Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jb9_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 6.A N GLU 6.A OE1 no hydrogen 2.843 N/A ASP 7.A N LEU 4.A O no hydrogen 2.689 N/A LYS 8.A N LEU 4.A O no hydrogen 3.215 N/A GLU 15.A N SER 13.A OG no hydrogen 3.156 N/A TYR 18.A N GLU 15.A O no hydrogen 2.416 N/A SER 20.A OG TYR 18.A O no hydrogen 3.093 N/A SER 20.A OG ASN 21.A OD1 no hydrogen 2.564 N/A GLU 28.A N GLU 28.A OE1 no hydrogen 2.699 N/A GLN 36.A N PRO 33.A O no hydrogen 2.985 N/A ARG 43.A NH1 ARG 43.A O no hydrogen 2.741 N/A ARG 43.A NH2 GLU 597.A OE1 no hydrogen 3.539 N/A ILE 47.A N VAL 432.A O no hydrogen 3.255 N/A ILE 49.A N THR 115.A O no hydrogen 3.100 N/A THR 51.A N ARG 483.A O no hydrogen 3.353 N/A THR 57.A OG1 THR 98.A O no hydrogen 2.628 N/A PHE 65.A N LYS 61.A O no hydrogen 3.265 N/A GLY 66.A N GLU 62.A O no hydrogen 2.688 N/A LEU 67.A N PHE 63.A O no hydrogen 3.089 N/A LEU 68.A N LEU 64.A O no hydrogen 3.051 N/A THR 69.A N PHE 65.A O no hydrogen 2.739 N/A THR 69.A OG1 PHE 65.A O no hydrogen 3.021 N/A GLY 70.A N GLY 66.A O no hydrogen 2.597 N/A THR 71.A N LEU 67.A O no hydrogen 3.416 N/A ARG 75.A NE ASP 73.A O no hydrogen 3.541 N/A ARG 75.A NH1 ILE 383.A O no hydrogen 3.157 N/A SER 76.A OG ASP 168.A OD1 no hydrogen 2.897 N/A ILE 78.A N GLY 169.A O no hydrogen 3.276 N/A VAL 79.A N ILE 148.A O no hydrogen 3.114 N/A ALA 80.A N VAL 171.A O no hydrogen 2.968 N/A HIS 82.A NE2 GLN 845.A OE1 no hydrogen 3.271 N/A SER 88.A OG SER 125.A OG no hydrogen 2.881 N/A LEU 90.A N LYS 87.A O no hydrogen 2.816 N/A LEU 91.A N LYS 87.A O no hydrogen 3.416 N/A ASP 92.A N SER 88.A O no hydrogen 3.250 N/A LEU 93.A N ALA 89.A O no hydrogen 3.277 N/A VAL 95.A N LEU 91.A O no hydrogen 2.903 N/A TYR 96.A N ASP 92.A O no hydrogen 2.912 N/A TYR 97.A N LEU 94.A O no hydrogen 2.820 N/A TYR 97.A OH GLY 370.A O no hydrogen 3.037 N/A THR 98.A N LEU 94.A O no hydrogen 3.255 N/A THR 98.A N VAL 95.A O no hydrogen 2.783 N/A THR 98.A OG1 LEU 94.A O no hydrogen 3.425 N/A THR 98.A OG1 VAL 95.A O no hydrogen 2.736 N/A HIS 99.A N VAL 95.A O no hydrogen 2.786 N/A SER 109.A OG ARG 108.A O no hydrogen 2.559 N/A SER 109.A OG LEU 110.A O no hydrogen 3.117 N/A LEU 110.A N ARG 108.A O no hydrogen 2.706 N/A ARG 111.A NH1 SER 109.A OG no hydrogen 3.132 N/A THR 113.A OG1 TYR 112.A O no hydrogen 2.218 N/A THR 113.A OG1 ASP 149.A OD2 no hydrogen 2.685 N/A THR 115.A OG1 ASP 114.A O no hydrogen 2.262 N/A HIS 116.A N ASP 114.A O no hydrogen 2.580 N/A TYR 117.A N ILE 47.A O no hydrogen 3.138 N/A ARG 120.A N TYR 117.A O no hydrogen 3.203 N/A GLU 121.A N TYR 117.A O no hydrogen 2.970 N/A ARG 122.A N LEU 118.A O no hydrogen 3.246 N/A ARG 122.A NH2 ASP 585.A OD2 no hydrogen 2.720 N/A SER 125.A OG SER 88.A OG no hydrogen 2.881 N/A SER 125.A OG ASP 114.A OD1 no hydrogen 2.686 N/A LYS 127.A NZ ASP 590.A OD2 no hydrogen 3.007 N/A SER 128.A OG GLU 159.A O no hydrogen 3.503 N/A LEU 131.A N CYS 147.A O no hydrogen 2.896 N/A LEU 133.A N PHE 145.A O no hydrogen 3.400 N/A VAL 135.A N PHE 143.A O no hydrogen 2.964 N/A MET 138.A N ASP 137.A OD1 no hydrogen 2.680 N/A