Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3k6s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 1.A N ASN 2.A OD1 no hydrogen 3.442 N/A PHE 1.A N SER 550.A OG no hydrogen 3.243 N/A ASN 2.A ND2 VAL 512.A O no hydrogen 3.305 N/A ASN 2.A ND2 ARG 597.A O no hydrogen 3.179 N/A LEU 3.A N GLN 551.A OE1 no hydrogen 3.266 N/A ASP 4.A N ARG 595.A O no hydrogen 3.134 N/A THR 5.A OG1 LEU 3.A O no hydrogen 3.106 N/A GLU 6.A N ASP 4.A OD1 no hydrogen 3.048 N/A GLU 7.A N ASP 4.A OD1 no hydrogen 3.426 N/A PHE 11.A N VAL 591.A O no hydrogen 3.164 N/A ARG 12.A NE GLN 590.A OE1 no hydrogen 3.317 N/A ARG 12.A NH2 GLN 590.A OE1 no hydrogen 3.393 N/A ASP 20.A N GLY 33.A O no hydrogen 3.438 N/A SER 21.A OG LEU 75.A O no hydrogen 3.392 N/A VAL 23.A N VAL 31.A O no hydrogen 3.047 N/A GLN 24.A NE2 SER 570.A O no hydrogen 3.323 N/A TYR 25.A N TRP 29.A O no hydrogen 3.353 N/A TRP 29.A N ALA 26.A O no hydrogen 2.859 N/A VAL 30.A N CYS 50.A O no hydrogen 3.207 N/A VAL 31.A N VAL 23.A O no hydrogen 3.214 N/A VAL 32.A N TYR 48.A O no hydrogen 3.154 N/A LYS 37.A N ALA 34.A O no hydrogen 3.104 N/A THR 39.A OG1 THR 44.A O no hydrogen 3.130 N/A THR 39.A OG1 THR 44.A OG1 no hydrogen 2.880 N/A GLN 43.A NE2 ALA 68.A O no hydrogen 3.309 N/A THR 44.A OG1 THR 39.A OG1 no hydrogen 2.880 N/A GLN 49.A N GLU 58.A O no hydrogen 3.286 N/A CYS 50.A N VAL 30.A O no hydrogen 3.156 N/A GLU 58.A N GLN 49.A O no hydrogen 3.108 N/A GLY 74.A N CYS 89.A O no hydrogen 2.951 N/A SER 76.A OG GLY 336.A O no hydrogen 2.939 N/A SER 76.A OG PHE 337.A O no hydrogen 3.022 N/A ALA 78.A N LEU 87.A O no hydrogen 3.048 N/A SER 79.A OG GLN 24.A O no hydrogen 2.950 N/A SER 79.A OG GLN 85.A O no hydrogen 3.017 N/A THR 80.A N GLN 85.A O no hydrogen 3.158 N/A ALA 88.A N PHE 108.A O no hydrogen 3.284 N/A CYS 89.A SG GLY 336.A O no hydrogen 3.296 N/A GLY 90.A N LEU 106.A O no hydrogen 2.858 N/A THR 92.A OG1 ASN 70.A O no hydrogen 2.980 N/A HIS 94.A N VAL 69.A O no hydrogen 2.945 N/A HIS 94.A ND1 VAL 69.A O no hydrogen 3.256 N/A CYS 97.A SG HIS 95.A ND1 no hydrogen 3.278 N/A CYS 97.A SG HIS 95.A O no hydrogen 3.970 N/A LEU 103.A N GLU 331.A O no hydrogen 3.000 N/A THR 104.A N VAL 93.A O no hydrogen 3.404 N/A LEU 106.A N GLY 90.A O no hydrogen 3.142 N/A PHE 108.A N ALA 88.A O no hydrogen 3.075 N/A LEU 109.A N THR 116.A O no hydrogen 3.035 N/A LEU 110.A N LEU 86.A O no hydrogen 3.320 N/A THR 113.A OG1 GLN 114.A O no hydrogen 3.502 N/A THR 116.A N GLN 114.A O no hydrogen 2.770 N/A THR 116.A OG1 GLN 114.A O no hydrogen 3.373 N/A GLN 117.A NE2 GLN 63.A O no hydrogen 3.215 N/A CYS 126.A SG HIS 95.A ND1 no hydrogen 3.917 N/A GLN 131.A N SER 166.A O no hydrogen 3.364 N/A GLN 131.A NE2 ILE 314.A O no hydrogen 3.510 N/A ASP 132.A N ALA 232.A O no hydrogen 2.993 N/A ILE 133.A N GLN 168.A O no hydrogen 3.066 N/A VAL 134.A N ILE 234.A O no hydrogen 2.968 N/A LEU 136.A N ILE 236.A O no hydrogen 2.777 N/A ILE 137.A N MET 172.A O no hydrogen 3.171 N/A ASP 138.A N ILE 238.A O no hydrogen 3.012 N/A GLY 139.A N PHE 174.A O no hydrogen 3.457 N/A SER 140.A N ASP 138.A OD1 no hydrogen 3.099 N/A SER 140.A OG ASP 138.A OD1 no hydrogen 3.227 N/A SER 140.A OG ASP 138.A OD2 no hydrogen 2.885 N/A SER 140.A OG