrogen 2.999 N/A THR 132.A OG1 ALA 128.A O no hydrogen 3.001 N/A THR 132.A OG1 GLU 248.A OE2 no hydrogen 2.946 N/A ALA 133.A N LEU 129.A O no hydrogen 2.877 N/A GLN 134.A N MET 130.A O no hydrogen 2.956 N/A LEU 135.A N VAL 131.A O no hydrogen 2.799 N/A MET 136.A N THR 132.A O no hydrogen 3.077 N/A CYS 137.A N ALA 133.A O no hydrogen 3.186 N/A ASP 138.A N GLN 134.A O no hydrogen 2.973 N/A ARG 141.A NH2 GLU 159.A OE1 no hydrogen 2.794 N/A LEU 142.A N CYS 242.A O no hydrogen 2.973 N/A SER 149.A N LEU 146.A O no hydrogen 2.769 N/A SER 149.A OG LEU 146.A O no hydrogen 2.979 N/A LEU 150.A N LEU 146.A O no hydrogen 2.976 N/A HIS 151.A ND1 LEU 168.A O no hydrogen 3.352 N/A GLY 152.A N VAL 167.A O no hydrogen 2.764 N/A ARG 153.A N LEU 150.A O no hydrogen 2.886 N/A ARG 153.A NH1 ASP 247.A OD1 no hydrogen 2.761 N/A ARG 153.A NH2 ASP 247.A OD2 no hydrogen 3.404 N/A VAL 155.A N TYR 165.A O no hydrogen 2.921 N/A ALA 156.A N LEU 243.A O no hydrogen 3.128 N/A THR 157.A N SER 163.A O no hydrogen 3.038 N/A THR 157.A OG1 THR 157.A O no hydrogen 2.628 N/A THR 157.A OG1 ILE 160.A O no hydrogen 3.512 N/A ILE 160.A N THR 157.A O no hydrogen 2.901 N/A SER 163.A N ILE 160.A O no hydrogen 3.461 N/A SER 163.A OG ILE 160.A O no hydrogen 3.180 N/A TYR 165.A N VAL 155.A O no hydrogen 2.720 N/A VAL 166.A N VAL 212.A O no hydrogen 2.823 N/A VAL 167.A N ARG 153.A O no hydrogen 2.977 N/A LEU 168.A N ALA 210.A O no hydrogen 2.794 N/A GLY 169.A N ALA 210.A O no hydrogen 3.259 N/A ASP 171.A N LEU 208.A O no hydrogen 3.253 N/A THR 173.A OG1 ASP 171.A OD1 no hydrogen 3.141 N/A GLN 174.A N ASP 171.A O no hydrogen 3.459 N/A THR 175.A N SER 178.A OG no hydrogen 2.438 N/A SER 178.A N THR 175.A O no hydrogen 2.395 N/A SER 178.A OG THR 175.A O no hydrogen 2.609 N/A PHE 180.A N ILE 187.A O no hydrogen 2.859 N/A ARG 182.A N GLU 185.A O no hydrogen 2.812 N/A GLU 185.A N ARG 182.A O no hydrogen 2.644 N/A ILE 187.A N PHE 180.A O no hydrogen 2.986 N/A TYR 189.A N SER 178.A O no hydrogen 3.362 N/A MET 190.A N SER 176.A O no hydrogen 2.774 N/A ARG 191.A N THR 188.A O no hydrogen 2.715 N/A TYR 192.A N THR 188.A O no hydrogen 2.809 N/A TYR 193.A N TYR 189.A O no hydrogen 3.054 N/A ALA 194.A N ARG 191.A O no hydrogen 3.142 N/A THR 195.A N ARG 191.A O no hydrogen 2.765 N/A THR 195.A OG1 ARG 191.A O no hydrogen 2.559 N/A ALA 196.A N TYR 192.A O no hydrogen 2.799 N/A HIS 197.A N TYR 193.A O no hydrogen 3.290 N/A HIS 197.A NE2 TYR 192.A OH no hydrogen 3.235 N/A ILE 199.A N TYR 193.A O no hydrogen 2.953 N/A ARG 202.A N GLU 240.A OE1 no hydrogen 3.249 N/A ALA 204.A N ARG 202.A O no hydrogen 2.731 N/A LEU 206.A N ALA 203.A O no hydrogen 3.118 N/A LEU 208.A N GLN 174.A O no hydrogen 3.144 N/A VAL 209.A N LEU 237.A O no hydrogen 2.849 N/A ALA 210.A N GLY 169.A O no hydrogen 2.960 