Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4u3c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 7.A N ALA 33.A O no hydrogen 3.094 N/A ASP 8.A N ASP 7.A OD1 no hydrogen 2.420 N/A ALA 10.A N SER 31.A O no hydrogen 2.845 N/A GLY 16.A N VAL 13.A O no hydrogen 2.807 N/A VAL 17.A N SER 14.A O no hydrogen 3.241 N/A ALA 20.A N GLY 182.A O no hydrogen 3.009 N/A LYS 21.A N ASP 452.A O no hydrogen 2.557 N/A ALA 22.A N TRP 184.A O no hydrogen 3.291 N/A VAL 24.A N ASP 186.A O no hydrogen 3.176 N/A GLY 25.A N PRO 78.A O no hydrogen 3.168 N/A GLU 26.A N VAL 23.A O no hydrogen 3.235 N/A VAL 28.A N PHE 76.A O no hydrogen 3.271 N/A VAL 30.A N GLY 74.A O no hydrogen 2.567 N/A SER 31.A N ALA 10.A O no hydrogen 2.988 N/A ALA 32.A N PHE 72.A O no hydrogen 2.842 N/A ALA 33.A N ASP 7.A O no hydrogen 2.856 N/A VAL 34.A N PHE 70.A O no hydrogen 2.815 N/A ARG 36.A NH1 GLU 37.A OE1 no hydrogen 2.884 N/A ARG 36.A NH2 ALA 41.A O no hydrogen 2.635 N/A GLU 37.A N GLU 37.A OE2 no hydrogen 3.042 N/A GLU 40.A N GLU 40.A OE1 no hydrogen 2.211 N/A ALA 43.A N TRP 91.A O no hydrogen 2.796 N/A THR 45.A N ASP 89.A O no hydrogen 3.073 N/A LEU 46.A N ILE 61.A O no hydrogen 2.623 N/A VAL 47.A N ARG 87.A O no hydrogen 3.012 N/A VAL 48.A N LEU 59.A O no hydrogen 2.931 N/A ARG 49.A N THR 85.A O no hydrogen 3.038 N/A LEU 51.A N LEU 83.A O no hydrogen 3.220 N/A LEU 59.A N VAL 48.A O no hydrogen 2.977 N/A ILE 61.A N LEU 46.A O no hydrogen 2.885 N/A MET 63.A N ALA 44.A O no hydrogen 3.105 N/A THR 64.A N HIS 73.A O no hydrogen 2.989 N/A GLN 67.A N GLN 67.A OE1 no hydrogen 2.486 N/A PHE 72.A N ALA 32.A O no hydrogen 2.574 N/A HIS 73.A N THR 64.A O no hydrogen 3.064 N/A GLY 74.A N VAL 30.A O no hydrogen 2.588 N/A PHE 76.A N VAL 28.A O no hydrogen 3.227 N/A GLY 82.A N VAL 185.A O no hydrogen 3.381 N/A LEU 83.A N GLY 52.A O no hydrogen 3.156 N/A TRP 84.A N VAL 183.A O no hydrogen 2.737 N/A TRP 84.A NE1 ARG 80.A O no hydrogen 3.009 N/A THR 85.A N ARG 49.A O no hydrogen 3.057 N/A PHE 86.A N PHE 181.A O no hydrogen 3.078 N/A ARG 87.A N VAL 47.A O no hydrogen 3.193 N/A ARG 87.A NE ASP 89.A OD1 no hydrogen 3.489 N/A ARG 87.A NE ASP 89.A OD2 no hydrogen 2.696 N/A ARG 87.A NH2 ASP 89.A OD1 no hydrogen 3.471 N/A ASP 89.A N THR 45.A O no hydrogen 3.120 N/A GLY 90.A N THR 176.A O no hydrogen 2.775 N/A TRP 91.A N ALA 43.A O no hydrogen 2.908 N/A GLY 92.A N ASP 173.A O no hydrogen 3.416 N/A ASP 93.A N ALA 41.A O no hydrogen 3.296 N/A HIS 96.A N ASP 93.A OD1 no hydrogen 3.219 N/A THR 97.A N ASP 93.A O no hydrogen 3.320 N/A THR 97.A OG1 PRO 94.A O no hydrogen 2.348 N/A TRP 98.A N PRO 94.A O no hydrogen 2.624 N/A TRP 98.A NE1 ASP 114.A O no hydrogen 2.849 N/A ARG 99.A N ILE 95.A O no hydrogen 2.462 N/A HIS 100.A N HIS 96.A O no hydrogen 2.854 N/A GLY 101.A N THR 97.A O no hydrogen 2.987 N/A LEU 102.A N TRP 98.A O no hydrogen 2.878 