LYS 141.A NZ ASP 73.A OD1 no hydrogen 2.753 N/A PHE 143.A N VAL 135.A O no hydrogen 2.933 N/A PHE 145.A N LEU 133.A O no hydrogen 3.148 N/A ASP 149.A N THR 129.A O no hydrogen 3.228 N/A THR 150.A N VAL 79.A O no hydrogen 3.270 N/A THR 150.A OG1 VAL 79.A O no hydrogen 2.476 N/A PHE 156.A N HIS 153.A O no hydrogen 3.409 N/A ASP 158.A N ASP 158.A OD1 no hydrogen 2.337 N/A GLU 159.A N PHE 156.A O no hydrogen 2.765 N/A VAL 160.A N VAL 157.A O no hydrogen 3.067 N/A ALA 161.A N VAL 157.A O no hydrogen 3.098 N/A ALA 162.A N ASP 158.A O no hydrogen 3.142 N/A MET 164.A N VAL 160.A O no hydrogen 3.405 N/A ALA 165.A N ALA 161.A O no hydrogen 3.387 N/A ILE 166.A N PRO 163.A O no hydrogen 2.816 N/A SER 167.A N PRO 163.A O no hydrogen 2.796 N/A SER 167.A OG PRO 163.A O no hydrogen 3.275 N/A SER 167.A OG GLY 169.A O no hydrogen 3.539 N/A VAL 170.A N PRO 197.A O no hydrogen 3.235 N/A VAL 171.A N ILE 78.A O no hydrogen 2.731 N/A LEU 172.A N VAL 199.A O no hydrogen 2.830 N/A VAL 173.A N ALA 80.A O no hydrogen 2.780 N/A VAL 174.A N VAL 201.A O no hydrogen 3.138 N/A VAL 176.A N ASN 203.A O no hydrogen 3.157 N/A GLY 179.A N ASP 175.A O no hydrogen 2.674 N/A THR 184.A OG1 MET 181.A O no hydrogen 3.005 N/A THR 185.A N ILE 182.A O no hydrogen 2.648 N/A THR 185.A OG1 ILE 182.A O no hydrogen 2.732 N/A ARG 186.A N ILE 182.A O no hydrogen 3.090 N/A ARG 186.A NE ASN 183.A OD1 no hydrogen 3.164 N/A ARG 186.A NH1 SER 531.A OG no hydrogen 2.409 N/A ILE 187.A N ASN 183.A O no hydrogen 2.971 N/A ILE 188.A N THR 184.A O no hydrogen 2.927 N/A LYS 189.A N THR 185.A O no hydrogen 2.834 N/A LYS 189.A NZ GLN 236.A OE1 no hydrogen 2.663 N/A ALA 191.A N ILE 187.A O no hydrogen 2.593 N/A ALA 191.A N ILE 188.A O no hydrogen 3.153 N/A ILE 192.A N ILE 188.A O no hydrogen 3.072 N/A ILE 192.A N LYS 189.A O no hydrogen 3.241 N/A LEU 193.A N LYS 189.A O no hydrogen 3.370 N/A ASP 195.A N ILE 192.A O no hydrogen 2.826 N/A MET 196.A N ALA 191.A O no hydrogen 3.064 N/A VAL 199.A N VAL 170.A O no hydrogen 3.130 N/A VAL 201.A N LEU 172.A O no hydrogen 2.923 N/A ASN 203.A N VAL 174.A O no hydrogen 2.708 N/A ASN 203.A ND2 HIS 85.A O no hydrogen 2.876 N/A LYS 204.A N ALA 255.A O no hydrogen 3.074 N/A LYS 204.A NZ HIS 84.A O no hydrogen 2.904 N/A LYS 204.A NZ ASP 175.A OD2 no hydrogen 3.143 N/A ARG 207.A NE GLU 211.A OE2 no hydrogen 2.631 N/A LEU 208.A N VAL 205.A O no hydrogen 2.803 N/A ILE 209.A N ASP 206.A O no hydrogen 3.037 N/A LEU 210.A N ASP 206.A O no hydrogen 3.185 N/A LEU 210.A N ARG 207.A O no hydrogen 3.074 N/A GLU 211.A N ARG 207.A O no hydrogen 2.630 N/A LEU 214.A N LEU 208.A O no hydrogen 3.449 N/A ALA 219.A N PRO 215.A O no hydrogen 3.002 N/A TYR 220.A N PRO 216.A O no hydrogen 3.142 N/A LYS 222.A N ASP 218.A O no hydrogen 3.353 N/A LEU 223.A N ALA 219.A O no hydrogen 2.813 N/A ARG 224.A N TYR 220.A O no hydrogen 2.850 N/A HIS 225.A N HIS 221.A O no hydrogen 2.866 N/A VAL 226.A N LEU 223.A O no hydrogen 2.722 N/A ILE 227.A N LEU 223.A O no hydrogen 3.265 N/A ASP 228.A N ARG 224.A O no hydrogen 3.007 N/A GLU 229.A N HIS 225.A O no hydrogen 3.098 N/A VAL 230.A N VAL 