N/A ALA 211.A N ARG 235.A O no hydrogen 2.966 N/A VAL 212.A N VAL 166.A O no hydrogen 2.875 N/A LEU 214.A N LEU 164.A O no hydrogen 2.867 N/A ASP 216.A N ARG 213.A O no hydrogen 3.173 N/A LEU 217.A N ARG 213.A O no hydrogen 3.231 N/A ARG 235.A N ALA 211.A O no hydrogen 2.952 N/A LEU 237.A N VAL 209.A O no hydrogen 3.051 N/A LEU 241.A N PRO 238.A O no hydrogen 3.025 N/A CYS 242.A N PRO 239.A O no hydrogen 3.338 N/A CYS 242.A SG PRO 238.A O no hydrogen 3.640 N/A LEU 243.A N ALA 156.A O no hydrogen 2.650 N/A LEU 244.A N LYS 140.A O no hydrogen 3.249 N/A LEU 245.A N MET 154.A O no hydrogen 3.145 N/A PHE 249.A N PRO 246.A O no hydrogen 2.947 N/A ARG 253.A N ASP 250.A OD1 no hydrogen 3.155 N/A ARG 253.A NH1 HIS 20.A O no hydrogen 2.919 N/A ARG 253.A NH2 HIS 20.A O no hydrogen 2.792 N/A VAL 254.A N ASP 250.A O no hydrogen 3.190 N/A GLN 255.A N LEU 251.A O no hydrogen 3.133 N/A GLN 255.A NE2 LYS 218.A O no hydrogen 3.181 N/A ALA 256.A N ILE 252.A O no hydrogen 3.083 N/A LEU 257.A N ARG 253.A O no hydrogen 2.672 N/A GLN 258.A N GLN 255.A O no hydrogen 2.719 N/A GLN 258.A NE2 VAL 254.A O no hydrogen 3.018 N/A PHE 259.A N ALA 256.A O no hydrogen 2.929 N/A LEU 260.A N LEU 257.A O no hydrogen 3.060 N/A GLU 262.A N PHE 259.A O no hydrogen 2.829 N/A ILE 263.A N PHE 259.A O no hydrogen 3.227 N/A ALA 264.A N LEU 260.A O no hydrogen 3.015 N/A LYS 265.A N PRO 261.A O no hydrogen 2.972 N/A LYS 265.A NZ GLU 96.A OE1 no hydrogen 3.467 N/A LYS 265.A NZ GLU 262.A OE2 no hydrogen 2.730 N/A HIS 266.A N GLU 262.A O no hydrogen 2.832 N/A HIS 266.A NE2 PRO 33.A O no hydrogen 2.866 N/A ILE 267.A N ILE 263.A O no hydrogen 3.188 N/A CYS 268.A N ALA 264.A O no hydrogen 3.060 N/A ASP 269.A N LYS 265.A O no hydrogen 2.754 N/A ILE 270.A N HIS 266.A O no hydrogen 2.808 N/A GLN 271.A N ILE 267.A O no hydrogen 3.162 N/A ASN 272.A N CYS 268.A O no hydrogen 3.047 N/A THR 273.A N ASP 269.A O no hydrogen 3.016 N/A THR 273.A OG1 ASP 269.A O no hydrogen 3.204 N/A ILE 274.A N ILE 270.A O no hydrogen 3.140 N/A CYS 275.A N GLN 271.A O no hydrogen 3.214 N/A CYS 275.A SG GLN 271.A O no hydrogen 3.385 N/A CYS 275.A SG ASN 272.A O no hydrogen 3.857 N/A LEU 277.A N THR 273.A O no hydrogen 2.990 N/A LEU 277.A N ILE 274.A O no hydrogen 3.257 N/A ASP 278.A N ILE 274.A O no hydrogen 2.795 N/A SER 280.A N LEU 277.A O no hydrogen 2.937 N/A GLY 285.A N ASP 283.A OD2 no hydrogen 2.912 N/A ARG 286.A NH1 SER 405.A O no hydrogen 3.201 N/A ARG 286.A NH1 SER 405.A OG no hydrogen 2.846 N/A ARG 286.A NH2 SER 405.A O no hydrogen 3.159 N/A ARG 286.A NH2 THR 408.A OG1 no hydrogen 3.395 N/A GLY 289.A N LEU 29.A O no hydrogen 2.889 N/A ARG 291.A N ILE 287.A O no hydrogen 3.280 N/A ARG 291.A NE ASP 278.A OD2 no hydrogen 2.685 N/A ARG 291.A NH1 PRO 282.A O no hydrogen 3.307 N/A ARG 291.A NH2 