Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3j9t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A N VAL 62.A O no hydrogen 3.334 N/A GLY 2.A N VAL 62.A O no hydrogen 3.061 N/A ALA 3.A N GLU 15.A O no hydrogen 3.110 N/A ILE 4.A N ASP 60.A O no hydrogen 3.135 N/A SER 6.A N ILE 13.A O no hydrogen 3.331 N/A SER 8.A N VAL 11.A O no hydrogen 2.880 N/A VAL 11.A N SER 8.A O no hydrogen 3.093 N/A VAL 12.A N ILE 47.A O no hydrogen 2.921 N/A ILE 13.A N SER 6.A O no hydrogen 2.929 N/A ALA 14.A N ALA 45.A O no hydrogen 3.192 N/A GLU 15.A N ALA 3.A O no hydrogen 2.916 N/A MET 17.A N ASP 43.A O no hydrogen 3.391 N/A CYS 20.A SG ALA 21.A O no hydrogen 4.002 N/A GLU 24.A N ALA 21.A O no hydrogen 3.325 N/A LEU 25.A N LYS 67.A O no hydrogen 3.148 N/A VAL 26.A N GLY 35.A O no hydrogen 3.175 N/A LYS 27.A N LEU 63.A O no hydrogen 2.866 N/A VAL 28.A N LEU 33.A O no hydrogen 3.124 N/A LEU 33.A N VAL 28.A O no hydrogen 3.357 N/A GLU 36.A N GLN 48.A O no hydrogen 3.243 N/A VAL 37.A N GLU 24.A O no hydrogen 3.364 N/A ILE 38.A N THR 46.A O no hydrogen 2.877 N/A ARG 39.A N THR 46.A O no hydrogen 3.300 N/A ASP 41.A N LYS 44.A O no hydrogen 2.834 N/A LYS 44.A N ASP 41.A O no hydrogen 3.269 N/A ALA 45.A N ALA 14.A O no hydrogen 2.962 N/A THR 46.A N ARG 39.A O no hydrogen 2.916 N/A ILE 47.A N VAL 12.A O no hydrogen 2.985 N/A GLN 48.A N GLU 36.A O no hydrogen 3.239 N/A VAL 49.A N PRO 10.A O no hydrogen 3.398 N/A TYR 50.A N VAL 34.A O no hydrogen 3.428 N/A LEU 56.A N THR 53.A O no hydrogen 3.189 N/A GLY 59.A N ILE 4.A O no hydrogen 2.953 N/A VAL 62.A N GLY 2.A O no hydrogen 2.987 N/A LEU 63.A N LYS 27.A O no hydrogen 3.165 N/A ARG 64.A NH2 GLU 24.A OE1 no hydrogen 3.535 N/A THR 65.A OG1 LEU 25.A O no hydrogen 2.983 N/A THR 65.A OG1 LYS 67.A O no hydrogen 3.366 N/A LYS 67.A NZ SER 70.A OG no hydrogen 3.180 N/A SER 70.A OG PRO 68.A O no hydrogen 3.038 N/A VAL 71.A N TRP 192.A O no hydrogen 3.174 N/A LEU 73.A N HIS 190.A O no hydrogen 3.004 N/A MET 78.A N GLU 140.A OE1 no hydrogen 3.139 N/A THR 80.A OG1 GLY 76.A O no hydrogen 3.226 N/A THR 80.A OG1 MET 78.A O no hydrogen 3.209 N/A TYR 82.A N LEU 294.A O no hydrogen 3.006 N/A ASP 83.A N ARG 87.A O no hydrogen 3.486 N/A LEU 89.A N ILE 81.A O no hydrogen 3.013 N/A LYS 93.A N LEU 89.A O no hydrogen 3.090 N/A GLU 94.A N LYS 90.A O no hydrogen 3.464 N/A GLU 95.A N ALA 91.A O no hydrogen 3.166 N/A SER 96.A N ILE 92.A O no hydrogen 2.993 N/A SER 96.A OG ILE 92.A O no hydrogen 3.563 N/A ARG 103.A NE GLU 52.A O no hydrogen 3.213 N/A ARG 103.A NH2 GLU 52.A O no hydrogen 2.890 N/A ARG 112.A N ASP 111.A OD1 no hydrogen 3.040 N/A ARG 112.A NE LEU 110.A O no hydrogen 3.133 N/A THR 113.A OG1 ASP 111.A