226.A O no hydrogen 3.137 N/A ASN 231.A N ILE 227.A O no hydrogen 3.409 N/A ASN 231.A ND2 VAL 245.A O no hydrogen 3.133 N/A ASP 232.A N ASP 228.A O no hydrogen 3.027 N/A ASN 233.A N VAL 230.A O no hydrogen 3.038 N/A ILE 234.A N VAL 230.A O no hydrogen 3.291 N/A CYS 235.A N ASN 231.A O no hydrogen 2.673 N/A CYS 235.A SG ASN 231.A O no hydrogen 3.694 N/A ILE 237.A N ILE 234.A O no hydrogen 2.952 N/A SER 238.A N ILE 234.A O no hydrogen 2.868 N/A LYS 242.A N ASP 240.A OD1 no hydrogen 3.249 N/A VAL 245.A N ASN 231.A OD1 no hydrogen 3.140 N/A LEU 249.A N SER 246.A O no hydrogen 3.088 N/A GLY 250.A N SER 246.A O no hydrogen 3.237 N/A CYS 253.A SG PHE 263.A O no hydrogen 3.675 N/A PHE 254.A N PHE 263.A O no hydrogen 2.984 N/A ALA 255.A N LEU 202.A O no hydrogen 2.944 N/A SER 256.A N TYR 261.A O no hydrogen 3.032 N/A CYS 257.A N ASN 203.A OD1 no hydrogen 3.313 N/A CYS 257.A SG ASN 203.A OD1 no hydrogen 3.183 N/A GLY 260.A N SER 256.A O no hydrogen 3.152 N/A TYR 261.A N SER 256.A O no hydrogen 3.428 N/A TYR 261.A OH HIS 326.A NE2 no hydrogen 3.216 N/A PHE 263.A N PHE 254.A O no hydrogen 2.909 N/A THR 264.A OG1 SER 267.A OG no hydrogen 3.114 N/A SER 267.A N THR 264.A OG1 no hydrogen 3.384 N/A SER 267.A OG THR 264.A OG1 no hydrogen 3.114 N/A PHE 268.A N THR 264.A O no hydrogen 3.153 N/A ALA 269.A N LEU 265.A O no hydrogen 3.115 N/A LYS 270.A N SER 266.A O no hydrogen 3.154 N/A LEU 271.A N SER 267.A O no hydrogen 3.368 N/A TYR 272.A OH PHE 317.A O no hydrogen 2.649 N/A ILE 273.A N ALA 269.A O no hydrogen 3.025 N/A ASP 274.A N LYS 270.A O no hydrogen 2.681 N/A ARG 275.A N TYR 272.A O no hydrogen 3.030 N/A HIS 276.A N ILE 273.A O no hydrogen 3.223 N/A SER 285.A N VAL 281.A O no hydrogen 3.028 N/A SER 285.A OG VAL 281.A O no hydrogen 2.703 N/A SER 285.A OG ASP 282.A O no hydrogen 3.243 N/A LYS 286.A N ASP 282.A O no hydrogen 3.335 N/A ARG 287.A N PHE 284.A O no hydrogen 3.037 N/A ARG 287.A NH1 LEU 283.A O no hydrogen 2.624 N/A TYR 293.A N ALA 302.A O no hydrogen 2.892 N/A ASP 295.A N LYS 300.A O no hydrogen 3.331 N/A ARG 299.A N ASP 295.A O no hydrogen 2.851 N/A ALA 302.A N TYR 293.A O no hydrogen 3.236 N/A SER 313.A N ILE 292.A O no hydrogen 3.339 N/A SER 313.A OG ARG 287.A O no hydrogen 2.803 N/A HIS 316.A N ARG 312.A O no hydrogen 3.206 N/A HIS 316.A N SER 313.A O no hydrogen 3.194 N/A PHE 317.A N SER 313.A O no hydrogen 3.013 N/A PHE 317.A N PHE 314.A O no hydrogen 3.139 N/A ILE 318.A N PHE 314.A O no hydrogen 2.900 N/A GLU 320.A N VAL 315.A O no hydrogen 3.215 N/A LEU 322.A N LEU 319.A O no hydrogen 2.585 N/A TYR 323.A N LEU 319.A O no hydrogen 2.744 N/A TYR 323.A OH LEU 214.A O no hydrogen 2.662 N/A LYS 324.A N GLU 320.A O no hydrogen 3.334 N/A THR 327.A N LYS 324.A O no hydrogen 2.763 N/A THR 327.A OG1 TYR 323.A O no hydrogen 2.737 N/A THR 327.A OG1 LYS 324.A O no hydrogen 2.781 N/A LEU 328.A N LYS 324.A O no hydrogen 2.464 N/A THR 329.A N LEU 325.A O no hydrogen 3.112 N/A THR 329.A OG1 LEU 325.A O no hydrogen 3.546 N/A SER 331.A N THR 327.A O no hydrogen 3.321 N/A SER 331.A OG THR 327.A O no hydrogen 2.712 N/A ASP 332.A N THR 