ASP 278.A O no hydrogen 3.230 N/A ARG 291.A NH2 ASP 278.A OD2 no hydrogen 2.908 N/A ARG 291.A NH2 PHE 281.A O no hydrogen 2.555 N/A TYR 292.A N GLY 288.A O no hydrogen 2.921 N/A TYR 292.A OH THR 98.A OG1 no hydrogen 2.578 N/A PHE 293.A N GLY 289.A O no hydrogen 2.927 N/A ALA 294.A N GLU 290.A O no hydrogen 2.875 N/A ILE 295.A N ARG 291.A O no hydrogen 3.005 N/A THR 296.A N TYR 292.A O no hydrogen 2.748 N/A THR 296.A OG1 TYR 292.A O no hydrogen 2.947 N/A ALA 297.A N PHE 293.A O no hydrogen 2.860 N/A GLY 298.A N ALA 294.A O no hydrogen 2.892 N/A LEU 299.A N ILE 295.A O no hydrogen 2.834 N/A ARG 300.A N THR 296.A O no hydrogen 2.913 N/A ARG 300.A NH1 THR 98.A O no hydrogen 2.946 N/A LEU 301.A N GLU 385.A O no hydrogen 3.326 N/A LEU 309.A N THR 314.A OG1 no hydrogen 3.354 N/A ALA 310.A N ARG 313.A O no hydrogen 2.947 N/A ARG 313.A N ALA 310.A O no hydrogen 3.115 N/A ARG 313.A NH2 GLU 96.A O no hydrogen 2.896 N/A ARG 313.A NH2 ASP 269.A OD2 no hydrogen 2.817 N/A THR 314.A N LYS 36.A O no hydrogen 3.049 N/A PHE 316.A N GLY 34.A O no hydrogen 2.812 N/A GLY 317.A N VAL 321.A O no hydrogen 2.875 N/A HIS 323.A NE2 ASP 302.A O no hydrogen 3.062 N/A ASP 325.A N SER 322.A OG no hydrogen 3.032 N/A VAL 326.A N SER 322.A O no hydrogen 2.964 N/A PHE 327.A N HIS 323.A O no hydrogen 3.111 N/A GLN 328.A N THR 324.A O no hydrogen 2.834 N/A ARG 329.A N ASP 325.A O no hydrogen 2.866 N/A ARG 329.A NE LEU 649.A O no hydrogen 2.836 N/A ARG 329.A NH2 HIS 643.A O no hydrogen 2.739 N/A ARG 329.A NH2 HIS 646.A O no hydrogen 2.969 N/A LEU 330.A N VAL 326.A O no hydrogen 2.745 N/A GLU 331.A N PHE 327.A O no hydrogen 3.016 N/A LEU 332.A N GLN 328.A O no hydrogen 3.403 N/A LEU 333.A N ARG 329.A O no hydrogen 3.262 N/A GLY 334.A N LEU 330.A O no hydrogen 2.820 N/A ASP 335.A N GLU 331.A O no hydrogen 2.742 N/A ALA 336.A N LEU 332.A O no hydrogen 3.301 N/A VAL 337.A N LEU 333.A O no hydrogen 3.081 N/A VAL 337.A N GLY 334.A O no hydrogen 3.291 N/A LEU 338.A N GLY 334.A O no hydrogen 3.049 N/A GLY 339.A N ASP 335.A O no hydrogen 3.348 N/A PHE 340.A N ALA 336.A O no hydrogen 3.440 N/A ILE 341.A N VAL 337.A O no hydrogen 2.898 N/A VAL 342.A N LEU 338.A O no hydrogen 2.979 N/A THR 343.A N GLY 339.A O no hydrogen 3.041 N/A THR 343.A OG1 GLY 339.A O no hydrogen 2.760 N/A ALA 344.A N PHE 340.A O no hydrogen 2.958 N/A ARG 345.A N ILE 341.A O no hydrogen 3.008 N/A ARG 345.A NH1 TRP 528.A O no hydrogen 2.930 N/A ARG 345.A NH1 SER 531.A O no hydrogen 3.423 N/A LEU 346.A N VAL 342.A O no hydrogen 3.012 N/A LEU 347.A N THR 343.A O no hydrogen 2.962 N/A CYS 348.A N ARG 345.A O no hydrogen 3.081 N/A CYS 348.A SG ALA 344.A O no hydrogen 3.461 N/A LEU 349.A N ARG 345.A O no hydrogen 2.771 N/A PHE 350.A N LEU 346.A O no hydrogen 3.004 N/A ALA 353.A N PHE 350.A O no hydrogen 