N/A ILE 103.A N ARG 99.A O no hydrogen 3.028 N/A ALA 104.A N HIS 100.A O no hydrogen 3.417 N/A LYS 105.A N GLY 101.A O no hydrogen 3.353 N/A LEU 106.A N LEU 102.A O no hydrogen 2.770 N/A ALA 108.A N LYS 105.A O no hydrogen 2.927 N/A GLY 109.A N LYS 105.A O no hydrogen 3.029 N/A ASN 113.A N LEU 111.A O no hydrogen 2.213 N/A ASP 114.A N LEU 111.A O no hydrogen 3.166 N/A VAL 117.A N ASN 113.A O no hydrogen 3.473 N/A GLY 118.A N ASP 114.A O no hydrogen 3.064 N/A ALA 119.A N LEU 115.A O no hydrogen 2.792 N/A VAL 120.A N LEU 116.A O no hydrogen 2.815 N/A LEU 121.A N GLY 118.A O no hydrogen 2.821 N/A LEU 122.A N GLY 118.A O no hydrogen 2.942 N/A ARG 124.A N VAL 120.A O no hydrogen 3.207 N/A ARG 124.A NH1 ASP 173.A OD2 no hydrogen 3.003 N/A ARG 124.A NH2 ASP 173.A OD1 no hydrogen 2.724 N/A ALA 125.A N LEU 121.A O no hydrogen 2.591 N/A ALA 126.A N LEU 122.A O no hydrogen 2.844 N/A ALA 126.A N GLU 123.A O no hydrogen 3.045 N/A THR 127.A OG1 GLU 123.A O no hydrogen 3.541 N/A THR 127.A OG1 ARG 124.A O no hydrogen 3.065 N/A GLY 128.A N ALA 125.A O no hydrogen 3.013 N/A VAL 129.A N ALA 126.A O no hydrogen 3.041 N/A ALA 139.A N ASP 135.A O no hydrogen 2.879 N/A ALA 140.A N PRO 136.A O no hydrogen 2.538 N/A ALA 141.A N LEU 137.A O no hydrogen 2.335 N/A ALA 142.A N LEU 138.A O no hydrogen 2.830 N/A ARG 145.A NE ALA 141.A O no hydrogen 2.291 N/A ARG 145.A NH2 GLU 123.A OE1 no hydrogen 3.531 N/A VAL 151.A N ASP 149.A OD1 no hydrogen 2.932 N/A THR 152.A N ASP 149.A O no hydrogen 3.355 N/A THR 152.A OG1 ASP 149.A O no hydrogen 3.401 N/A ARG 153.A NH2 LEU 115.A O no hydrogen 2.363 N/A THR 154.A OG1 VAL 151.A O no hydrogen 2.736 N/A ALA 155.A N VAL 151.A O no hydrogen 3.157 N/A LEU 156.A N ARG 153.A O no hydrogen 2.949 N/A ALA 157.A N THR 154.A O no hydrogen 2.982 N/A LEU 158.A N THR 154.A O no hydrogen 2.450 N/A THR 159.A N ALA 155.A O no hydrogen 3.415 N/A GLU 161.A N THR 159.A OG1 no hydrogen 3.368 N/A ILE 162.A N THR 159.A O no hydrogen 2.742 N/A TYR 169.A N LEU 165.A O no hydrogen 2.311 N/A THR 176.A N GLY 90.A O no hydrogen 2.882 N/A THR 176.A OG1 VAL 4.A O no hydrogen 3.245 N/A THR 176.A OG1 GLY 90.A O no hydrogen 3.372 N/A GLY 178.A N VAL 88.A O no hydrogen 2.790 N/A PHE 181.A N PHE 86.A O no hydrogen 2.983 N/A VAL 183.A N TRP 84.A O no hydrogen 2.864 N/A TRP 184.A N ALA 20.A O no hydrogen 2.885 N/A TRP 184.A NE1 ASP 186.A OD1 no hydrogen 2.998 N/A TRP 184.A NE1 ASP 186.A OD2 no hydrogen 2.958 N/A VAL 185.A N GLY 82.A O no hydrogen 3.016 N/A ASP 186.A N ALA 22.A O no hydrogen 3.040 N/A ARG 187.A NE ASP 402.A O no hydrogen 2.933 N/A ARG 187.A NH1 GLU 301.A OE1 no hydrogen 3.265 N/A ARG 187.A NH1 GLU 301.A OE2 no hydrogen 3.110 N/A ARG 187.A NH2 GLU 301.A OE2 no hydrogen 2.823 N/A ARG 187.A NH2 ASP 402.A O no hydrogen 2.760 N/A ALA 190.A N ARG 187.A O no hydrogen 2.948 N/A ARG 191.A N PRO 188.A