OD1 no hydrogen 2.933 N/A THR 113.A OG1 ASP 111.A OD2 no hydrogen 3.226 N/A LYS 115.A NZ THR 169.A OG1 no hydrogen 3.130 N/A TRP 116.A N TYR 168.A O no hydrogen 3.165 N/A PHE 118.A N GLY 166.A O no hydrogen 3.016 N/A THR 119.A N SER 137.A O no hydrogen 3.402 N/A THR 119.A OG1 PRO 120.A O no hydrogen 3.491 N/A GLY 126.A N ILE 159.A O no hydrogen 3.079 N/A ASP 127.A N GLN 124.A O no hydrogen 3.202 N/A ILE 129.A N GLY 157.A O no hydrogen 3.042 N/A SER 130.A N ASP 133.A OD2 no hydrogen 3.119 N/A TYR 135.A N ILE 149.A O no hydrogen 2.954 N/A TYR 135.A OH ILE 174.A O no hydrogen 2.783 N/A GLY 136.A N ILE 149.A O no hydrogen 3.139 N/A SER 137.A N THR 119.A O no hydrogen 3.223 N/A SER 137.A OG GLY 136.A O no hydrogen 3.306 N/A VAL 138.A N HIS 147.A O no hydrogen 2.807 N/A HIS 147.A NE2 LEU 188.A O no hydrogen 3.324 N/A LYS 148.A NZ GLN 323.A O no hydrogen 3.189 N/A ILE 149.A N GLY 136.A O no hydrogen 2.863 N/A LEU 151.A N ASP 133.A O no hydrogen 3.222 N/A GLY 157.A N ILE 129.A O no hydrogen 3.297 N/A THR 158.A N GLU 178.A O no hydrogen 3.195 N/A ILE 159.A N ASP 127.A O no hydrogen 3.430 N/A THR 160.A N GLU 176.A O no hydrogen 3.314 N/A TRP 161.A N GLU 176.A O no hydrogen 3.518 N/A ALA 163.A N ILE 174.A O no hydrogen 2.907 N/A GLY 166.A N PHE 118.A O no hydrogen 3.136 N/A TYR 168.A N TRP 116.A O no hydrogen 3.072 N/A TYR 168.A OH PRO 164.A O no hydrogen 3.175 N/A THR 169.A N GLU 172.A OE1 no hydrogen 2.978 N/A THR 169.A OG1 GLU 172.A OE1 no hydrogen 3.054 N/A ILE 174.A N PHE 186.A O no hydrogen 3.502 N/A GLU 176.A N TRP 161.A O no hydrogen 3.292 N/A GLU 178.A N THR 158.A O no hydrogen 2.930 N/A PHE 179.A N GLY 181.A O no hydrogen 2.995 N/A LYS 183.A N VAL 177.A O no hydrogen 3.246 N/A SER 184.A OG ASP 185.A O no hydrogen 3.346 N/A PHE 186.A N LEU 175.A O no hydrogen 2.913 N/A THR 187.A OG1 TYR 189.A O no hydrogen 3.075 N/A HIS 190.A N LEU 73.A O no hydrogen 3.042 N/A THR 191.A N HIS 190.A ND1 no hydrogen 3.001 N/A THR 191.A OG1 GLU 72.A OE1 no hydrogen 2.912 N/A TRP 192.A N VAL 71.A O no hydrogen 3.139 N/A THR 201.A OG1 ALA 377.A O no hydrogen 3.307 N/A LYS 203.A NZ GLU 370.A O no hydrogen 3.489 N/A LYS 203.A NZ ALA 372.A O no hydrogen 3.370 N/A LEU 204.A N LYS 374.A O no hydrogen 3.115 N/A GLN 214.A NE2 ILE 242.A O no hydrogen 3.560 N/A ARG 215.A NH2 ASP 512.A OD2 no hydrogen 3.182 N/A ALA 219.A N ARG 215.A O no hydrogen 2.943 N/A LEU 220.A N VAL 216.A O no hydrogen 3.242 N/A PHE 221.A N LEU 217.A O no hydrogen 3.419 N/A CYS 223.A SG THR 212.A OG1 no hydrogen 3.601 N/A THR 228.A OG1 THR 412.A OG1 no hydrogen 3.091 N/A CYS 230.A N VAL 414.A O no hydrogen 3.215 N/A ILE 231.A N ALA 391.A O no hydrogen 3.324 N/A GLY 233.A N