329.A O no hydrogen 3.426 N/A LEU 337.A N GLU 333.A O no hydrogen 3.324 N/A HIS 340.A N LYS 336.A O no hydrogen 3.051 N/A LEU 341.A N LEU 337.A O no hydrogen 2.751 N/A SER 342.A N LYS 338.A O no hydrogen 3.012 N/A SER 343.A N HIS 340.A O no hydrogen 2.944 N/A GLN 345.A N SER 342.A O no hydrogen 3.103 N/A ILE 346.A N LEU 341.A O no hydrogen 2.884 N/A ASP 352.A N LYS 349.A O no hydrogen 2.974 N/A LYS 358.A NZ ASP 258.A OD2 no hydrogen 3.144 N/A LEU 360.A N ASP 356.A O no hydrogen 2.624 N/A LEU 360.A N PRO 357.A O no hydrogen 3.079 N/A LEU 361.A N PRO 357.A O no hydrogen 2.836 N/A GLN 362.A N LYS 358.A O no hydrogen 2.854 N/A ILE 364.A N LEU 360.A O no hydrogen 2.749 N/A CYS 365.A N LEU 361.A O no hydrogen 2.656 N/A ALA 366.A N GLN 362.A O no hydrogen 2.976 N/A SER 367.A N ILE 364.A O no hydrogen 2.749 N/A VAL 373.A N PHE 371.A O no hydrogen 2.665 N/A ASN 377.A N VAL 373.A O no hydrogen 2.952 N/A ALA 378.A N GLY 374.A O no hydrogen 2.709 N/A VAL 379.A N VAL 376.A O no hydrogen 2.821 N/A THR 380.A N VAL 376.A O no hydrogen 3.020 N/A THR 380.A OG1 VAL 376.A O no hydrogen 3.381 N/A HIS 382.A N VAL 379.A O no hydrogen 3.216 N/A ILE 383.A N VAL 379.A O no hydrogen 2.854 N/A SER 385.A N GLU 388.A OE1 no hydrogen 3.101 N/A ASN 389.A N SER 385.A O no hydrogen 3.258 N/A ALA 390.A N PRO 386.A O no hydrogen 3.175 N/A ALA 390.A N ARG 387.A O no hydrogen 3.041 N/A LYS 393.A N ASN 389.A O no hydrogen 2.753 N/A LYS 393.A NZ MET 164.A O no hydrogen 3.281 N/A LYS 393.A NZ SER 167.A O no hydrogen 3.368 N/A ALA 394.A N ALA 390.A O no hydrogen 2.885 N/A SER 395.A N ARG 392.A O no hydrogen 3.194 N/A SER 397.A OG LYS 393.A O no hydrogen 2.581 N/A TYR 398.A N ALA 394.A O no hydrogen 3.023 N/A ILE 399.A N ILE 523.A O no hydrogen 3.424 N/A SER 404.A OG PRO 401.A O no hydrogen 2.867 N/A GLY 407.A N SER 404.A OG no hydrogen 3.420 N/A LYS 408.A N SER 404.A O no hydrogen 3.056 N/A ALA 409.A N SER 405.A O no hydrogen 2.989 N/A ILE 410.A N ILE 406.A O no hydrogen 3.035 N/A GLU 412.A N LYS 408.A O no hydrogen 3.330 N/A MET 413.A N ILE 410.A O no hydrogen 3.223 N/A SER 414.A N ALA 409.A O no hydrogen 3.471 N/A SER 414.A OG ALA 409.A O no hydrogen 3.104 N/A ARG 415.A NH2 ALA 493.A O no hydrogen 3.138 N/A MET 423.A N ILE 512.A O no hydrogen 3.187 N/A THR 426.A N PHE 440.A O no hydrogen 3.277 N/A LYS 427.A NZ GLU 159.A OE2 no hydrogen 3.252 N/A TYR 429.A N TYR 438.A O no hydrogen 3.058 N/A ASN 430.A ND2 TYR 595.A OH no hydrogen 2.589 N/A VAL 432.A N THR 431.A OG1 no hydrogen 2.751 N/A TYR 438.A N TYR 429.A O no hydrogen 3.042 N/A ALA 439.A N LEU 499.A O no hydrogen 3.147 N/A PHE 440.A N LYS 427.A O no hydrogen 3.095 N/A ARG 442.A NH1 ILE 166.A O no hydrogen 2.974 N/A ARG 442.A NH2 ASP 168.A OD2 no hydrogen 3.549 N/A VAL 443.A N MET 495.A O no hydrogen 3.170 N/A TYR 444.A N VAL 422.A O no hydrogen 2.664 N/A SER 445.A OG PRO 420.A O no hydrogen 2.594 N/A GLY 446.A N SER 414.A O no hydrogen 2.617 N/A LYS 449.A NZ GLU 417.A OE1 no hydrogen 2.925 N/A GLY 451.A N ILE 474.A O no hydrogen 2.858 N/A VAL 456.A N VAL 470.A O no hydrogen 2.805 N/A LEU 457.A N THR 511.A