SER 142.A OG no hydrogen 2.800 N/A GLY 141.A N GLY 205.A O no hydrogen 3.028 N/A SER 142.A OG SER 140.A OG no hydrogen 2.800 N/A SER 142.A OG ASP 240.A OD1 no hydrogen 2.988 N/A SER 142.A OG ASP 240.A OD2 no hydrogen 2.762 N/A ILE 143.A N SER 140.A O no hydrogen 3.291 N/A ASN 147.A N SER 144.A OG no hydrogen 3.075 N/A THR 150.A OG1 ARG 146.A O no hydrogen 2.956 N/A MET 151.A N PHE 148.A O no hydrogen 2.909 N/A MET 152.A N PHE 148.A O no hydrogen 2.957 N/A PHE 154.A N THR 150.A O no hydrogen 3.060 N/A VAL 155.A N MET 151.A O no hydrogen 2.860 N/A ARG 156.A N MET 152.A O no hydrogen 3.243 N/A VAL 158.A N PHE 154.A O no hydrogen 3.121 N/A ILE 159.A N ARG 156.A O no hydrogen 3.081 N/A SER 160.A N ARG 156.A O no hydrogen 3.070 N/A SER 160.A N ALA 157.A O no hydrogen 3.272 N/A SER 160.A OG ALA 157.A O no hydrogen 2.881 N/A GLN 161.A N ALA 157.A O no hydrogen 3.505 N/A PHE 162.A N ILE 159.A O no hydrogen 3.416 N/A SER 166.A OG GLN 163.A O no hydrogen 2.930 N/A THR 167.A OG1 GLN 163.A O no hydrogen 3.043 N/A GLN 168.A NE2 PRO 165.A O no hydrogen 3.219 N/A SER 170.A N ILE 133.A O no hydrogen 3.270 N/A SER 170.A OG PHE 182.A O no hydrogen 2.985 N/A LEU 171.A N PHE 182.A O no hydrogen 3.354 N/A MET 172.A N PHE 135.A O no hydrogen 3.155 N/A GLN 173.A N GLN 179.A O no hydrogen 3.268 N/A GLN 173.A NE2 HIS 181.A NE2 no hydrogen 3.371 N/A GLN 173.A NE2 HIS 201.A O no hydrogen 3.354 N/A PHE 174.A N ILE 137.A O no hydrogen 3.099 N/A SER 175.A N LYS 177.A O no hydrogen 3.205 N/A SER 175.A OG ASN 176.A OD1 no hydrogen 3.508 N/A GLN 179.A N GLN 173.A O no hydrogen 3.270 N/A THR 183.A N GLU 186.A OE1 no hydrogen 3.194 N/A THR 183.A OG1 TYR 225.A O no hydrogen 3.567 N/A GLU 185.A N THR 183.A OG1 no hydrogen 3.205 N/A GLU 186.A N THR 183.A OG1 no hydrogen 3.417 N/A SER 190.A OG ASN 192.A O no hydrogen 3.228 N/A SER 195.A N ASN 192.A O no hydrogen 3.152 N/A SER 195.A OG ASN 192.A O no hydrogen 2.606 N/A LEU 196.A N PRO 193.A O no hydrogen 2.902 N/A LEU 197.A N LEU 194.A O no hydrogen 3.132 N/A GLN 202.A NE2 SER 140.A O no hydrogen 3.505 N/A GLN 202.A NE2 ILE 143.A O no hydrogen 2.975 N/A THR 207.A OG1 GLU 244.A OE2 no hydrogen 3.562 N/A THR 211.A N ASP 246.A OD1 no hydrogen 3.265 N/A THR 211.A OG1 ASP 246.A OD1 no hydrogen 3.097 N/A ALA 212.A N TYR 208.A O no hydrogen 3.322 N/A ILE 213.A N THR 209.A O no hydrogen 3.465 N/A GLN 214.A N ALA 210.A O no hydrogen 3.359 N/A ASN 215.A N THR 211.A O no hydrogen 3.103 N/A VAL 216.A N ILE 213.A O no hydrogen 3.229 N/A VAL 217.A N ILE 213.A O no hydrogen 3.142 N/A HIS 218.A N GLN 214.A O no hydrogen 3.055 N/A LEU 220.A N VAL 216.A O no hydrogen 2.971 N/A HIS 222.A N ARG 219.A O no hydrogen 3.120 N/A ARG 228.A NE ASP 132.A OD1 no hydrogen 3.462 N/A ARG 228.A NH2 GLN 131.A O no hydrogen 3.079 N/A ALA 232.A N GLU 130.A O no hydrogen 3.008 N/A LYS 233.A NZ ARG 229.A O no hydrogen 3.302 N/A LYS 233.A NZ ALA 231.A O no hydrogen 3.189 N/A LEU 235.A N ILE 263.A O no hydrogen 3.163 N/A ILE 236.A N VAL 134.A O no hydrogen 3.081 N/A ILE 238.A N LEU 136.A O no hydrogen 2.989 N/A THR 239.A N ILE 267.A O no hydrogen 3.406 N/A THR 239.A OG1 GLY 241.A O no hydrogen 2.993 N/A GLY 241.A N THR 239.A OG1 no hydrogen 3.206 