VAL 393.A O no hydrogen 3.167 N/A LYS 239.A NZ SER 333.A OG no hydrogen 3.198 N/A VAL 241.A N GLY 238.A O no hydrogen 3.284 N/A ILE 242.A N GLY 238.A O no hydrogen 3.484 N/A SER 243.A N LYS 239.A O no hydrogen 3.086 N/A SER 243.A OG LYS 239.A O no hydrogen 2.859 N/A SER 243.A OG ASP 332.A OD2 no hydrogen 3.166 N/A GLN 244.A NE2 GLU 273.A OE2 no hydrogen 3.378 N/A SER 245.A N VAL 241.A O no hydrogen 3.182 N/A SER 245.A OG VAL 241.A O no hydrogen 3.318 N/A LEU 246.A N ILE 242.A O no hydrogen 2.751 N/A SER 247.A N SER 243.A O no hydrogen 3.117 N/A SER 247.A OG SER 243.A O no hydrogen 2.815 N/A LYS 248.A N GLN 244.A O no hydrogen 3.064 N/A LYS 248.A NZ TYR 278.A O no hydrogen 3.185 N/A LYS 248.A NZ GLU 280.A OE2 no hydrogen 3.407 N/A TYR 249.A N SER 245.A O no hydrogen 3.009 N/A SER 250.A OG LEU 246.A O no hydrogen 3.088 N/A ASN 251.A ND2 LEU 211.A O no hydrogen 3.411 N/A SER 252.A OG SER 328.A OG no hydrogen 3.258 N/A ASP 253.A N ASN 326.A O no hydrogen 2.977 N/A ILE 255.A N ARG 291.A O no hydrogen 3.140 N/A ILE 256.A N SER 328.A O no hydrogen 3.028 N/A TYR 257.A N THR 293.A O no hydrogen 3.209 N/A VAL 258.A N ILE 330.A O no hydrogen 2.940 N/A GLY 259.A N VAL 295.A O no hydrogen 3.072 N/A CYS 260.A N ASP 332.A O no hydrogen 3.007 N/A CYS 260.A SG SER 333.A O no hydrogen 3.657 N/A GLU 262.A N ASN 297.A O no hydrogen 3.038 N/A ALA 268.A N GLY 264.A O no hydrogen 3.144 N/A GLU 269.A N ASN 265.A O no hydrogen 3.366 N/A VAL 270.A N GLU 266.A O no hydrogen 3.390 N/A LEU 271.A N MET 267.A O no hydrogen 3.213 N/A MET 272.A N ALA 268.A O no hydrogen 3.513 N/A GLU 273.A N GLU 269.A O no hydrogen 2.927 N/A PHE 274.A N VAL 270.A O no hydrogen 3.469 N/A GLU 276.A N GLU 273.A O no hydrogen 2.950 N/A LEU 277.A N GLU 273.A O no hydrogen 3.019 N/A LEU 277.A N PHE 274.A O no hydrogen 3.208 N/A THR 279.A OG1 GLY 283.A O no hydrogen 3.006 N/A GLY 283.A N TYR 278.A OH no hydrogen 2.865 N/A LYS 285.A NZ GLU 79.A OE2 no hydrogen 3.242 N/A LYS 285.A NZ GLU 140.A O no hydrogen 3.368 N/A LYS 290.A N GLU 286.A O no hydrogen 2.990 N/A ARG 291.A N ILE 288.A O no hydrogen 3.273 N/A ARG 291.A NH1 SER 250.A O no hydrogen 3.563 N/A ARG 291.A NH1 SER 252.A O no hydrogen 2.939 N/A ARG 291.A NH2 SER 247.A O no hydrogen 3.562 N/A ARG 291.A NH2 LYS 248.A O no hydrogen 3.351 N/A THR 292.A N MET 289.A O no hydrogen 3.152 N/A THR 292.A OG1 ILE 288.A O no hydrogen 3.323 N/A THR 293.A N ILE 255.A O no hydrogen 3.382 N/A VAL 295.A N TYR 257.A O no hydrogen 3.032 N/A ALA 296.A N TYR 82.A O no hydrogen 2.959 N/A ASN 297.A N GLY 259.A O no hydrogen 3.129 N/A THR 298.A OG1 GLU 262.A O no hydrogen 2.773 N/A THR 298.A OG1 ARG 263.A O no hydrogen 2.927 N/A SER 299.A N