3.283 N/A LEU 358.A N SER 354.A O no hydrogen 2.917 N/A VAL 359.A N VAL 355.A O no hydrogen 3.171 N/A GLU 360.A N GLY 356.A O no hydrogen 3.172 N/A LEU 361.A N THR 357.A O no hydrogen 2.794 N/A LYS 362.A N LEU 358.A O no hydrogen 2.967 N/A MET 363.A N VAL 359.A O no hydrogen 3.205 N/A GLU 364.A N LEU 361.A O no hydrogen 3.010 N/A LEU 365.A N LYS 362.A O no hydrogen 2.737 N/A VAL 366.A N LYS 362.A O no hydrogen 2.829 N/A ARG 367.A N MET 363.A O no hydrogen 3.139 N/A ARG 367.A NH2 GLU 364.A O no hydrogen 3.392 N/A LEU 371.A N ARG 367.A O no hydrogen 2.978 N/A ASN 372.A N ASN 368.A O no hydrogen 2.661 N/A ASN 372.A ND2 ASN 368.A OD1 no hydrogen 3.648 N/A LEU 374.A N ALA 370.A O no hydrogen 2.977 N/A VAL 375.A N LEU 371.A O no hydrogen 2.902 N/A GLN 376.A N ASN 372.A O no hydrogen 3.189 N/A THR 377.A N TYR 373.A O no hydrogen 3.122 N/A THR 377.A OG1 LEU 374.A O no hydrogen 3.076 N/A LEU 378.A N LEU 374.A O no hydrogen 3.239 N/A GLY 379.A N GLN 376.A O no hydrogen 2.880 N/A LEU 380.A N VAL 375.A O no hydrogen 3.442 N/A LEU 383.A N LEU 380.A O no hydrogen 2.759 N/A ALA 384.A N LEU 380.A O no hydrogen 2.858 N/A GLU 385.A N LEU 299.A O no hydrogen 3.141 N/A SER 387.A N ASP 302.A OD2 no hydrogen 2.766 N/A ASN 389.A N SER 387.A O no hydrogen 2.571 N/A THR 394.A N ASP 397.A OD1 no hydrogen 3.169 N/A ASP 397.A N THR 394.A O no hydrogen 3.053 N/A MET 398.A N TRP 395.A O no hydrogen 3.023 N/A TYR 399.A N ALA 396.A O no hydrogen 3.181 N/A TYR 399.A OH THR 423.A OG1 no hydrogen 2.629 N/A GLU 401.A N ASP 397.A O no hydrogen 2.932 N/A ILE 402.A N MET 398.A O no hydrogen 2.993 N/A VAL 403.A N TYR 399.A O no hydrogen 3.208 N/A GLY 404.A N GLU 400.A O no hydrogen 3.058 N/A SER 405.A N GLU 401.A O no hydrogen 2.807 N/A ILE 406.A N ILE 402.A O no hydrogen 2.754 N/A PHE 407.A N VAL 403.A O no hydrogen 2.957 N/A THR 408.A N GLY 404.A O no hydrogen 2.979 N/A THR 408.A OG1 GLY 404.A O no hydrogen 2.811 N/A THR 408.A OG1 SER 405.A O no hydrogen 3.251 N/A GLY 409.A N SER 405.A O no hydrogen 2.946 N/A GLY 412.A N GLY 409.A O no hydrogen 3.235 N/A TYR 414.A OH VAL 552.A O no hydrogen 2.840 N/A GLY 415.A N GLY 412.A O no hydrogen 3.267 N/A CYS 416.A SG VAL 403.A O no hydrogen 3.297 N/A CYS 416.A SG GLY 412.A O no hydrogen 3.819 N/A GLU 417.A N ILE 413.A O no hydrogen 2.964 N/A GLU 418.A N TYR 414.A O no hydrogen 3.124 N/A PHE 419.A N GLY 415.A O no hydrogen 2.872 N/A LEU 420.A N CYS 416.A O no hydrogen 2.855 N/A ALA 421.A N GLU 417.A O no hydrogen 3.011 N/A LYS 422.A N GLU 418.A O no hydrogen 3.079 N/A LYS 422.A NZ GLU 418.A OE2 no hydrogen 3.064 N/A THR 423.A N LEU 420.A O no hydrogen 3.259 N/A THR 423.A OG1 TYR 399.A OH no hydrogen 2.629 N/A THR 423.A OG1 PHE 419.A O no hydrogen 2.696 N/A THR 423.A OG1 LEU 420.A O no hydrogen 3.402 N/A LEU 