O no hydrogen 3.006 N/A ARG 191.A NH1 GLN 555.A OE1 no hydrogen 3.157 N/A PHE 192.A N PRO 188.A O no hydrogen 2.842 N/A ALA 194.A N ASP 233.A OD2 no hydrogen 3.212 N/A TRP 195.A N TRP 492.A O no hydrogen 2.872 N/A TYR 196.A N VAL 234.A O no hydrogen 2.886 N/A TYR 196.A OH GLU 499.A OE1 no hydrogen 2.178 N/A GLU 197.A N MET 494.A O no hydrogen 2.851 N/A MET 198.A N TYR 236.A O no hydrogen 3.188 N/A ARG 201.A NH1 GLY 263.A O no hydrogen 3.140 N/A ARG 201.A NH2 LYS 518.A O no hydrogen 3.203 N/A ARG 201.A NH2 GLU 520.A O no hydrogen 3.206 N/A SER 202.A N PHE 199.A O no hydrogen 2.915 N/A SER 202.A OG ARG 522.A O no hydrogen 2.657 N/A THR 203.A N PRO 200.A O no hydrogen 3.213 N/A THR 203.A OG1 PRO 200.A O no hydrogen 2.727 N/A THR 203.A OG1 THR 219.A OG1 no hydrogen 2.791 N/A HIS 214.A ND1 GLY 215.A O no hydrogen 3.025 N/A GLY 215.A N ARG 201.A O no hydrogen 2.786 N/A THR 216.A N THR 219.A OG1 no hydrogen 2.456 N/A THR 216.A OG1 LEU 282.A O no hydrogen 2.188 N/A PHE 217.A N LEU 282.A O no hydrogen 3.183 N/A THR 219.A OG1 THR 203.A OG1 no hydrogen 2.791 N/A THR 219.A OG1 THR 216.A O no hydrogen 2.595 N/A ALA 220.A N THR 216.A O no hydrogen 2.558 N/A ALA 221.A N PHE 217.A O no hydrogen 2.701 N/A ALA 222.A N THR 219.A O no hydrogen 3.231 N/A GLU 223.A N ALA 220.A O no hydrogen 3.039 N/A LEU 224.A N ALA 221.A O no hydrogen 3.167 N/A ARG 226.A NH2 GLU 499.A OE2 no hydrogen 2.574 N/A ALA 228.A N LEU 224.A O no hydrogen 3.166 N/A GLY 229.A N PRO 225.A O no hydrogen 2.810 N/A MET 230.A N ARG 226.A O no hydrogen 3.257 N/A MET 230.A N ILE 227.A O no hydrogen 3.067 N/A GLY 231.A N ALA 228.A O no hydrogen 2.854 N/A ASP 233.A N ALA 194.A O no hydrogen 2.940 N/A VAL 234.A N ALA 194.A O no hydrogen 2.908 N/A VAL 235.A N GLU 301.A O no hydrogen 3.121 N/A TYR 236.A N TYR 196.A O no hydrogen 2.757 N/A TYR 236.A OH ASP 305.A OD1 no hydrogen 2.683 N/A LEU 237.A N ALA 303.A O no hydrogen 2.861 N/A GLY 244.A N ALA 267.A O no hydrogen 3.106 N/A LYS 245.A N ASP 313.A OD2 no hydrogen 2.533 N/A LYS 245.A NZ ASP 271.A OD1 no hydrogen 3.321 N/A LYS 245.A NZ ASP 271.A OD2 no hydrogen 3.113 N/A VAL 246.A N ASP 313.A OD2 no hydrogen 3.353 N/A ARG 248.A NE GLY 244.A O no hydrogen 2.737 N/A ARG 248.A NH1 ASP 261.A O no hydrogen 2.904 N/A ARG 248.A NH2 ILE 243.A O no hydrogen 2.744 N/A ARG 248.A NH2 GLY 244.A O no hydrogen 2.925 N/A LYS 249.A NZ ASN 253.A OD1 no hydrogen 2.571 N/A LYS 249.A NZ ASP 344.A OD2 no hydrogen 3.477 N/A GLY 250.A N SER 254.A O no hydrogen 2.713 N/A SER 254.A N ARG 251.A O no hydrogen 3.064 N/A SER 254.A OG THR 256.A O no hydrogen 3.072 N/A ALA 258.A N ASP 261.A OD2 no hydrogen 3.251 N/A ASP 261.A N ALA 258.A O no hydrogen 3.404 N/A TRP 266.A N SER 264.A OG no hydrogen 3.102 N/A TRP 266.A NE1 ASP 305.A OD1 no hydrogen 2.395 N/A ALA 267.A N SER 264.A O no hydrogen 2.803 N/A GLY 269.A N PRO 