N/A LYS 242.A NZ ASN 277.A O no hydrogen 3.503 N/A LYS 243.A N GLU 281.A OE2 no hydrogen 3.299 N/A LYS 243.A NZ ASP 246.A OD2 no hydrogen 3.553 N/A LYS 243.A NZ LEU 248.A O no hydrogen 3.141 N/A LYS 243.A NZ ASP 249.A OD1 no hydrogen 3.098 N/A ASP 252.A N ASP 249.A O no hydrogen 3.225 N/A ILE 254.A N TYR 250.A O no hydrogen 3.238 N/A ALA 257.A N ILE 254.A O no hydrogen 3.281 N/A ASP 258.A N ILE 254.A O no hydrogen 3.258 N/A ALA 259.A N PRO 255.A O no hydrogen 3.251 N/A GLY 261.A N ASP 258.A O no hydrogen 3.024 N/A ILE 263.A N LYS 233.A O no hydrogen 3.143 N/A ARG 264.A NE ILE 285.A O no hydrogen 2.848 N/A ARG 264.A NH1 ILE 254.A O no hydrogen 3.351 N/A ARG 264.A NH2 ASP 258.A OD2 no hydrogen 2.962 N/A TYR 265.A N LEU 235.A O no hydrogen 3.154 N/A ILE 267.A N VAL 237.A O no hydrogen 3.065 N/A GLY 270.A N VAL 297.A O no hydrogen 3.426 N/A GLN 274.A N LEU 271.A O no hydrogen 2.915 N/A ASN 275.A N ALA 272.A O no hydrogen 3.380 N/A SER 278.A OG ASN 277.A OD1 no hydrogen 2.974 N/A LEU 282.A N TRP 279.A O no hydrogen 3.457 N/A ASP 284.A N LYS 280.A O no hydrogen 3.064 N/A ALA 286.A N LEU 282.A O no hydrogen 3.119 N/A SER 287.A N ARG 264.A O no hydrogen 3.007 N/A SER 287.A OG ASP 258.A OD1 no hydrogen 3.505 N/A HIS 293.A ND1 PRO 289.A O no hydrogen 2.954 N/A PHE 295.A N ALA 266.A O no hydrogen 3.033 N/A VAL 297.A N GLY 268.A O no hydrogen 2.958 N/A ASP 301.A N ASP 299.A OD1 no hydrogen 3.193 N/A LEU 303.A N PHE 300.A O no hydrogen 3.264 N/A ASP 305.A N ALA 302.A O no hydrogen 3.191 N/A GLN 307.A NE2 ALA 157.A O no hydrogen 3.622 N/A GLN 309.A N ILE 306.A O no hydrogen 3.003 N/A LEU 310.A N ILE 306.A O no hydrogen 2.892 N/A LYS 311.A NZ ASN 308.A O no hydrogen 2.832 N/A GLU 312.A N GLN 309.A O no hydrogen 3.153 N/A ALA 316.A N GLU 312.A O no hydrogen 3.042 N/A ILE 317.A N ILE 314.A O no hydrogen 3.372 N/A GLU 329.A N GLU 331.A OE1 no hydrogen 2.967 N/A LEU 330.A N GLU 331.A OE2 no hydrogen 3.452 N/A GLN 334.A N LEU 103.A O no hydrogen 3.232 N/A GLU 335.A N THR 104.A O no hydrogen 2.951 N/A GLY 336.A N GLY 349.A O no hydrogen 3.184 N/A SER 338.A OG GLY 387.A O no hydrogen 2.640 N/A SER 338.A OG TYR 388.A O no hydrogen 3.103 N/A VAL 340.A N VAL 347.A O no hydrogen 3.148 N/A THR 342.A OG1 ASP 344.A OD1 no hydrogen 3.186 N/A LEU 348.A N PHE 361.A O no hydrogen 3.203 N/A ALA 350.A N GLY 359.A O no hydrogen 2.993 N/A VAL 351.A N ALA 333.A O no hydrogen 3.052 N/A PHE 354.A N GLU 329.A O no hydrogen 2.776 N/A SER 357.A N SER 353.A O no hydrogen 2.842 N/A GLY 359.A N ALA 350.A O no hydrogen 3.036 N/A GLY 359.A N LEU 386.A O no hydrogen 2.882 N/A PHE 361.A N LEU 348.A O no hydrogen 2.819 N/A LEU 362.A N THR 370.A O no hydrogen 3.299 N/A TYR 363.A N PRO 346.A O no hydrogen 3.256 N/A TYR 363.A OH GLU 335.A OE2 no hydrogen 2.416 N/A ASN 366.A N PRO 364.A O no hydrogen 2.974 N/A THR 370.A N LEU 362.A O no hydrogen 2.894 N/A ILE 372.A N ALA 360.A O no hydrogen 3.182 N/A SER 375.A N ASN 373.A OD1 no hydrogen 3.168 N/A SER 375.A OG MET 374.A O no hydrogen 2.395 N/A ASP 383.A N THR 355.A O no hydrogen 3.189 N/A SER 384.A OG SER 357.A O no hydrogen 3.256 N/A SER 384.A OG MET 381.A O no hydrogen 3.472 N/A LEU 386.A N SER 357.A O no hydrogen 3.081 N/A