THR 298.A OG1 no hydrogen 2.864 N/A MET 301.A N THR 298.A O no hydrogen 3.228 N/A ARG 306.A N PRO 302.A O no hydrogen 3.259 N/A ARG 306.A NH1 GLU 343.A OE1 no hydrogen 3.442 N/A ARG 306.A NH1 GLU 343.A OE2 no hydrogen 3.556 N/A ARG 306.A NH2 GLU 343.A OE2 no hydrogen 3.318 N/A GLU 307.A N VAL 303.A O no hydrogen 2.932 N/A ALA 308.A N ALA 304.A O no hydrogen 2.922 N/A SER 309.A N ARG 306.A O no hydrogen 3.320 N/A SER 309.A OG ARG 306.A O no hydrogen 2.666 N/A THR 312.A N ALA 308.A O no hydrogen 2.876 N/A THR 312.A OG1 GLY 84.A O no hydrogen 2.794 N/A THR 312.A OG1 ALA 308.A O no hydrogen 2.951 N/A GLY 313.A N SER 309.A O no hydrogen 3.218 N/A ILE 314.A N ILE 310.A O no hydrogen 3.264 N/A THR 315.A N TYR 311.A O no hydrogen 3.031 N/A THR 315.A OG1 TYR 311.A O no hydrogen 2.730 N/A LEU 316.A N THR 312.A O no hydrogen 3.330 N/A ALA 317.A N GLY 313.A O no hydrogen 3.069 N/A GLU 318.A N ILE 314.A O no hydrogen 2.912 N/A TYR 319.A N THR 315.A O no hydrogen 3.237 N/A PHE 320.A N LEU 316.A O no hydrogen 3.422 N/A ARG 321.A N ALA 317.A O no hydrogen 2.958 N/A ASP 322.A N GLU 318.A O no hydrogen 3.206 N/A GLN 323.A N PHE 320.A O no hydrogen 3.116 N/A GLY 324.A N ARG 321.A O no hydrogen 3.228 N/A LYS 325.A N PHE 320.A O no hydrogen 3.083 N/A LYS 325.A NZ SER 145.A O no hydrogen 3.268 N/A ASN 326.A N ASP 253.A OD1 no hydrogen 3.130 N/A VAL 327.A N SER 386.A O no hydrogen 3.034 N/A SER 328.A N ALA 254.A O no hydrogen 3.168 N/A SER 328.A OG SER 252.A OG no hydrogen 3.258 N/A MET 329.A N SER 388.A O no hydrogen 2.899 N/A ILE 330.A N ILE 256.A O no hydrogen 3.252 N/A ALA 331.A N VAL 390.A O no hydrogen 3.141 N/A ASP 332.A N VAL 258.A O no hydrogen 3.077 N/A SER 334.A N ALA 392.A O no hydrogen 2.703 N/A ARG 336.A N SER 333.A O no hydrogen 3.114 N/A ARG 336.A NE SER 335.A OG no hydrogen 3.274 N/A TRP 337.A N SER 333.A O no hydrogen 3.414 N/A TRP 337.A NE1 GLU 307.A O no hydrogen 2.892 N/A ALA 338.A N SER 334.A O no hydrogen 2.937 N/A GLU 339.A N SER 335.A O no hydrogen 3.230 N/A ALA 340.A N ARG 336.A O no hydrogen 3.432 N/A LEU 341.A N ALA 338.A O no hydrogen 3.269 N/A ARG 342.A N GLU 339.A O no hydrogen 3.158 N/A GLU 343.A N GLU 339.A O no hydrogen 3.287 N/A ILE 344.A N ALA 340.A O no hydrogen 3.279 N/A SER 345.A N LEU 341.A O no hydrogen 2.997 N/A SER 345.A OG LEU 341.A O no hydrogen 3.139 N/A GLY 346.A N ARG 342.A O no hydrogen 3.166 N/A ARG 347.A N GLU 343.A O no hydrogen 3.141 N/A LEU 348.A N ILE 344.A O no hydrogen 3.160 N/A GLY 349.A N SER 345.A O no hydrogen 2.860 N/A GLU 350.A N SER 345.A O no hydrogen 2.940 N/A ALA 353.A N PHE 357.A O no hydrogen 2.743 N/A GLN 355.A NE2 SER 401.A O no hydrogen 3.551 N/A GLY 356.A N ALA 