242.A O no hydrogen 2.769 N/A SER 270.A N GLY 273.A O no hydrogen 2.970 N/A GLY 273.A N SER 270.A O no hydrogen 2.944 N/A HIS 275.A NE2 GLN 309.A O no hydrogen 3.022 N/A THR 277.A N GLY 274.A O no hydrogen 3.260 N/A THR 277.A OG1 GLY 274.A O no hydrogen 3.091 N/A HIS 279.A N ILE 240.A O no hydrogen 2.928 N/A SER 281.A OG HIS 214.A ND1 no hydrogen 2.903 N/A LEU 282.A N HIS 279.A O no hydrogen 2.964 N/A THR 284.A N ASP 287.A OD2 no hydrogen 3.065 N/A ASP 287.A N THR 284.A O no hydrogen 3.026 N/A ASP 287.A N THR 284.A OG1 no hydrogen 3.339 N/A ASP 289.A N ILE 285.A O no hydrogen 3.063 N/A ASP 290.A N ASP 286.A O no hydrogen 2.820 N/A PHE 291.A N ASP 287.A O no hydrogen 2.794 N/A VAL 292.A N PHE 288.A O no hydrogen 2.754 N/A SER 293.A N ASP 289.A O no hydrogen 3.083 N/A SER 293.A OG ASP 289.A O no hydrogen 2.410 N/A SER 293.A OG ASP 290.A O no hydrogen 2.908 N/A ALA 294.A N ASP 290.A O no hydrogen 2.932 N/A ALA 295.A N PHE 291.A O no hydrogen 3.111 N/A ARG 296.A N VAL 292.A O no hydrogen 3.054 N/A ARG 296.A NH2 GLY 372.A O no hydrogen 2.221 N/A ASP 297.A N SER 293.A O no hydrogen 3.119 N/A LEU 298.A N ALA 295.A O no hydrogen 2.792 N/A GLY 299.A N ARG 296.A O no hydrogen 3.147 N/A MET 300.A N ALA 295.A O no hydrogen 2.940 N/A GLU 301.A N ASP 233.A O no hydrogen 3.246 N/A ALA 303.A N VAL 235.A O no hydrogen 2.854 N/A LEU 304.A N PHE 375.A O no hydrogen 3.221 N/A ASP 305.A N LEU 237.A O no hydrogen 3.091 N/A LEU 306.A N ARG 377.A O no hydrogen 3.002 N/A GLN 309.A N ALA 307.A O no hydrogen 2.927 N/A CYS 310.A N GLN 309.A OE1 no hydrogen 3.320 N/A ALA 311.A N ILE 268.A O no hydrogen 2.626 N/A HIS 314.A N ALA 311.A O no hydrogen 3.086 N/A TRP 316.A N HIS 314.A ND1 no hydrogen 2.827 N/A ALA 317.A N HIS 314.A O no hydrogen 2.979 N/A ARG 318.A N PRO 315.A O no hydrogen 3.120 N/A GLU 319.A N PRO 315.A O no hydrogen 2.874 N/A HIS 320.A N TRP 316.A O no hydrogen 3.099 N/A GLN 322.A N GLN 322.A OE1 no hydrogen 2.649 N/A TRP 323.A NE1 ASP 353.A OD2 no hydrogen 2.917 N/A PHE 324.A N ARG 321.A O no hydrogen 3.222 N/A LEU 327.A N THR 331.A O no hydrogen 2.726 N/A GLY 330.A N LEU 327.A O no hydrogen 3.315 N/A THR 331.A N ASP 329.A OD1 no hydrogen 3.025 N/A THR 331.A OG1 ASP 329.A OD1 no hydrogen 3.126 N/A ALA 333.A N THR 325.A O no hydrogen 3.269 N/A ALA 335.A N ILE 345.A O no hydrogen 2.821 N/A ASN 337.A N LYS 340.A O no hydrogen 3.222 N/A LYS 340.A NZ ASN 337.A OD1 no hydrogen 2.905 N/A LYS 341.A NZ PRO 339.A O no hydrogen 2.360 N/A LYS 341.A NZ LYS 340.A O no hydrogen 3.431 N/A TYR 342.A N ALA 335.A O no hydrogen 3.378 N/A GLN 343.A NE2 HIS 247.A O no hydrogen 3.457 N/A GLN 343.A NE2 PRO 255.A O no hydrogen 3.277 N/A ILE 345.A N TYR 342.A O no hydrogen 3.271 N/A TYR 346.A N CYS 310.A O no hydrogen 2.645 N/A ASN 349.A N TRP 323.A O no hydrogen 2.789 N/A ASN 352.A ND2 GLN 322.A O no hydrogen 2.944 N/A