424.A N LEU 420.A O no hydrogen 2.876 N/A SER 426.A N VAL 469.A O no hydrogen 2.955 N/A GLU 428.A N SER 426.A OG no hydrogen 3.008 N/A HIS 429.A N SER 426.A O no hydrogen 3.022 N/A SER 430.A N PRO 427.A O no hydrogen 3.441 N/A LYS 431.A NZ GLY 466.A O no hydrogen 3.280 N/A CYS 434.A SG PRO 435.A O no hydrogen 3.847 N/A CYS 434.A SG THR 439.A OG1 no hydrogen 3.559 N/A THR 439.A N ASP 436.A O no hydrogen 3.024 N/A THR 439.A OG1 PRO 435.A O no hydrogen 3.530 N/A LYS 440.A N ASP 436.A O no hydrogen 3.470 N/A SER 442.A N VAL 438.A O no hydrogen 3.088 N/A SER 442.A OG VAL 438.A O no hydrogen 3.123 N/A LYS 443.A N THR 439.A O no hydrogen 3.002 N/A ARG 444.A N LYS 440.A O no hydrogen 3.176 N/A ARG 444.A NE GLU 454.A OE2 no hydrogen 3.256 N/A ARG 444.A NH1 GLU 449.A OE2 no hydrogen 3.190 N/A VAL 445.A N ALA 441.A O no hydrogen 2.881 N/A CYS 446.A N SER 442.A O no hydrogen 3.196 N/A CYS 446.A SG SER 442.A O no hydrogen 3.534 N/A GLY 448.A N VAL 445.A O no hydrogen 3.406 N/A GLY 451.A N GLU 454.A OE1 no hydrogen 3.074 N/A GLU 454.A N GLU 454.A OE1 no hydrogen 2.674 N/A ARG 456.A N ALA 452.A O no hydrogen 3.366 N/A SER 457.A N HIS 453.A O no hydrogen 2.825 N/A SER 457.A OG HIS 453.A O no hydrogen 3.431 N/A LEU 458.A N GLU 454.A O no hydrogen 3.078 N/A VAL 459.A N PHE 455.A O no hydrogen 2.766 N/A ASP 460.A N ARG 456.A O no hydrogen 2.864 N/A TYR 461.A N SER 457.A O no hydrogen 2.997 N/A ALA 462.A N LEU 458.A O no hydrogen 3.112 N/A CYS 463.A N VAL 459.A O no hydrogen 2.670 N/A GLU 464.A N TYR 461.A O no hydrogen 2.930 N/A GLN 465.A N TYR 461.A O no hydrogen 2.818 N/A ILE 467.A N ALA 462.A O no hydrogen 3.207 N/A SER 468.A OG HIS 429.A O no hydrogen 2.874 N/A PHE 470.A N SER 476.A OG no hydrogen 3.276 N/A CYS 471.A N LEU 424.A O no hydrogen 3.176 N/A CYS 471.A SG LEU 424.A O no hydrogen 3.936 N/A ARG 474.A NH1 GLU 360.A OE1 no hydrogen 3.367 N/A VAL 475.A N SER 472.A OG no hydrogen 2.977 N/A SER 476.A N SER 472.A O no hydrogen 2.970 N/A SER 476.A OG SER 472.A O no hydrogen 2.465 N/A THR 477.A N SER 473.A O no hydrogen 3.115 N/A THR 477.A OG1 SER 473.A O no hydrogen 3.014 N/A MET 478.A N ARG 474.A O no hydrogen 2.793 N/A PHE 479.A N VAL 475.A O no hydrogen 2.652 N/A LEU 480.A N SER 476.A O no hydrogen 3.056 N/A GLU 481.A N THR 477.A O no hydrogen 3.435 N/A ARG 482.A N MET 478.A O no hydrogen 3.139 N/A ARG 482.A NH1 LEU 349.A O no hydrogen 2.988 N/A LEU 483.A N PHE 479.A O no hydrogen 2.992 N/A ARG 484.A N LEU 480.A O no hydrogen 3.359 N/A ASP 485.A N ARG 482.A O no hydrogen 3.205 N/A ILE 486.A N LEU 483.A O no hydrogen 3.150 N/A GLU 489.A N GLU 489.A OE1 no hydrogen 2.699 N/A ASP 490.A N PRO 487.A O no hydrogen 2.719 N/A MET 491.A N ALA 488.A O no hydrogen 3.391 N/A ASP 493.A N ASP 490.A O no hydrogen 3.083 N/A TRP 494.A N ASP 490.A