GLY 387.A N GLY 404.A O no hydrogen 3.182 N/A TYR 388.A N TYR 385.A O no hydrogen 2.806 N/A TYR 388.A N GLY 404.A O no hydrogen 3.258 N/A SER 389.A OG GLY 440.A O no hydrogen 2.975 N/A SER 389.A OG ALA 441.A O no hydrogen 2.942 N/A GLU 391.A N VAL 402.A O no hydrogen 3.273 N/A SER 400.A OG GLN 399.A O no hydrogen 2.845 N/A LEU 401.A N PHE 417.A O no hydrogen 3.088 N/A LEU 403.A N VAL 415.A O no hydrogen 3.133 N/A GLY 404.A N SER 389.A O no hydrogen 2.951 N/A ALA 405.A N LYS 413.A O no hydrogen 2.999 N/A TYR 408.A OH ASP 380.A OD2 no hydrogen 2.858 N/A THR 411.A N TYR 408.A O no hydrogen 3.190 N/A THR 411.A OG1 TYR 408.A O no hydrogen 3.032 N/A GLY 412.A N TYR 408.A O no hydrogen 3.426 N/A LYS 413.A N ALA 405.A O no hydrogen 2.890 N/A LYS 413.A NZ GLU 429.A OE1 no hydrogen 3.148 N/A ALA 414.A N VAL 430.A O no hydrogen 3.252 N/A VAL 415.A N LEU 403.A O no hydrogen 3.309 N/A ILE 416.A N ALA 428.A O no hydrogen 3.109 N/A PHE 417.A N LEU 401.A O no hydrogen 2.996 N/A THR 418.A N ARG 425.A O no hydrogen 3.195 N/A LYS 427.A N ILE 416.A O no hydrogen 3.019 N/A VAL 430.A N ALA 414.A O no hydrogen 3.220 N/A THR 431.A OG1 GLY 432.A O no hydrogen 3.567 N/A GLY 436.A N HIS 410.A O no hydrogen 3.152 N/A SER 437.A N GLN 434.A O no hydrogen 3.307 N/A SER 437.A OG THR 411.A O no hydrogen 3.548 N/A SER 437.A OG GLN 434.A O no hydrogen 2.847 N/A TYR 438.A N THR 411.A O no hydrogen 3.179 N/A PHE 439.A N SER 437.A OG no hydrogen 3.312 N/A GLY 440.A N GLY 460.A O no hydrogen 3.004 N/A ALA 441.A N TYR 438.A O no hydrogen 3.226 N/A SER 442.A OG GLY 503.A O no hydrogen 2.918 N/A SER 442.A OG ALA 504.A O no hydrogen 2.780 N/A CYS 444.A N LEU 458.A O no hydrogen 3.200 N/A SER 445.A OG GLU 391.A OE2 no hydrogen 3.226 N/A SER 445.A OG LEU 392.A O no hydrogen 2.775 N/A VAL 446.A N LEU 456.A O no hydrogen 3.041 N/A SER 450.A OG ASP 449.A O no hydrogen 2.924 N/A ASP 451.A N ASP 449.A OD1 no hydrogen 3.192 N/A GLY 452.A N ASP 447.A OD2 no hydrogen 3.328 N/A SER 453.A N ASP 451.A OD1 no hydrogen 3.072 N/A LEU 456.A N VAL 446.A O no hydrogen 3.335 N/A VAL 457.A N CYS 476.A O no hydrogen 2.950 N/A LEU 458.A N CYS 444.A O no hydrogen 2.921 N/A GLN 472.A N PHE 502.A O no hydrogen 3.029 N/A GLN 472.A NE2 VAL 473.A O no hydrogen 2.900 N/A VAL 473.A N GLY 493.A O no hydrogen 3.363 N/A SER 474.A N ILE 459.A O no hydrogen 2.848 N/A CYS 476.A N VAL 457.A O no hydrogen 2.761 N/A CYS 476.A SG SER 474.A O no hydrogen 3.577 N/A CYS 476.A SG SER 474.A OG no hydrogen 3.150 N/A LEU 478.A N ASP 455.A O no hydrogen 3.124 N/A ARG 483.A N LYS 427.A O no hydrogen 3.322 N/A LEU 491.A N ALA 489.A O no hydrogen 3.149 N/A HIS 497.A NE2 GLU 528.A O no hydrogen 3.131 N/A GLY 500.A N ARG 469.A O no hydrogen 3.455 N/A PHE 502.A N GLY 470.A O no hydrogen 3.159 N/A GLY 503.A N GLY 523.A O no hydrogen 3.134 N/A THR 507.A N VAL 521.A O no hydrogen 3.352 N/A THR 507.A OG1 VAL 508.A O no hydrogen 3.309 N/A LEU 509.A N ASP 519.A O no hydrogen 3.187 N/A GLY 510.A N ASP 519.A O no hydrogen 3.138 N/A ASP 515.A N ASN 513.A OD1 no hydrogen 3.225 N/A LEU 517.A N ASP 515.A OD1 no hydrogen 3.083 N/A THR 518.A N VAL 448.A O no hydrogen 3.072 N/A ASP 519.A N GLY 510.A O no hydrogen 2.859 N/A VAL 