353.A O no hydrogen 3.112 N/A PHE 357.A N ASP 354.A O no hydrogen 3.141 N/A LYS 364.A N TYR 360.A O no hydrogen 3.376 N/A LEU 365.A N LEU 361.A O no hydrogen 3.187 N/A ALA 366.A N GLY 362.A O no hydrogen 3.220 N/A SER 367.A N ALA 363.A O no hydrogen 2.949 N/A SER 367.A OG ALA 363.A O no hydrogen 2.839 N/A PHE 368.A N LYS 364.A O no hydrogen 3.273 N/A ARG 371.A NE SER 367.A O no hydrogen 3.275 N/A ARG 371.A NH2 ARG 195.A O no hydrogen 3.101 N/A ALA 372.A N TYR 369.A O no hydrogen 3.173 N/A GLY 373.A N VAL 387.A O no hydrogen 3.211 N/A ALA 375.A N GLY 385.A O no hydrogen 3.322 N/A VAL 376.A N GLU 202.A O no hydrogen 2.965 N/A ALA 377.A N ARG 383.A O no hydrogen 3.005 N/A SER 380.A N ASP 133.A OD1 no hydrogen 3.010 N/A SER 380.A OG ASP 133.A OD1 no hydrogen 3.218 N/A ARG 383.A NH1 GLY 132.A O no hydrogen 3.514 N/A GLY 385.A N ALA 375.A O no hydrogen 3.424 N/A SER 386.A OG GLY 385.A O no hydrogen 3.149 N/A VAL 387.A N GLY 373.A O no hydrogen 3.132 N/A SER 388.A N VAL 327.A O no hydrogen 3.394 N/A SER 388.A OG VAL 327.A O no hydrogen 3.485 N/A ILE 389.A N GLY 227.A O no hydrogen 3.110 N/A VAL 390.A N MET 329.A O no hydrogen 3.036 N/A ALA 391.A N THR 229.A O no hydrogen 3.097 N/A ALA 392.A N ALA 331.A O no hydrogen 3.196 N/A VAL 393.A N ILE 231.A O no hydrogen 3.357 N/A THR 405.A N ASP 402.A OD2 no hydrogen 3.191 N/A THR 405.A OG1 ASP 402.A OD1 no hydrogen 3.127 N/A THR 405.A OG1 ASP 402.A OD2 no hydrogen 3.087 N/A THR 406.A OG1 ASP 402.A O no hydrogen 3.371 N/A THR 406.A OG1 PRO 403.A O no hydrogen 3.278 N/A ALA 407.A N PRO 403.A O no hydrogen 2.907 N/A THR 408.A N VAL 404.A O no hydrogen 3.136 N/A THR 408.A OG1 VAL 404.A O no hydrogen 3.100 N/A THR 408.A OG1 THR 405.A O no hydrogen 2.789 N/A LEU 409.A N THR 405.A O no hydrogen 3.123 N/A ILE 411.A N THR 408.A O no hydrogen 2.944 N/A THR 412.A N THR 408.A O no hydrogen 3.004 N/A THR 412.A OG1 THR 228.A OG1 no hydrogen 3.091 N/A THR 412.A OG1 VAL 414.A O no hydrogen 3.067 N/A VAL 414.A N THR 412.A OG1 no hydrogen 3.150 N/A PHE 415.A N TYR 437.A O no hydrogen 3.190 N/A TRP 416.A N CYS 230.A O no hydrogen 3.364 N/A GLN 424.A N LYS 420.A O no hydrogen 2.987 N/A ARG 425.A N LYS 421.A O no hydrogen 3.137 N/A LYS 426.A N ALA 423.A O no hydrogen 3.279 N/A HIS 427.A N LEU 422.A O no hydrogen 2.887 N/A HIS 427.A ND1 LEU 422.A O no hydrogen 3.178 N/A SER 430.A OG ASP 419.A O no hydrogen 3.394 N/A SER 430.A OG HIS 427.A O no hydrogen 3.444 N/A SER 434.A OG GLU 470.A OE1 no hydrogen 3.316 N/A SER 434.A OG GLU 470.A OE2 no hydrogen 3.335 N/A SER 436.A OG ASN 432.A O no hydrogen 2.639 N/A TYR 437.A N PHE 415.A O no hydrogen 3.240 N/A TYR 437.A OH LEU 409.A O no hydrogen 3.222 N/A LYS 