O no hydrogen 3.286 N/A TYR 495.A N MET 491.A O no hydrogen 2.979 N/A ARG 496.A N LEU 492.A O no hydrogen 3.079 N/A LEU 497.A N ASP 493.A O no hydrogen 2.915 N/A GLY 498.A N TRP 494.A O no hydrogen 2.834 N/A ILE 499.A N TYR 495.A O no hydrogen 2.834 N/A GLN 500.A N ARG 496.A O no hydrogen 2.828 N/A PHE 501.A N LEU 497.A O no hydrogen 3.146 N/A SER 502.A N GLY 498.A O no hydrogen 2.980 N/A SER 502.A OG GLY 498.A O no hydrogen 2.754 N/A SER 502.A OG HIS 522.A ND1 no hydrogen 3.025 N/A HIS 503.A N ILE 499.A O no hydrogen 2.928 N/A ARG 504.A N GLN 500.A O no hydrogen 3.261 N/A SER 505.A N PHE 501.A O no hydrogen 3.098 N/A SER 505.A OG PHE 501.A O no hydrogen 2.766 N/A GLY 506.A N HIS 503.A O no hydrogen 3.108 N/A LEU 507.A N SER 502.A O no hydrogen 3.279 N/A ASP 518.A N SER 515.A OG no hydrogen 3.279 N/A ILE 519.A N SER 515.A O no hydrogen 2.967 N/A MET 520.A N VAL 516.A O no hydrogen 2.935 N/A THR 521.A N ILE 517.A O no hydrogen 2.859 N/A THR 521.A OG1 ILE 517.A O no hydrogen 2.888 N/A HIS 522.A N ASP 518.A O no hydrogen 2.934 N/A LEU 523.A N ILE 519.A O no hydrogen 3.136 N/A ALA 524.A N MET 520.A O no hydrogen 3.179 N/A ARG 525.A N THR 521.A O no hydrogen 2.956 N/A ARG 525.A NE ALA 421.A O no hydrogen 2.905 N/A ARG 525.A NH2 MET 425.A O no hydrogen 2.775 N/A GLY 526.A N HIS 522.A O no hydrogen 2.964 N/A LEU 527.A N LEU 523.A O no hydrogen 3.123 N/A TRP 528.A N ALA 524.A O no hydrogen 2.750 N/A LEU 529.A N ARG 525.A O no hydrogen 3.021 N/A GLY 530.A N GLY 526.A O no hydrogen 2.774 N/A SER 531.A N LEU 527.A O no hydrogen 3.169 N/A SER 531.A OG LEU 527.A O no hydrogen 2.754 N/A PHE 534.A N ILE 542.A O no hydrogen 3.037 N/A TYR 535.A N PRO 351.A O no hydrogen 3.085 N/A GLU 537.A N GLU 537.A OE1 no hydrogen 2.690 N/A ILE 542.A N PHE 534.A O no hydrogen 3.084 N/A VAL 544.A N PRO 532.A O no hydrogen 2.735 N/A TYR 548.A N LEU 545.A O no hydrogen 3.014 N/A TYR 548.A OH TYR 558.A O no hydrogen 2.606 N/A ARG 550.A N ILE 547.A O no hydrogen 3.038 N/A ARG 550.A NE GLU 713.A OE1 no hydrogen 2.598 N/A ARG 550.A NH1 GLU 417.A OE1 no hydrogen 3.201 N/A ARG 550.A NH1 GLU 417.A OE2 no hydrogen 3.122 N/A ARG 550.A NH2 GLU 417.A OE2 no hydrogen 2.671 N/A ARG 550.A NH2 GLU 713.A OE2 no hydrogen 3.093 N/A LEU 557.A N CYS 554.A O no hydrogen 3.282 N/A TYR 558.A N CYS 554.A O no hydrogen 3.110 N/A SER 560.A OG GLY 559.A O no hydrogen 3.246 N/A THR 562.A OG1 LEU 561.A O no hydrogen 2.435 N/A SER 568.A OG GLY 564.A O no hydrogen 3.472 N/A VAL 570.A N VAL 566.A O no hydrogen 3.141 N/A LEU 571.A N ALA 567.A O no hydrogen 2.837 N/A ALA 572.A N SER 568.A O no hydrogen 2.777 N/A LEU 573.A N LYS 569.A O no hydrogen 3.190 N/A TYR 574.A N VAL 570.A O no hydrogen 2.965 N/A GLU 575.A N LEU 571.A O no hydrogen 2.827 N/A LYS 576.A N ALA 572.A O no hydrogen 