O no hydrogen 2.894 N/A SER 462.A OG GLU 464.A OE1 no hydrogen 2.967 N/A SER 462.A OG ASP 465.A OD1 no hydrogen 2.868 N/A VAL 470.A N VAL 456.A O no hydrogen 3.257 N/A ALA 472.A N VAL 454.A O no hydrogen 3.147 N/A ALA 475.A N GLY 500.A O no hydrogen 2.579 N/A GLU 476.A N GLY 500.A O no hydrogen 3.369 N/A CYS 478.A N LEU 498.A O no hydrogen 2.882 N/A CYS 478.A SG HIS 487.A ND1 no hydrogen 2.852 N/A VAL 479.A N LEU 486.A O no hydrogen 2.760 N/A CYS 481.A N TYR 484.A O no hydrogen 3.073 N/A CYS 481.A SG THR 132.A O no hydrogen 3.320 N/A CYS 481.A SG THR 132.A OG1 no hydrogen 3.746 N/A CYS 481.A SG PRO 480.A O no hydrogen 3.044 N/A CYS 481.A SG TYR 484.A OH no hydrogen 3.369 N/A ALA 482.A N PRO 130.A O no hydrogen 3.235 N/A TYR 484.A N CYS 481.A O no hydrogen 3.101 N/A LEU 486.A N VAL 479.A O no hydrogen 2.849 N/A VAL 488.A N ILE 477.A O no hydrogen 3.050 N/A ALA 491.A N VAL 448.A O no hydrogen 2.792 N/A GLY 494.A N VAL 443.A O no hydrogen 3.005 N/A LEU 496.A N GLN 146.A OE1 no hydrogen 3.066 N/A VAL 497.A N ALA 441.A O no hydrogen 3.264 N/A LEU 498.A N CYS 478.A O no hydrogen 2.792 N/A LEU 499.A N ALA 439.A O no hydrogen 3.016 N/A GLY 500.A N GLU 476.A O no hydrogen 2.536 N/A ILE 506.A N ASP 503.A O no hydrogen 2.706 N/A LYS 508.A NZ SER 564.A O no hydrogen 3.474 N/A ALA 510.A N VAL 425.A O no hydrogen 3.113 N/A THR 511.A OG1 MET 423.A O no hydrogen 3.237 N/A THR 511.A OG1 ILE 512.A O no hydrogen 3.009 N/A VAL 513.A N LYS 455.A O no hydrogen 3.054 N/A SER 514.A N LEU 421.A O no hydrogen 3.237 N/A SER 514.A OG ASN 516.A OD1 no hydrogen 3.134 N/A ARG 525.A N SER 397.A O no hydrogen 2.713 N/A ARG 525.A NH1 GLN 396.A O no hydrogen 3.415 N/A SER 531.A OG MET 530.A O no hydrogen 2.756 N/A PHE 535.A N SER 533.A O no hydrogen 2.892 N/A LYS 536.A N VAL 606.A O no hydrogen 2.847 N/A VAL 537.A N ILE 576.A O no hydrogen 3.010 N/A ALA 538.A N SER 603.A OG no hydrogen 2.849 N/A HIS 542.A N GLU 599.A O no hydrogen 3.426 N/A SER 545.A N ASN 543.A OD1 no hydrogen 3.171 N/A SER 545.A OG ASN 543.A OD1 no hydrogen 2.673 N/A GLU 546.A N ASN 543.A O no hydrogen 3.427 N/A LEU 551.A N LEU 547.A O no hydrogen 3.165 N/A ASP 552.A N PRO 548.A O no hydrogen 2.815 N/A GLY 553.A N LYS 549.A O no hydrogen 2.810 N/A LEU 554.A N LEU 550.A O no hydrogen 2.852 N/A ARG 555.A N LEU 551.A O no hydrogen 3.352 N/A LYS 556.A N ASP 552.A O no hydrogen 3.395 N/A THR 557.A N GLY 553.A O no hydrogen 3.109 N/A THR 557.A OG1 LEU 554.A O no hydrogen 2.718 N/A ASN 558.A N LEU 554.A O no hydrogen 3.517 N/A LYS 559.A N ARG 555.A O no hydrogen 3.299 N/A LYS 559.A NZ ILE 506.A O no hydrogen 3.160 N/A SER 560.A N LYS 556.A O no hydrogen 3.399 N/A SER 560.A OG TYR 595.A OH no hydrogen 2.527 N/A TYR 561.A OH ASP 590.A OD2 no hydrogen 2.589 N/A SER 564.A N TYR 561.A O no hydrogen 3.240 N/A SER 564.A OG ASN 558.A OD1 no hydrogen 3.316 N/A SER 564.A OG TYR 561.A O no hydrogen 2.665 N/A GLU 569.A N GLU 573.A O no hydrogen 3.279 N/A THR 575.A OG1 LYS 567.A O no hydrogen 3.145 N/A ILE 576.A N VAL 537.A O no hydrogen 2.858 N/A PHE 577.A N ILE 565.A O no hydrogen 3.213 N/A GLY 578.A N