LEU 357.A N ASP 353.A O no hydrogen 3.011 N/A TYR 358.A N PRO 354.A O no hydrogen 2.832 N/A ASP 359.A N GLU 355.A O no hydrogen 3.231 N/A GLU 360.A N GLY 356.A O no hydrogen 3.363 N/A VAL 361.A N LEU 357.A O no hydrogen 3.079 N/A LEU 362.A N TYR 358.A O no hydrogen 3.117 N/A ARG 363.A N ASP 359.A O no hydrogen 3.312 N/A ARG 363.A NH1 ASP 359.A O no hydrogen 2.514 N/A VAL 364.A N GLU 360.A O no hydrogen 2.956 N/A VAL 365.A N VAL 361.A O no hydrogen 2.948 N/A GLN 366.A N LEU 362.A O no hydrogen 2.953 N/A HIS 367.A N ARG 363.A O no hydrogen 2.975 N/A HIS 367.A N VAL 364.A O no hydrogen 3.069 N/A VAL 369.A N VAL 365.A O no hydrogen 3.054 N/A ASN 370.A N GLN 366.A O no hydrogen 3.072 N/A HIS 371.A N TRP 368.A O no hydrogen 2.846 N/A HIS 371.A ND1 ASP 289.A OD2 no hydrogen 2.586 N/A GLY 372.A N VAL 369.A O no hydrogen 3.295 N/A VAL 373.A N TRP 368.A O no hydrogen 3.212 N/A LYS 374.A NZ ASP 400.A OD1 no hydrogen 2.933 N/A LYS 374.A NZ ASP 400.A OD2 no hydrogen 3.190 N/A PHE 376.A N LEU 404.A O no hydrogen 3.105 N/A ARG 377.A N LEU 304.A O no hydrogen 2.944 N/A ARG 377.A NE TYR 428.A OH no hydrogen 2.899 N/A VAL 378.A N LEU 406.A O no hydrogen 2.803 N/A ASP 379.A N LEU 306.A O no hydrogen 2.725 N/A THR 383.A N ASN 380.A O no hydrogen 3.077 N/A THR 383.A OG1 ASN 380.A O no hydrogen 2.906 N/A LYS 384.A N PRO 381.A O no hydrogen 3.142 N/A LYS 384.A NZ ASP 379.A O no hydrogen 3.032 N/A LYS 384.A NZ ASN 380.A O no hydrogen 3.434 N/A LYS 384.A NZ THR 383.A OG1 no hydrogen 3.357 N/A TRP 389.A NE1 PRO 381.A O no hydrogen 2.626 N/A ALA 390.A N PRO 386.A O no hydrogen 3.159 N/A TRP 391.A N ASN 387.A O no hydrogen 2.903 N/A LEU 392.A N PHE 388.A O no hydrogen 2.684 N/A ILE 393.A N TRP 389.A O no hydrogen 2.776 N/A ALA 394.A N ALA 390.A O no hydrogen 3.295 N/A GLN 395.A N TRP 391.A O no hydrogen 3.014 N/A VAL 396.A N LEU 392.A O no hydrogen 2.896 N/A LYS 397.A N ILE 393.A O no hydrogen 2.965 N/A THR 398.A N ALA 394.A O no hydrogen 3.292 N/A ASP 400.A N VAL 396.A O no hydrogen 3.093 N/A ASP 402.A N ASP 400.A OD2 no hydrogen 3.122 N/A LEU 404.A N LYS 374.A O no hydrogen 2.982 N/A LEU 406.A N PHE 376.A O no hydrogen 2.945 N/A SER 407.A N GLN 426.A O no hydrogen 3.035 N/A GLU 408.A N VAL 378.A O no hydrogen 3.361 N/A ARG 415.A N PRO 412.A O no hydrogen 3.098 N/A ARG 415.A NE THR 411.A OG1 no hydrogen 2.944 N/A ARG 415.A NH2 THR 411.A OG1 no hydrogen 3.185 N/A GLN 416.A N PRO 412.A O no hydrogen 2.948 N/A GLN 416.A NE2 TYR 428.A O no hydrogen 2.969 N/A TYR 417.A N PRO 413.A O no hydrogen 2.679 N/A LEU 419.A N ARG 415.A O no hydrogen 2.802 N/A LYS 421.A N TYR 417.A O no hydrogen 3.358 N/A LEU 422.A N LEU 419.A O no hydrogen 3.164 N/A GLY 423.A N ALA 420.A O no hydrogen 3.183 N/A THR 425.A OG1 PHE 405.A O no hydrogen 2.813 N/A GLN 426.A N PHE 405.A O no hydrogen 3.175 N/A GLN 426.A NE2 ALA 190.A O no