439.A N GLN 413.A O no hydrogen 3.278 N/A THR 441.A OG1 SER 438.A O no hydrogen 2.803 N/A LEU 444.A N TYR 440.A O no hydrogen 3.372 N/A ASN 445.A N THR 441.A O no hydrogen 3.060 N/A LYS 446.A N ASN 442.A O no hydrogen 3.382 N/A PHE 447.A N VAL 443.A O no hydrogen 3.179 N/A TYR 448.A N LEU 444.A O no hydrogen 3.087 N/A ASP 449.A N ASN 445.A O no hydrogen 2.818 N/A SER 450.A N LYS 446.A O no hydrogen 3.415 N/A ASN 451.A N TYR 448.A O no hydrogen 3.218 N/A ARG 459.A N PHE 455.A O no hydrogen 3.143 N/A ARG 459.A NE PHE 455.A O no hydrogen 3.388 N/A ARG 461.A N VAL 457.A O no hydrogen 3.510 N/A MET 462.A N LEU 458.A O no hydrogen 3.030 N/A LYS 463.A N ARG 459.A O no hydrogen 3.243 N/A GLU 464.A N ASP 460.A O no hydrogen 3.229 N/A ILE 465.A N ARG 461.A O no hydrogen 3.143 N/A SER 467.A N LYS 463.A O no hydrogen 3.277 N/A SER 467.A OG LYS 463.A O no hydrogen 3.560 N/A ASN 468.A N GLU 464.A O no hydrogen 3.036 N/A ALA 469.A N ILE 465.A O no hydrogen 3.199 N/A LEU 472.A N ASN 468.A O no hydrogen 3.362 N/A GLU 473.A N ALA 469.A O no hydrogen 2.946 N/A GLN 477.A N GLU 473.A O no hydrogen 3.267 N/A GLN 477.A NE2 GLU 473.A O no hydrogen 3.521 N/A LEU 478.A N GLN 474.A O no hydrogen 3.149 N/A VAL 479.A N VAL 475.A O no hydrogen 2.997 N/A GLY 480.A N VAL 475.A O no hydrogen 3.143 N/A LYS 489.A N SER 485.A O no hydrogen 3.221 N/A ILE 490.A N ASP 486.A O no hydrogen 3.149 N/A THR 491.A N SER 487.A O no hydrogen 3.260 N/A THR 491.A OG1 SER 487.A O no hydrogen 3.021 N/A LEU 492.A N ASP 488.A O no hydrogen 3.475 N/A ASP 493.A N LYS 489.A O no hydrogen 3.330 N/A VAL 494.A N ILE 490.A O no hydrogen 3.269 N/A ALA 495.A N THR 491.A O no hydrogen 3.110 N/A THR 496.A N LEU 492.A O no hydrogen 3.193 N/A THR 496.A OG1 LEU 492.A O no hydrogen 2.808 N/A LEU 497.A N ASP 493.A O no hydrogen 3.224 N/A ILE 498.A N VAL 494.A O no hydrogen 3.040 N/A LYS 499.A N ALA 495.A O no hydrogen 3.132 N/A GLU 500.A N THR 496.A O no hydrogen 2.908 N/A ASP 501.A N LEU 497.A O no hydrogen 3.064 N/A PHE 502.A N ILE 498.A O no hydrogen 3.070 N/A LEU 503.A N LYS 499.A O no hydrogen 3.018 N/A GLN 504.A N LYS 499.A O no hydrogen 3.304 N/A ASP 512.A N SER 509.A O no hydrogen 3.327 N/A CYS 515.A SG GLY 213.A O no hydrogen 3.889 N/A CYS 515.A SG TYR 511.A O no hydrogen 3.477 N/A CYS 515.A SG ASP 512.A O no hydrogen 3.830 N/A LYS 519.A NZ SER 561.A O no hydrogen 2.956 N/A LYS 519.A NZ PHE 564.A O no hydrogen 3.445 N/A THR 520.A OG1 PRO 516.A O no hydrogen 3.217 N/A PHE 521.A N ILE 517.A O no hydrogen 3.235 N/A ASP 522.A N TRP 518.A O no hydrogen 3.057 N/A MET 523.A N LYS 519.A O no hydrogen 3.144 N/A MET 524.A N THR 520.A O no hydrogen 3.444 N/A ARG 525.A N PHE 521.A O no