PHE 535.A O no hydrogen 3.172 N/A THR 579.A OG1 ASP 155.A O no hydrogen 2.690 N/A MET 584.A N GLY 580.A O no hydrogen 2.941 N/A ASP 585.A N GLU 581.A O no hydrogen 2.979 N/A CYS 586.A N MET 582.A O no hydrogen 3.411 N/A CYS 586.A N TYR 583.A O no hydrogen 3.138 N/A CYS 586.A SG MET 582.A O no hydrogen 3.299 N/A LEU 587.A N TYR 583.A O no hydrogen 3.319 N/A LEU 588.A N MET 584.A O no hydrogen 3.172 N/A ASP 590.A N CYS 586.A O no hydrogen 3.253 N/A LEU 591.A N LEU 587.A O no hydrogen 2.903 N/A ARG 592.A NE LEU 588.A O no hydrogen 2.968 N/A THR 593.A N TYR 589.A O no hydrogen 3.019 N/A THR 593.A N ASP 590.A O no hydrogen 3.159 N/A THR 593.A OG1 TYR 589.A O no hydrogen 2.509 N/A LEU 594.A N ASP 590.A O no hydrogen 2.634 N/A TYR 595.A N ASP 590.A O no hydrogen 3.034 N/A TYR 595.A OH SER 560.A OG no hydrogen 2.527 N/A SER 596.A OG LEU 591.A O no hydrogen 2.402 N/A ARG 601.A N GLU 540.A O no hydrogen 2.866 N/A SER 603.A N ALA 538.A O no hydrogen 3.120 N/A SER 603.A OG ASP 604.A O no hydrogen 3.561 N/A VAL 606.A N LYS 536.A O no hydrogen 3.114 N/A ARG 608.A N VAL 534.A O no hydrogen 3.164 N/A CYS 610.A N MET 775.A O no hydrogen 2.833 N/A CYS 610.A SG PHE 609.A O no hydrogen 3.527 N/A CYS 610.A SG THR 730.A OG1 no hydrogen 2.942 N/A GLU 611.A N THR 730.A O no hydrogen 3.119 N/A THR 612.A N ARG 773.A O no hydrogen 3.056 N/A THR 612.A OG1 ARG 773.A O no hydrogen 3.271 N/A VAL 614.A N SER 771.A O no hydrogen 3.282 N/A ASP 615.A N ALA 770.A O no hydrogen 3.446 N/A CYS 621.A SG PHE 622.A O no hydrogen 3.527 N/A CYS 621.A SG SER 765.A OG no hydrogen 3.008 N/A SER 623.A OG ILE 632.A O no hydrogen 2.505 N/A THR 625.A N ASN 630.A O no hydrogen 3.386 N/A LYS 628.A N THR 625.A O no hydrogen 3.171 N/A LYS 629.A N THR 625.A OG1 no hydrogen 3.311 N/A ARG 631.A N VAL 742.A O no hydrogen 3.437 N/A THR 633.A OG1 ASP 740.A O no hydrogen 3.559 N/A VAL 635.A N ARG 737.A O no hydrogen 3.181 N/A LEU 639.A N ASN 733.A O no hydrogen 2.958 N/A ILE 643.A N GLU 640.A O no hydrogen 3.200 N/A SER 644.A OG LYS 641.A O no hydrogen 3.232 N/A ASP 646.A N ILE 643.A O no hydrogen 2.908 N/A ASN 649.A N ASN 645.A O no hydrogen 3.242 N/A ASN 649.A ND2 ASN 645.A O no hydrogen 2.545 N/A GLY 650.A N ASP 646.A O no hydrogen 3.307 N/A GLY 650.A N ILE 647.A O no hydrogen 3.227 N/A LYS 651.A N ASP 646.A O no hydrogen 3.176 N/A ILE 661.A N PRO 657.A O no hydrogen 3.316 N/A SER 662.A N GLN 658.A O no hydrogen 3.079 N/A SER 662.A OG GLN 658.A O no hydrogen 3.053 N/A SER 662.A OG LYS 659.A O no hydrogen 2.989 N/A GLU 663.A N LYS 659.A O no hydrogen 3.348 N/A PHE 664.A N ILE 661.A O no hydrogen 3.165 N/A GLN 666.A N SER 662.A O no hydrogen 3.356 N/A GLN 666.A NE2 SER 676.A OG no hydrogen 2.627 N/A ASN 668.A N PHE 664.A O no hydrogen 3.234 N/A TYR 669.A N PHE 665.A O no hydrogen 2.983 N/A TYR 669.A OH GLY 642.A O no hydrogen 2.814 N/A TYR 669.A OH ASP 646.A OD2 no hydrogen 2.586 N/A SER 676.A N ASP 672.A O no hydrogen 3.006 N/A SER 676.A OG ASP 672.A O no hydrogen 2.860 N/A SER 676.A OG LEU 673.A O no hydrogen 2.729 N/A SER 678.A OG LEU 674.A O no hydrogen 2.995 N/A SER 678.A OG