520.A N PHE 537.A O no hydrogen 3.330 N/A VAL 521.A N THR 507.A O no hydrogen 3.351 N/A ILE 522.A N TYR 535.A O no hydrogen 3.121 N/A GLY 523.A N ALA 505.A O no hydrogen 3.120 N/A ALA 524.A N ALA 533.A O no hydrogen 2.923 N/A GLY 526.A N GLY 500.A O no hydrogen 2.892 N/A GLU 527.A N ALA 524.A O no hydrogen 3.313 N/A ASN 530.A N GLU 528.A O no hydrogen 2.846 N/A ALA 533.A N PHE 565.A O no hydrogen 3.248 N/A VAL 534.A N ILE 553.A O no hydrogen 3.093 N/A TYR 535.A N ILE 522.A O no hydrogen 2.813 N/A TYR 535.A OH GLU 527.A OE2 no hydrogen 2.906 N/A PHE 537.A N VAL 520.A O no hydrogen 3.188 N/A HIS 538.A NE2 SER 550.A OG no hydrogen 3.004 N/A GLY 539.A N THR 518.A O no hydrogen 3.232 N/A LEU 541.A N SER 544.A OG no hydrogen 3.392 N/A SER 546.A N HIS 538.A O no hydrogen 2.970 N/A SER 546.A OG SER 548.A O no hydrogen 3.184 N/A SER 550.A N LEU 536.A O no hydrogen 3.245 N/A SER 550.A OG HIS 538.A NE2 no hydrogen 3.004 N/A GLN 551.A NE2 LEU 3.A O no hydrogen 3.138 N/A ARG 552.A NH2 GLU 527.A OE1 no hydrogen 3.161 N/A GLY 555.A N GLY 532.A O no hydrogen 3.082 N/A SER 556.A OG GLU 528.A OE1 no hydrogen 2.887 N/A SER 556.A OG GLU 528.A OE2 no hydrogen 2.814 N/A GLY 566.A N GLY 586.A O no hydrogen 2.982 N/A GLN 567.A NE2 GLY 19.A O no hydrogen 3.030 N/A SER 570.A N ALA 584.A O no hydrogen 3.121 N/A SER 570.A OG LEU 569.A O no hydrogen 3.038 N/A GLY 572.A N ASP 582.A O no hydrogen 3.156 N/A LEU 575.A N ASP 582.A OD2 no hydrogen 3.084 N/A THR 576.A N ASP 582.A OD2 no hydrogen 3.100 N/A THR 576.A OG1 ASP 578.A OD2 no hydrogen 2.739 N/A THR 576.A OG1 ASP 582.A OD2 no hydrogen 3.540 N/A ASP 578.A N THR 576.A OG1 no hydrogen 3.418 N/A ASP 582.A N GLN 573.A O no hydrogen 3.057 N/A LEU 583.A N LEU 594.A O no hydrogen 3.112 N/A ALA 584.A N SER 570.A O no hydrogen 3.385 N/A VAL 585.A N LEU 592.A O no hydrogen 3.151 N/A GLY 586.A N ALA 568.A O no hydrogen 3.112 N/A ALA 587.A N GLN 590.A O no hydrogen 2.974 N/A ARG 588.A NH1 GLN 563.A OE1 no hydrogen 3.295 N/A GLY 589.A N PHE 18.A O no hydrogen 3.311 N/A VAL 591.A N PHE 11.A O no hydrogen 2.968 N/A LEU 592.A N VAL 585.A O no hydrogen 3.104 N/A LEU 593.A N THR 9.A O no hydrogen 3.217 N/A LEU 594.A N LEU 583.A O no hydrogen 2.961 N/A THR 596.A OG1 VAL 581.A O no hydrogen 3.003 N/A ARG 597.A N ASN 2.A O no hydrogen 3.202 N/A ARG 597.A NH2 ASP 4.A OD1 no hydrogen 3.160 N/A GLY 603.A N TYR 638.A O no hydrogen 2.893 N/A SER 605.A N CYS 636.A O no hydrogen 3.279 N/A GLN 607.A N ASN 634.A O no hydrogen 3.150 N/A CYS 620.A SG GLU 619.A O no hydrogen 2.735 N/A SER 626.A OG SER 702.A OG no hydrogen 3.383 N/A VAL 631.A N LEU 698.A O no hydrogen 3.081 N/A GLN 632.A NE2 ASN 697.A OD1 no hydrogen 3.435 N/A SER 633.A N PHE 696.A O no hydrogen 3.256 N/A SER 633.A OG GLN 607.A O no hydrogen 3.557 N/A ASN 634.A N GLN 607.A O no hydrogen 2.970 N/A ILE 635.A N GLU 694.A O no hydrogen 3.265 N/A CYS 636.A N SER 605.A O no hydrogen 3.038 N/A CYS 636.A SG ASN 634.A OD1 no hydrogen 3.353 N/A LEU 637.A N HIS 692.A O no hydrogen 3.116 N/A TYR 638.A N GLY 603.A O no hydrogen 3.231 N/A ARG 642.A NH1 ASP 640.A O no hydrogen 3.270 N/A LYS 644.A NZ VAL 599.A O no hydrogen 3.067 N/A LEU 646.A N ARG 642.A O no hydrogen 3.311 N/A ARG 