hydrogen 3.203 N/A ALA 526.A N ASP 522.A O no hydrogen 3.255 N/A ILE 528.A N MET 524.A O no hydrogen 3.346 N/A SER 529.A N ARG 525.A O no hydrogen 3.209 N/A SER 529.A OG ARG 525.A O no hydrogen 2.770 N/A TYR 530.A N ALA 526.A O no hydrogen 3.348 N/A HIS 531.A N PHE 527.A O no hydrogen 3.169 N/A ASP 532.A N ILE 528.A O no hydrogen 3.266 N/A ALA 534.A N TYR 530.A O no hydrogen 2.928 N/A GLN 535.A N HIS 531.A O no hydrogen 3.360 N/A LYS 536.A N ASP 532.A O no hydrogen 3.225 N/A ALA 537.A N GLU 533.A O no hydrogen 2.924 N/A VAL 538.A N ALA 534.A O no hydrogen 3.140 N/A ALA 539.A N GLN 535.A O no hydrogen 3.151 N/A ASN 540.A N LYS 536.A O no hydrogen 2.986 N/A LYS 546.A NZ GLY 541.A O no hydrogen 3.498 N/A LYS 546.A NZ SER 591.A O no hydrogen 3.213 N/A LEU 547.A N ASN 543.A O no hydrogen 2.988 N/A ALA 548.A N TRP 544.A O no hydrogen 2.937 N/A ASP 549.A N SER 545.A O no hydrogen 3.237 N/A SER 550.A N LYS 546.A O no hydrogen 3.234 N/A SER 550.A OG LYS 546.A O no hydrogen 2.834 N/A THR 551.A N LEU 547.A O no hydrogen 2.995 N/A GLY 552.A N ALA 548.A O no hydrogen 3.456 N/A VAL 554.A N THR 551.A O no hydrogen 3.076 N/A HIS 556.A N GLY 552.A O no hydrogen 3.373 N/A ALA 557.A N ASP 553.A O no hydrogen 3.261 N/A VAL 558.A N VAL 554.A O no hydrogen 3.264 N/A SER 559.A OG GLU 500.A OE2 no hydrogen 2.960 N/A SER 560.A N HIS 556.A O no hydrogen 3.078 N/A SER 560.A OG HIS 556.A O no hydrogen 3.302 N/A SER 561.A N VAL 558.A O no hydrogen 3.441 N/A SER 561.A OG VAL 558.A O no hydrogen 2.845 N/A LYS 562.A NZ GLN 504.A OE1 no hydrogen 3.506 N/A PHE 563.A N SER 560.A O no hydrogen 3.285 N/A PHE 564.A N SER 561.A O no hydrogen 3.129 N/A GLY 569.A N VAL 573.A O no hydrogen 3.306 N/A GLU 570.A N VAL 573.A O no hydrogen 3.230 N/A HIS 574.A N ASP 522.A OD2 no hydrogen 3.164 N/A GLU 578.A N HIS 574.A O no hydrogen 3.329 N/A LYS 579.A N GLY 575.A O no hydrogen 3.101 N/A LEU 580.A N PHE 577.A O no hydrogen 3.000 N/A THR 583.A N LYS 579.A O no hydrogen 3.413 N/A THR 583.A OG1 LYS 579.A O no hydrogen 3.493 N/A THR 583.A OG1 LEU 580.A O no hydrogen 2.954 N/A MET 584.A N LEU 580.A O no hydrogen 2.939 N/A GLN 585.A N LEU 581.A O no hydrogen 3.203 N/A GLN 585.A NE2 LEU 581.A O no hydrogen 3.092 N/A GLU 586.A N SER 582.A O no hydrogen 3.204 N/A ARG 587.A N THR 583.A O no hydrogen 2.822 N/A PHE 588.A N MET 584.A O no hydrogen 3.197 N/A ALA 589.A N GLN 585.A O no hydrogen 3.246 N/A GLU 590.A N GLU 586.A O no hydrogen 3.410 N/A SER 591.A N ARG 587.A O no hydrogen 2.914 N/A SER 591.A OG ARG 587.A O no hydrogen 2.951 N/A THR 592.A N PHE 588.A O no hydrogen 3.052 N/A THR 592.A OG1 PHE 588.A O no hydrogen 3.019 N/A ASP 593.A N ALA 589.A O no hydrogen 3.261 N/A