hydrogen 2.689 N/A SER 427.A N ARG 455.A O no hydrogen 2.867 N/A TYR 428.A N SER 407.A O no hydrogen 2.931 N/A TYR 430.A OH THR 411.A O no hydrogen 3.004 N/A TRP 433.A N TYR 430.A O no hydrogen 3.119 N/A TRP 433.A NE1 GLU 511.A OE2 no hydrogen 2.721 N/A ARG 434.A N PHE 431.A O no hydrogen 3.091 N/A ARG 434.A NH1 TRP 433.A O no hydrogen 3.380 N/A THR 435.A N GLU 439.A OE1 no hydrogen 3.336 N/A LYS 437.A NZ LEU 569.A O no hydrogen 3.428 N/A LEU 440.A N THR 436.A O no hydrogen 2.821 N/A THR 441.A N LYS 437.A O no hydrogen 2.959 N/A THR 441.A OG1 LYS 437.A O no hydrogen 2.446 N/A GLU 442.A N TRP 438.A O no hydrogen 2.790 N/A PHE 443.A N GLU 439.A O no hydrogen 2.724 N/A GLY 444.A N LEU 440.A O no hydrogen 2.855 N/A ASN 445.A N THR 441.A O no hydrogen 3.186 N/A GLN 446.A N GLU 442.A O no hydrogen 2.736 N/A ILE 447.A N PHE 443.A O no hydrogen 3.149 N/A ILE 447.A N GLY 444.A O no hydrogen 3.168 N/A TYR 453.A N LEU 450.A O no hydrogen 3.074 N/A ARG 454.A N LEU 450.A O no hydrogen 2.565 N/A ARG 454.A NH1 ILE 447.A O no hydrogen 3.503 N/A ARG 455.A NH1 THR 425.A O no hydrogen 3.283 N/A ASN 457.A N SER 427.A O no hydrogen 2.915 N/A LEU 458.A N ALA 491.A O no hydrogen 3.224 N/A VAL 460.A N GLY 493.A O no hydrogen 3.204 N/A ASN 461.A ND2 TYR 495.A O no hydrogen 3.626 N/A ASN 461.A ND2 TYR 513.A OH no hydrogen 2.704 N/A THR 462.A N ILE 465.A O no hydrogen 3.490 N/A ILE 465.A N THR 462.A O no hydrogen 3.019 N/A LEU 466.A N GLU 511.A O no hydrogen 2.596 N/A VAL 469.A N HIS 467.A ND1 no hydrogen 3.011 N/A LEU 470.A N HIS 467.A O no hydrogen 3.023 N/A GLN 471.A N HIS 467.A O no hydrogen 3.289 N/A GLN 471.A N ALA 468.A O no hydrogen 2.831 N/A GLN 471.A NE2 LEU 466.A O no hydrogen 3.640 N/A ASN 473.A N VAL 469.A O no hydrogen 3.355 N/A MET 477.A N GLY 474.A O no hydrogen 3.049 N/A ALA 479.A N GLY 476.A O no hydrogen 3.161 N/A ILE 480.A N GLY 476.A O no hydrogen 3.275 N/A ARG 481.A N MET 477.A O no hydrogen 2.925 N/A ARG 481.A NH1 ARG 434.A O no hydrogen 3.181 N/A ARG 481.A NH2 PHE 431.A O no hydrogen 3.156 N/A ARG 481.A NH2 ARG 434.A O no hydrogen 3.447 N/A ALA 482.A N PHE 478.A O no hydrogen 3.274 N/A VAL 483.A N ALA 479.A O no hydrogen 2.837 N/A LEU 484.A N ILE 480.A O no hydrogen 2.972 N/A ALA 485.A N ARG 481.A O no hydrogen 2.681 N/A ALA 486.A N ALA 482.A O no hydrogen 2.908 N/A THR 487.A N VAL 483.A O no hydrogen 3.058 N/A THR 487.A OG1 VAL 483.A O no hydrogen 2.196 N/A THR 487.A OG1 LEU 484.A O no hydrogen 3.333 N/A THR 487.A OG1 TYR 572.A OH no hydrogen 2.307 N/A MET 488.A N LEU 484.A O no hydrogen 2.910 N/A SER 489.A N ALA 485.A O no hydrogen 3.399 N/A SER 489.A OG PRO 456.A O no hydrogen 2.961 N/A SER 489.A OG ALA 491.A O no hydrogen 2.414 N/A ALA 491.A N SER 489.A OG no hydrogen 2.825 N/A TRP 492.A NE1 ASN 544.A OD1 no hydrogen 3.006 N/A GLY 493.A N LEU 458.A O no hydrogen 2.746 N/A MET 494.A