650.A NH2 ASN 645.A OD1 no hydrogen 3.271 N/A ASP 651.A N SER 649.A O no hydrogen 2.870 N/A SER 654.A OG LEU 652.A O no hydrogen 3.350 N/A VAL 656.A N ARG 685.A O no hydrogen 3.153 N/A LEU 658.A N ARG 683.A O no hydrogen 3.378 N/A ASP 659.A N ASN 716.A O no hydrogen 2.872 N/A LEU 660.A N LEU 681.A O no hydrogen 3.081 N/A ALA 661.A N ARG 714.A O no hydrogen 3.099 N/A LEU 662.A N ARG 679.A O no hydrogen 3.267 N/A ASP 663.A N THR 712.A O no hydrogen 3.164 N/A ARG 666.A NH2 ASP 706.A OD2 no hydrogen 3.175 N/A ARG 670.A NH1 THR 709.A O no hydrogen 3.048 N/A PHE 673.A N ASN 678.A O no hydrogen 2.969 N/A GLN 674.A N ASN 697.A O no hydrogen 3.052 N/A LYS 677.A N PHE 673.A O no hydrogen 2.807 N/A ARG 679.A NE LEU 662.A O no hydrogen 3.250 N/A ARG 679.A NH2 LEU 662.A O no hydrogen 3.467 N/A ARG 679.A NH2 ASP 663.A O no hydrogen 2.847 N/A ARG 679.A NH2 ARG 666.A O no hydrogen 3.328 N/A LEU 681.A N LEU 660.A O no hydrogen 3.080 N/A SER 682.A OG LEU 658.A O no hydrogen 2.821 N/A SER 682.A OG ASP 659.A OD1 no hydrogen 2.821 N/A ARG 683.A N LEU 658.A O no hydrogen 3.370 N/A ARG 685.A N VAL 656.A O no hydrogen 3.116 N/A LEU 687.A N SER 654.A O no hydrogen 3.283 N/A HIS 692.A N LEU 637.A O no hydrogen 2.903 N/A GLU 694.A N ILE 635.A O no hydrogen 3.058 N/A PHE 696.A N SER 633.A O no hydrogen 2.952 N/A ASN 697.A ND2 GLN 674.A OE1 no hydrogen 3.485 N/A LEU 698.A N VAL 631.A O no hydrogen 2.866 N/A LEU 699.A N THR 672.A O no hydrogen 2.914 N/A LEU 700.A N THR 629.A O no hydrogen 3.107 N/A SER 702.A OG SER 626.A OG no hydrogen 3.383 N/A CYS 703.A SG SER 702.A OG no hydrogen 3.406 N/A THR 709.A N ASP 706.A OD1 no hydrogen 3.241 N/A THR 709.A OG1 ASP 706.A OD2 no hydrogen 2.622 N/A ILE 711.A N LEU 746.A O no hydrogen 3.145 N/A THR 712.A N ASP 663.A OD1 no hydrogen 3.043 N/A THR 712.A OG1 ASP 663.A OD1 no hydrogen 3.497 N/A LEU 713.A N ALA 744.A O no hydrogen 3.149 N/A ARG 714.A N ALA 661.A O no hydrogen 3.370 N/A LEU 715.A N PHE 742.A O no hydrogen 3.090 N/A ASN 716.A N ASP 659.A O no hydrogen 3.003 N/A THR 718.A OG1 THR 657.A OG1 no hydrogen 2.840 N/A LYS 722.A N VAL 720.A O no hydrogen 2.928 N/A LYS 722.A NZ PRO 732.A O no hydrogen 3.015 N/A MET 733.A N PRO 598.A O no hydrogen 3.119 N/A ALA 738.A N ALA 736.A O no hydrogen 2.749 N/A ALA 744.A N LEU 713.A O no hydrogen 3.088 N/A LEU 746.A N ILE 711.A O no hydrogen 3.148 N/A GLU 749.A N ILE 613.A O no hydrogen 3.151 N/A HIS 756.A NE2 GLU 793.A OE1 no hydrogen 2.765 N/A CYS 758.A SG LYS 750.A O no hydrogen 3.585 N/A SER 765.A N MET 787.A O no hydrogen 3.238 N/A SER 767.A N GLU 785.A O no hydrogen 3.099 N/A LEU 771.A N PHE 768.A O no hydrogen 3.385 N/A LEU 775.A N ASN 779.A OD1 no hydrogen 3.380 N/A VAL 776.A N LYS 902.A O no hydrogen 3.157 N/A SER 778.A OG LEU 1063.A O no hydrogen 2.478 N/A ALA 784.A N ALA 861.A O no hydrogen 3.207 N/A GLU 785.A N SER 767.A O no hydrogen 3.064 N/A VAL 786.A N PHE 859.A O no hydrogen 3.282 N/A MET 787.A N SER 765.A O no hydrogen 2.807 N/A TRP 789.A N GLY 763.A O no hydrogen 3.137 N/A GLU 793.A N GLN 759.A O no hydrogen 2.788 N/A SER 795.A N PHE 851.A O no hydrogen 3.299 N/A THR 798.A OG1 SER 882.A O no hydrogen 3.193 N/A THR 799.A N SER 882.A O no hydrogen 3.063 