3.093 N/A ILE 577.A N LEU 573.A O no hydrogen 3.121 N/A LEU 578.A N TYR 574.A O no hydrogen 3.379 N/A ALA 579.A N GLU 575.A O no hydrogen 3.264 N/A ALA 590.A N SER 586.A O no hydrogen 2.912 N/A ALA 591.A N LYS 587.A O no hydrogen 2.751 N/A GLN 592.A N HIS 588.A O no hydrogen 3.246 N/A GLN 592.A NE2 HIS 588.A NE2 no hydrogen 2.941 N/A THR 593.A N ILE 589.A O no hydrogen 3.039 N/A THR 593.A OG1 ILE 589.A O no hydrogen 2.897 N/A THR 593.A OG1 ALA 590.A O no hydrogen 3.050 N/A VAL 594.A N ALA 590.A O no hydrogen 2.913 N/A SER 595.A N ALA 591.A O no hydrogen 2.767 N/A SER 597.A N VAL 594.A O no hydrogen 3.017 N/A SER 597.A OG THR 593.A O no hydrogen 2.817 N/A THR 606.A OG1 ALA 710.A O no hydrogen 2.623 N/A LEU 610.A N THR 606.A O no hydrogen 3.221 N/A ILE 611.A N ILE 607.A O no hydrogen 2.912 N/A ARG 612.A N PRO 608.A O no hydrogen 3.414 N/A LEU 613.A N PHE 609.A O no hydrogen 3.177 N/A LEU 614.A N LEU 610.A O no hydrogen 2.742 N/A GLN 615.A N ILE 611.A O no hydrogen 2.870 N/A ILE 616.A N ARG 612.A O no hydrogen 3.278 N/A ALA 617.A N LEU 613.A O no hydrogen 2.703 N/A LEU 618.A N LEU 614.A O no hydrogen 3.082 N/A LEU 618.A N GLN 615.A O no hydrogen 2.691 N/A THR 619.A N ILE 616.A O no hydrogen 3.178 N/A LYS 625.A NZ ALA 353.A O no hydrogen 2.679 N/A LYS 625.A NZ TYR 535.A O no hydrogen 3.064 N/A GLU 627.A N TYR 623.A O no hydrogen 2.684 N/A LEU 628.A N GLN 624.A O no hydrogen 3.142 N/A LEU 629.A N LYS 625.A O no hydrogen 3.034 N/A GLY 630.A N LEU 626.A O no hydrogen 2.765 N/A ASP 631.A N GLU 627.A O no hydrogen 2.814 N/A ALA 632.A N LEU 628.A O no hydrogen 3.250 N/A PHE 633.A N LEU 629.A O no hydrogen 3.027 N/A LEU 634.A N GLY 630.A O no hydrogen 2.969 N/A LYS 635.A N ASP 631.A O no hydrogen 3.331 N/A LYS 635.A NZ ASP 335.A OD1 no hydrogen 3.315 N/A CYS 636.A N ALA 632.A O no hydrogen 3.360 N/A SER 637.A N PHE 633.A O no hydrogen 2.681 N/A LEU 638.A N LEU 634.A O no hydrogen 2.941 N/A ALA 639.A N LYS 635.A O no hydrogen 2.748 N/A LEU 640.A N CYS 636.A O no hydrogen 3.173 N/A HIS 641.A N SER 637.A O no hydrogen 2.917 N/A HIS 641.A ND1 SER 637.A O no hydrogen 2.940 N/A LEU 642.A N LEU 638.A O no hydrogen 2.992 N/A HIS 643.A N ALA 639.A O no hydrogen 2.808 N/A ALA 644.A N LEU 640.A O no hydrogen 2.986 N/A LEU 645.A N HIS 641.A O no hydrogen 2.983 N/A HIS 646.A N LEU 642.A O no hydrogen 2.877 N/A LEU 649.A N HIS 646.A O no hydrogen 3.144 N/A LEU 654.A N THR 650.A O no hydrogen 3.107 N/A THR 655.A N GLU 651.A O no hydrogen 3.031 N/A THR 655.A OG1 GLU 651.A O no hydrogen 2.894 N/A ARG 656.A N GLY 652.A O no hydrogen 2.947 N/A ARG 656.A NH2 ASP 731.A OD1 no hydrogen 2.337 N/A MET 657.A N ALA 653.A O no hydrogen 2.868 N/A ARG 658.A N LEU 654.A O no hydrogen 3.213 N/A ARG 658.A NH1 GLU 662.A OE1 no hydrogen 2.665 N/A GLN 659.A N