ALA 675.A O no hydrogen 2.778 N/A TRP 680.A N LEU 692.A O no hydrogen 3.268 N/A TRP 680.A NE1 ASP 694.A OD1 no hydrogen 2.732 N/A ASP 686.A N GLY 683.A O no hydrogen 3.381 N/A THR 689.A OG1 ASN 733.A OD1 no hydrogen 2.933 N/A ASN 690.A N GLY 688.A O no hydrogen 2.673 N/A ASN 690.A ND2 ILE 731.A O no hydrogen 3.207 N/A ILE 691.A N VAL 734.A O no hydrogen 3.244 N/A LEU 692.A N ALA 681.A O no hydrogen 3.410 N/A ASP 695.A N LEU 738.A O no hydrogen 2.996 N/A ASP 700.A N LEU 697.A O no hydrogen 2.818 N/A ASP 702.A N SER 698.A O no hydrogen 2.852 N/A ASN 707.A N LYS 703.A O no hydrogen 3.013 N/A SER 708.A OG VAL 705.A O no hydrogen 2.691 N/A VAL 709.A N LEU 706.A O no hydrogen 2.840 N/A GLN 715.A N GLU 711.A O no hydrogen 3.022 N/A GLY 716.A N ILE 713.A O no hydrogen 3.235 N/A PHE 717.A N LYS 714.A O no hydrogen 3.168 N/A GLN 718.A N LYS 714.A O no hydrogen 2.836 N/A THR 721.A N PHE 717.A O no hydrogen 2.754 N/A THR 721.A OG1 PHE 717.A O no hydrogen 2.662 N/A LEU 726.A N GLU 611.A OE1 no hydrogen 3.191 N/A CYS 727.A N GLU 611.A OE2 no hydrogen 3.439 N/A GLU 729.A N GLU 611.A OE2 no hydrogen 3.242 N/A ARG 732.A N GLU 611.A O no hydrogen 3.082 N/A ASN 733.A N THR 689.A OG1 no hydrogen 2.809 N/A VAL 734.A N ASN 690.A OD1 no hydrogen 2.884 N/A ASN 735.A N GLU 637.A O no hydrogen 3.102 N/A LEU 738.A N ARG 693.A O no hydrogen 2.728 N/A MET 739.A N THR 633.A O no hydrogen 2.946 N/A ASP 740.A N THR 633.A OG1 no hydrogen 2.986 N/A VAL 742.A N ARG 631.A O no hydrogen 3.252 N/A ARG 750.A NH2 ALA 744.A O no hydrogen 2.409 N/A ILE 755.A N GLY 751.A O no hydrogen 3.100 N/A ILE 756.A N GLY 752.A O no hydrogen 3.115 N/A THR 758.A N ILE 755.A O no hydrogen 3.107 N/A THR 758.A OG1 GLN 754.A O no hydrogen 3.316 N/A THR 758.A OG1 ILE 755.A O no hydrogen 2.734 N/A ALA 759.A N ILE 755.A O no hydrogen 2.653 N/A ARG 760.A N ILE 756.A O no hydrogen 3.079 N/A ARG 760.A NH1 TYR 764.A OH no hydrogen 3.463 N/A CYS 763.A N ARG 760.A O no hydrogen 3.297 N/A SER 765.A N ARG 761.A O no hydrogen 3.241 N/A SER 765.A OG ARG 761.A O no hydrogen 3.339 N/A SER 765.A OG VAL 762.A O no hydrogen 2.613 N/A SER 766.A N VAL 762.A O no hydrogen 3.266 N/A SER 766.A OG VAL 762.A O no hydrogen 3.025 N/A SER 766.A OG CYS 763.A O no hydrogen 2.877 N/A PHE 767.A N CYS 763.A O no hydrogen 3.238 N/A THR 769.A OG1 SER 765.A O no hydrogen 3.498 N/A THR 769.A OG1 SER 766.A O no hydrogen 2.992 N/A ALA 770.A N SER 766.A O no hydrogen 3.236 N/A ALA 770.A N PHE 767.A O no hydrogen 3.027 N/A SER 771.A OG ALA 770.A O no hydrogen 2.486 N/A SER 771.A OG SER 771.A O no hydrogen 2.572 N/A ARG 773.A N THR 612.A O no hydrogen 3.097 N/A MET 775.A N CYS 610.A O no hydrogen 2.796 N/A GLU 776.A N GLN 852.A O no hydrogen 2.743 N/A TYR 779.A N ILE 822.A O no hydrogen 3.034 N/A TYR 779.A OH SER 827.A OG no hydrogen 2.714 N/A MET 780.A N VAL 847.A O no hydrogen 3.132 N/A VAL 781.A N ALA 820.A O no hydrogen 2.997 N/A GLU 782.A N GLN 845.A O no hydrogen 3.257 N/A VAL 783.A N VAL 818.A O no hydrogen 3.269 N/A HIS 784.A N MET 843.A O no hydrogen 2.946 N/A SER 789.A N PRO 786.A O no hydrogen 3.313 N/A SER 789.A