N/A ILE 800.A N CYS 844.A O no hydrogen 3.037 N/A THR 801.A N ASN 880.A O no hydrogen 3.028 N/A PHE 802.A N THR 842.A O no hydrogen 3.242 N/A SER 803.A N THR 878.A O no hydrogen 3.366 N/A SER 803.A OG THR 878.A OG1 no hydrogen 2.920 N/A HIS 804.A N TRP 840.A O no hydrogen 3.223 N/A HIS 804.A ND1 PRO 805.A O no hydrogen 3.047 N/A SER 809.A N ASP 864.A O no hydrogen 3.322 N/A ARG 811.A N THR 862.A O no hydrogen 3.138 N/A ARG 811.A NH2 GLU 781.A OE1 no hydrogen 2.962 N/A ARG 823.A NE LEU 825.A O no hydrogen 3.516 N/A ARG 823.A NH1 TYR 810.A OH no hydrogen 3.094 N/A ARG 823.A NH2 TYR 810.A OH no hydrogen 2.929 N/A SER 824.A OG LEU 822.A O no hydrogen 3.164 N/A THR 828.A N ARG 845.A O no hydrogen 3.243 N/A ASP 830.A N SER 843.A O no hydrogen 2.954 N/A TRP 840.A N HIS 804.A O no hydrogen 3.117 N/A SER 841.A N ALA 832.A O no hydrogen 3.066 N/A SER 841.A OG PHE 802.A O no hydrogen 3.248 N/A THR 842.A N PHE 802.A O no hydrogen 3.182 N/A THR 842.A OG1 HIS 804.A NE2 no hydrogen 3.239 N/A SER 843.A N ASP 830.A O no hydrogen 3.312 N/A SER 843.A OG ASP 830.A O no hydrogen 3.401 N/A CYS 844.A SG SER 843.A O no hydrogen 3.049 N/A ARG 845.A N THR 828.A O no hydrogen 3.049 N/A ILE 846.A N THR 798.A O no hydrogen 3.138 N/A PHE 851.A N SER 795.A O no hydrogen 3.206 N/A GLY 853.A N ASP 794.A OD1 no hydrogen 3.158 N/A ALA 855.A N ARG 852.A O no hydrogen 3.312 N/A ILE 857.A N VAL 788.A O no hydrogen 3.261 N/A PHE 859.A N VAL 786.A O no hydrogen 3.188 N/A ALA 861.A N ALA 784.A O no hydrogen 3.159 N/A THR 862.A OG1 ASN 783.A OD1 no hydrogen 3.041 N/A PHE 863.A N LEU 782.A O no hydrogen 3.116 N/A VAL 865.A N LEU 780.A O no hydrogen 2.904 N/A SER 866.A N GLY 807.A O no hydrogen 3.218 N/A LEU 875.A N LEU 899.A O no hydrogen 3.102 N/A LEU 877.A N LEU 897.A O no hydrogen 3.273 N/A THR 878.A N SER 803.A O no hydrogen 3.327 N/A THR 878.A N SER 803.A OG no hydrogen 3.276 N/A THR 878.A OG1 SER 803.A OG no hydrogen 2.920 N/A SER 882.A N THR 799.A O no hydrogen 3.352 N/A SER 882.A OG SER 883.A O no hydrogen 3.290 N/A SER 883.A OG ASP 760.A OD2 no hydrogen 3.152 N/A SER 883.A OG ASN 886.A O no hydrogen 3.518 N/A ASN 886.A N SER 883.A O no hydrogen 3.251 N/A LYS 892.A NZ THR 887.A OG1 no hydrogen 3.187 N/A LYS 892.A NZ ARG 889.A O no hydrogen 3.402 N/A LEU 897.A N LEU 877.A O no hydrogen 3.249 N/A LEU 899.A N LEU 875.A O no hydrogen 3.114 N/A VAL 901.A N ASP 873.A O no hydrogen 3.173 N/A LYS 902.A N LEU 774.A O no hydrogen 3.339 N/A LYS 902.A NZ THR 1057.A O no hydrogen 3.343 N/A TYR 903.A OH GLY 872.A O no hydrogen 3.321 N/A ALA 904.A N VAL 776.A O no hydrogen 2.934 N/A THR 907.A N GLN 1062.A OE1 no hydrogen 2.855 N/A VAL 908.A N ASN 939.A O no hydrogen 3.029 N/A VAL 909.A N PHE 1069.A O no hydrogen 2.639 N/A SER 910.A N GLN 937.A O no hydrogen 2.831 N/A SER 911.A OG GLN 1073.A O no hydrogen 3.469 N/A SER 911.A OG THR 1074.A OG1 no hydrogen 2.637 N/A LYS 917.A N PHE 915.A O no hydrogen 3.162 N/A SER 922.A OG SER 922.A O no hydrogen 2.676 N/A SER 924.A OG GLU 925.A OE1 no hydrogen 2.609 N/A MET 933.A N THR 916.A OG1 no hydrogen 2.997 N/A HIS 934.A N LEU 1028.A O no hydrogen 3.121 N/A TYR 936.A N PHE 1026.A O no hydrogen 3.251 N/A TYR 936.A OH SER 1049.A