THR 655.A O no hydrogen 3.040 N/A SER 660.A N MET 657.A O no hydrogen 3.043 N/A SER 660.A OG MET 657.A O no hydrogen 2.496 N/A ALA 661.A N ARG 658.A O no hydrogen 3.276 N/A ASN 664.A ND2 LYS 694.A O no hydrogen 2.907 N/A LEU 667.A N THR 663.A O no hydrogen 3.030 N/A GLY 668.A N ASN 664.A O no hydrogen 2.917 N/A ARG 669.A N SER 665.A O no hydrogen 3.293 N/A LEU 670.A N VAL 666.A O no hydrogen 3.421 N/A THR 671.A N LEU 667.A O no hydrogen 3.223 N/A THR 671.A N GLY 668.A O no hydrogen 2.956 N/A THR 671.A OG1 LEU 667.A O no hydrogen 3.148 N/A THR 671.A OG1 TYR 696.A O no hydrogen 3.039 N/A LYS 672.A N ARG 669.A O no hydrogen 3.056 N/A LYS 672.A NZ PRO 691.A O no hydrogen 2.613 N/A ARG 673.A NH2 GLN 727.A OE1 no hydrogen 3.534 N/A PHE 674.A N THR 671.A O no hydrogen 3.428 N/A VAL 678.A N PRO 675.A O no hydrogen 2.782 N/A GLU 680.A N SER 676.A O no hydrogen 3.005 N/A VAL 681.A N VAL 677.A O no hydrogen 3.151 N/A ILE 682.A N VAL 678.A O no hydrogen 3.001 N/A ILE 683.A N SER 679.A O no hydrogen 2.932 N/A GLU 684.A N GLU 680.A O no hydrogen 2.939 N/A SER 685.A N VAL 681.A O no hydrogen 3.091 N/A SER 685.A N ILE 682.A O no hydrogen 3.230 N/A SER 685.A OG VAL 681.A O no hydrogen 2.964 N/A HIS 686.A N ILE 682.A O no hydrogen 3.147 N/A SER 693.A N GLN 690.A O no hydrogen 2.747 N/A VAL 695.A N SER 693.A OG no hydrogen 3.008 N/A ASP 698.A N LYS 694.A O no hydrogen 3.110 N/A THR 699.A N VAL 695.A O no hydrogen 2.961 N/A THR 699.A OG1 VAL 695.A O no hydrogen 3.123 N/A THR 699.A OG1 TYR 696.A O no hydrogen 2.929 N/A PHE 700.A N TYR 696.A O no hydrogen 3.150 N/A GLU 701.A N GLY 697.A O no hydrogen 3.256 N/A ALA 702.A N ASP 698.A O no hydrogen 2.757 N/A ILE 703.A N THR 699.A O no hydrogen 2.687 N/A LEU 704.A N PHE 700.A O no hydrogen 2.826 N/A ALA 705.A N GLU 701.A O no hydrogen 3.142 N/A ALA 706.A N ALA 702.A O no hydrogen 3.055 N/A ILE 707.A N ILE 703.A O no hydrogen 2.902 N/A LEU 708.A N LEU 704.A O no hydrogen 2.873 N/A LEU 709.A N ALA 705.A O no hydrogen 2.764 N/A ALA 710.A N ALA 706.A O no hydrogen 3.080 N/A CYS 711.A N ILE 707.A O no hydrogen 2.836 N/A GLY 712.A N LEU 708.A O no hydrogen 2.859 N/A ALA 716.A N GLY 712.A O no hydrogen 3.161 N/A GLY 717.A N GLU 713.A O no hydrogen 3.032 N/A ALA 718.A N GLU 714.A O no hydrogen 2.909 N/A PHE 719.A N ALA 715.A O no hydrogen 2.987 N/A VAL 720.A N ALA 716.A O no hydrogen 3.085 N/A ARG 721.A N GLY 717.A O no hydrogen 3.082 N/A GLU 722.A N ALA 718.A O no hydrogen 2.835 N/A HIS 723.A N PHE 719.A O no hydrogen 3.213 N/A HIS 723.A NE2 LEU 598.A O no hydrogen 3.224 N/A VAL 724.A N VAL 720.A O no hydrogen 2.794 N/A LEU 725.A N VAL 720.A O no hydrogen 2.939 N/A GLN 727.A N VAL 724.A O no hydrogen 3.041 N/A VAL 728.A N LEU 725.A O no hydrogen 3.060 N/A VAL 729.A N SER 660.A OG no hydrogen 3.179 N/A