N TRP 195.A O no hydrogen 2.919 N/A TYR 495.A N ASN 461.A OD1 no hydrogen 2.990 N/A CYS 496.A N GLU 197.A O no hydrogen 2.923 N/A CYS 496.A SG TYR 196.A OH no hydrogen 3.746 N/A TYR 498.A N TYR 495.A O no hydrogen 3.319 N/A LEU 500.A N GLY 497.A O no hydrogen 3.010 N/A PHE 501.A N TYR 498.A O no hydrogen 2.991 N/A GLU 502.A N GLY 497.A O no hydrogen 3.391 N/A VAL 506.A N GLU 512.A O no hydrogen 3.293 N/A SER 510.A N ARG 507.A O no hydrogen 3.318 N/A GLU 512.A N SER 510.A OG no hydrogen 3.363 N/A LEU 514.A N ARG 504.A O no hydrogen 3.300 N/A LYS 518.A N SER 516.A OG no hydrogen 3.242 N/A LYS 518.A NZ ASP 464.A OD1 no hydrogen 2.466 N/A TYR 519.A N SER 516.A O no hydrogen 3.236 N/A ARG 522.A N SER 202.A OG no hydrogen 3.112 N/A ARG 524.A NE GLU 502.A OE2 no hydrogen 3.432 N/A ARG 524.A NH1 GLU 517.A OE1 no hydrogen 2.849 N/A ARG 524.A NH1 GLU 517.A OE2 no hydrogen 2.670 N/A ARG 524.A NH2 GLU 502.A OE1 no hydrogen 2.321 N/A ARG 524.A NH2 GLU 517.A OE2 no hydrogen 2.504 N/A SER 528.A N ASP 525.A OD2 no hydrogen 2.920 N/A SER 528.A OG ASP 525.A OD1 no hydrogen 2.698 N/A SER 528.A OG ASP 525.A OD2 no hydrogen 2.703 N/A LEU 530.A N PHE 526.A O no hydrogen 3.185 N/A ASP 531.A N ALA 527.A O no hydrogen 3.243 N/A GLN 532.A N SER 528.A O no hydrogen 2.944 N/A GLY 533.A N LEU 530.A O no hydrogen 3.167 N/A ARG 534.A N ALA 529.A O no hydrogen 2.893 N/A LEU 536.A N GLU 499.A O no hydrogen 3.050 N/A GLN 537.A N SER 535.A OG no hydrogen 2.965 N/A ILE 540.A N LEU 536.A O no hydrogen 3.105 N/A THR 541.A N GLN 537.A O no hydrogen 3.081 N/A THR 541.A OG1 GLN 537.A O no hydrogen 2.353 N/A ARG 542.A N PRO 538.A O no hydrogen 2.927 N/A LEU 543.A N PHE 539.A O no hydrogen 2.789 N/A ASN 544.A N ILE 540.A O no hydrogen 2.847 N/A ASN 544.A ND2 MET 230.A O no hydrogen 2.810 N/A ILE 545.A N THR 541.A O no hydrogen 3.021 N/A ILE 546.A N ARG 542.A O no hydrogen 3.154 N/A ARG 547.A N LEU 543.A O no hydrogen 3.100 N/A ARG 547.A NH1 SER 489.A O no hydrogen 3.183 N/A ARG 547.A NH2 PRO 490.A O no hydrogen 2.324 N/A ARG 548.A N ASN 544.A O no hydrogen 3.116 N/A LEU 549.A N ILE 545.A O no hydrogen 2.751 N/A HIS 550.A N ILE 546.A O no hydrogen 2.897 N/A HIS 550.A ND1 ASP 581.A OD1 no hydrogen 3.356 N/A HIS 550.A NE2 GLU 619.A OE2 no hydrogen 2.395 N/A PHE 553.A N HIS 550.A O no hydrogen 3.124 N/A GLN 554.A N PRO 551.A O no hydrogen 3.138 N/A GLN 555.A N ALA 552.A O no hydrogen 3.193 N/A THR 558.A OG1 PHE 575.A O no hydrogen 2.767 N/A HIS 560.A N SER 573.A O no hydrogen 2.821 N/A HIS 562.A N ALA 571.A O no hydrogen 2.879 N/A HIS 562.A NE2 SER 573.A OG no hydrogen 3.037 N/A ASP 565.A N THR 598.A O no hydrogen 3.434 N/A ASN 566.A N VAL 564.A O no hydrogen 2.597 N/A ASN 566.A ND2 GLU 596.A O no hydrogen 2.929 N/A ALA 568.A N ASN 566.A OD1 no hydrogen 2.808 N/A LEU 569.A N ASN 566.A O no hydrogen 3.157 N/A LEU 570.A N