OG PRO 786.A O no hydrogen 2.687 N/A LEU 790.A N ALA 787.A O no hydrogen 3.344 N/A ILE 792.A N SER 789.A O no hydrogen 3.009 N/A ILE 793.A N LEU 790.A O no hydrogen 2.780 N/A TYR 794.A N LEU 790.A O no hydrogen 3.313 N/A TYR 794.A OH ASP 807.A OD2 no hydrogen 2.724 N/A ASP 795.A N PRO 791.A O no hydrogen 3.169 N/A LEU 796.A N ILE 792.A O no hydrogen 2.988 N/A LEU 797.A N ILE 793.A O no hydrogen 2.831 N/A THR 798.A N TYR 794.A O no hydrogen 2.910 N/A ARG 800.A N LEU 797.A O no hydrogen 2.729 N/A ARG 800.A NE ASP 826.A O no hydrogen 2.850 N/A ARG 801.A NH1 GLU 776.A OE1 no hydrogen 3.434 N/A ARG 810.A N LEU 815.A O no hydrogen 2.805 N/A LEU 815.A N SER 813.A O no hydrogen 2.767 N/A TYR 816.A N ALA 785.A O no hydrogen 2.796 N/A LEU 817.A N ILE 808.A O no hydrogen 2.865 N/A VAL 818.A N VAL 783.A O no hydrogen 3.077 N/A ARG 819.A N GLN 806.A O no hydrogen 3.229 N/A ARG 819.A NH1 GLN 806.A OE1 no hydrogen 2.626 N/A ILE 822.A N TYR 779.A O no hydrogen 3.365 N/A VAL 824.A N PRO 777.A O no hydrogen 3.041 N/A ASP 826.A N PRO 823.A O no hydrogen 2.565 N/A SER 827.A N VAL 824.A O no hydrogen 3.313 N/A SER 827.A OG TYR 779.A OH no hydrogen 2.714 N/A SER 827.A OG VAL 824.A O no hydrogen 3.555 N/A CYS 828.A SG ILE 825.A O no hydrogen 3.673 N/A PHE 830.A N SER 827.A O no hydrogen 3.323 N/A THR 832.A OG1 GLY 829.A O no hydrogen 3.207 N/A ASP 833.A N GLY 829.A O no hydrogen 3.402 N/A LEU 834.A N PHE 830.A O no hydrogen 3.247 N/A ARG 835.A N GLU 831.A O no hydrogen 3.390 N/A ARG 835.A NE GLU 831.A OE1 no hydrogen 3.344 N/A VAL 836.A N THR 832.A O no hydrogen 3.278 N/A HIS 837.A N ASP 833.A O no hydrogen 3.195 N/A THR 838.A N LEU 834.A O no hydrogen 2.994 N/A THR 838.A OG1 LEU 834.A O no hydrogen 2.763 N/A THR 838.A OG1 GLN 841.A O no hydrogen 2.662 N/A GLN 839.A N VAL 836.A O no hydrogen 2.961 N/A GLY 840.A N ARG 835.A O no hydrogen 3.097 N/A GLN 841.A N THR 838.A O no hydrogen 3.282 N/A GLN 845.A NE2 CYS 844.A O no hydrogen 3.095 N/A VAL 847.A N MET 780.A O no hydrogen 3.334 N/A GLN 852.A N GLU 776.A O no hydrogen 2.790 N/A VAL 854.A N LEU 774.A O no hydrogen 2.774 N/A SER 862.A N ASP 860.A OD1 no hydrogen 3.428 N/A SER 862.A OG ASP 860.A OD1 no hydrogen 2.740 N/A LEU 876.A N GLY 873.A O no hydrogen 3.112 N/A PHE 880.A N LEU 876.A O no hydrogen 3.202 N/A ILE 882.A N ARG 878.A O no hydrogen 3.369 N/A LYS 883.A N ASP 879.A O no hydrogen 3.337 N/A LYS 883.A NZ ASP 879.A OD1 no hydrogen 3.390 N/A THR 884.A N PHE 880.A O no hydrogen 2.747 N/A THR 884.A OG1 PHE 880.A O no hydrogen 2.565 N/A ARG 885.A N LEU 881.A O no hydrogen 3.020 N/A ARG 885.A NE VAL 891.A O no hydrogen 2.652 N/A ARG 885.A NH1 PRO 725.A O no hydrogen 3.470 N/A ARG 885.A NH1 LEU 726.A O no hydrogen 2.617 N/A ARG 885.A NH2 VAL 891.A O no hydrogen 3.040 N/A ARG 886.A N ILE 882.A O no hydrogen 2.875 N/A ARG 887.A N LYS 883.A O no hydrogen 3.217 N/A LYS 888.A N THR 884.A O no hydrogen 3.265 N/A LYS 888.A NZ CYS 727.A O no hydrogen 2.654 N/A GLY 889.A N ARG 885.A O no hydrogen 3.040 N/A LEU 890.A N ARG 885.A O no hydrogen 3.186 N/A GLU 892.A N GLU 892.A OE1 no hydrogen 2.625 N/A