OG no hydrogen 3.135 N/A GLN 937.A N SER 910.A O no hydrogen 3.100 N/A ASN 939.A N VAL 908.A O no hydrogen 3.042 N/A ASN 940.A ND2 PHE 1018.A O no hydrogen 3.389 N/A ARG 944.A NH2 ALA 904.A O no hydrogen 3.093 N/A SER 949.A N THR 1054.A O no hydrogen 3.101 N/A SER 949.A OG ASP 1014.A OD1 no hydrogen 2.706 N/A ILE 950.A N CYS 1013.A O no hydrogen 3.002 N/A ASN 951.A N GLU 1052.A O no hydrogen 2.872 N/A ASN 951.A ND2 PHE 1011.A O no hydrogen 3.540 N/A VAL 954.A N LEU 1009.A O no hydrogen 3.110 N/A VAL 956.A N GLY 1007.A O no hydrogen 3.098 N/A ASN 959.A ND2 GLN 1039.A OE1 no hydrogen 3.521 N/A GLU 961.A N LEU 958.A O no hydrogen 3.224 N/A VAL 963.A N VAL 956.A O no hydrogen 2.782 N/A MET 965.A N ASN 1031.A O no hydrogen 3.163 N/A GLU 968.A N LYS 1029.A O no hydrogen 3.269 N/A ASN 974.A ND2 PRO 972.A O no hydrogen 3.325 N/A SER 980.A N ARG 1012.A O no hydrogen 3.090 N/A GLU 982.A N ARG 1010.A O no hydrogen 3.171 N/A HIS 994.A N ASP 990.A O no hydrogen 3.245 N/A ILE 995.A N PHE 991.A O no hydrogen 3.340 N/A GLN 996.A N ALA 993.A O no hydrogen 3.166 N/A LYS 997.A N ALA 993.A O no hydrogen 3.286 N/A SER 1004.A OG ASP 1002.A OD1 no hydrogen 2.650 N/A ILE 1005.A N ASP 1002.A O no hydrogen 3.420 N/A ARG 1010.A N GLU 982.A O no hydrogen 2.961 N/A ARG 1012.A N SER 980.A O no hydrogen 3.257 N/A CYS 1013.A N ILE 950.A O no hydrogen 3.228 N/A PHE 1018.A N LEU 946.A O no hydrogen 3.203 N/A SER 1019.A N SER 1017.A O no hydrogen 2.789 N/A SER 1019.A OG VAL 1020.A O no hydrogen 3.542 N/A VAL 1020.A N ASP 945.A OD1 no hydrogen 3.368 N/A GLN 1021.A N ASN 940.A O no hydrogen 3.134 N/A GLU 1022.A N SER 1019.A O no hydrogen 3.147 N/A PHE 1026.A N TYR 936.A O no hydrogen 3.261 N/A THR 1027.A N SER 970.A O no hydrogen 3.174 N/A THR 1027.A OG1 HIS 934.A O no hydrogen 3.195 N/A LEU 1028.A N HIS 934.A O no hydrogen 3.231 N/A LYS 1029.A N GLU 968.A O no hydrogen 3.147 N/A SER 1033.A N VAL 963.A O no hydrogen 3.052 N/A GLY 1035.A N SER 1033.A OG no hydrogen 3.187 N/A VAL 1037.A N PHE 1034.A O no hydrogen 3.307 N/A ARG 1038.A N GLY 1035.A O no hydrogen 3.410 N/A GLN 1039.A N TRP 1036.A O no hydrogen 2.998 N/A LEU 1041.A N ARG 1038.A O no hydrogen 3.044 N/A SER 1046.A N PRO 999.A O no hydrogen 3.419 N/A VAL 1048.A N LEU 1001.A O no hydrogen 3.396 N/A SER 1049.A N THR 1074.A O no hydrogen 3.104 N/A SER 1049.A OG TYR 936.A OH no hydrogen 3.135 N/A VAL 1050.A N TRP 953.A O no hydrogen 3.224 N/A ALA 1051.A N ALA 1072.A O no hydrogen 3.220 N/A GLU 1052.A N ASN 951.A O no hydrogen 3.148 N/A ILE 1053.A N MET 1070.A O no hydrogen 3.104 N/A THR 1054.A N SER 949.A O no hydrogen 3.038 N/A THR 1054.A OG1 SER 949.A O no hydrogen 2.756 N/A THR 1054.A OG1 ASN 951.A OD1 no hydrogen 3.511 N/A SER 1058.A N ASP 1056.A OD1 no hydrogen 3.176 N/A SER 1061.A N TYR 903.A O no hydrogen 3.155 N/A ALA 1072.A N ALA 1051.A O no hydrogen 2.922 N/A THR 1074.A N SER 1049.A O no hydrogen 3.171 N/A THR 1074.A OG1 SER 911.A OG no hydrogen 2.637 N/A THR 1074.A OG1 TYR 936.A OH no hydrogen 3.021 N/A THR 1076.A N VAL 1047.A O no hydrogen 2.949 N/A THR 1076.A OG1 THR 916.A O no hydrogen 2.832 N/A LEU 1078.A N VAL 1045.A O no hydrogen 2.887 N/A LYS 1080.A NZ SER 922.A O no hydrogen 3.548 N/A