VAL 587.A O no hydrogen 2.940 N/A TYR 572.A N VAL 585.A O no hydrogen 2.948 N/A TYR 572.A OH THR 487.A OG1 no hydrogen 2.307 N/A SER 573.A N HIS 560.A O no hydrogen 2.745 N/A SER 573.A OG HIS 562.A NE2 no hydrogen 3.037 N/A LYS 574.A N VAL 583.A O no hydrogen 2.859 N/A LYS 574.A NZ THR 487.A O no hydrogen 2.763 N/A LYS 574.A NZ MET 488.A O no hydrogen 2.713 N/A LYS 574.A NZ GLN 555.A O no hydrogen 3.468 N/A PHE 575.A N THR 558.A OG1 no hydrogen 3.274 N/A ASP 576.A N ASP 581.A O no hydrogen 2.734 N/A ALA 578.A N ASP 576.A OD1 no hydrogen 2.708 N/A THR 579.A N ASP 576.A OD2 no hydrogen 3.466 N/A GLY 580.A N ASP 576.A O no hydrogen 2.846 N/A CYS 582.A SG LYS 574.A O no hydrogen 3.921 N/A VAL 583.A N LYS 574.A O no hydrogen 2.816 N/A LEU 584.A N ILE 645.A O no hydrogen 3.002 N/A VAL 585.A N TYR 572.A O no hydrogen 2.704 N/A VAL 586.A N HIS 643.A O no hydrogen 2.967 N/A VAL 587.A N LEU 570.A O no hydrogen 2.875 N/A THR 588.A N VAL 641.A O no hydrogen 3.414 N/A THR 588.A OG1 ASN 590.A O no hydrogen 3.021 N/A LEU 589.A N ALA 568.A O no hydrogen 3.020 N/A ASN 590.A N THR 588.A OG1 no hydrogen 2.982 N/A ASN 590.A ND2 GLY 593.A O no hydrogen 2.716 N/A GLU 595.A N ILE 635.A O no hydrogen 2.868 N/A ALA 597.A N ILE 633.A O no hydrogen 3.011 N/A THR 598.A N ASP 565.A OD1 no hydrogen 2.774 N/A LEU 599.A N ASN 631.A O no hydrogen 2.831 N/A TRP 600.A N HIS 563.A O no hydrogen 2.866 N/A LEU 601.A N GLN 629.A O no hydrogen 2.908 N/A ALA 605.A N ASP 602.A O no hydrogen 2.981 N/A LEU 606.A N MET 603.A O no hydrogen 2.861 N/A GLY 607.A N ALA 604.A O no hydrogen 2.997 N/A MET 608.A N MET 603.A O no hydrogen 2.896 N/A ASP 612.A N GLU 609.A O no hydrogen 3.262 N/A PHE 614.A N TRP 627.A O no hydrogen 2.847 N/A VAL 616.A N TYR 625.A O no hydrogen 2.808 N/A ARG 617.A N ASN 646.A O no hydrogen 3.362 N/A GLU 619.A N ILE 644.A O no hydrogen 2.800 N/A ILE 620.A N ASP 618.A OD1 no hydrogen 2.842 N/A THR 621.A N ASP 618.A OD1 no hydrogen 3.217 N/A GLY 622.A N ASP 618.A O no hydrogen 2.537 N/A GLU 623.A N THR 621.A OG1 no hydrogen 3.174 N/A TYR 625.A N VAL 616.A O no hydrogen 2.823 N/A TRP 627.A N PHE 614.A O no hydrogen 2.704 N/A GLY 628.A N ASN 631.A OD1 no hydrogen 2.587 N/A ASN 631.A N LEU 599.A O no hydrogen 2.918 N/A ASN 631.A ND2 GLY 628.A O no hydrogen 2.503 N/A ILE 633.A N ALA 597.A O no hydrogen 3.286 N/A ILE 635.A N GLU 595.A O no hydrogen 2.717 N/A ALA 640.A N ASP 636.A O no hydrogen 3.010 N/A HIS 643.A N VAL 586.A O no hydrogen 2.870 N/A ILE 645.A N LEU 584.A O no hydrogen 2.810 N/A ASN 646.A N ARG 617.A O no hydrogen 2.711 N/A MET 647.A N CYS 582.A O no hydrogen 3.011 N/A VAL 650.A N GLY 580.A O no hydrogen 2.509 N/A SER 654.A OG PRO 577.A O no hydrogen 2.697 N/A THR 657.A N GLU 653.A O no hydrogen 3.350 N/A THR 657.A OG1 SER 654.A O no hydrogen 2.672 N/A LEU 658.A N ARG 655.A O no hydrogen 3.155 N/A