Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7mkl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N VAL 36.A O no hydrogen 3.035 N/A THR 3.A OG1 ASP 145.A OD1 no hydrogen 2.870 N/A THR 3.A OG1 ASP 145.A OD2 no hydrogen 3.063 N/A ASN 4.A N THR 3.A OG1 no hydrogen 2.781 N/A SER 5.A N SER 34.A O no hydrogen 2.947 N/A SER 5.A OG PRO 31.A O no hydrogen 3.249 N/A SER 5.A OG SER 34.A O no hydrogen 2.954 N/A SER 5.A OG SER 34.A OG no hydrogen 3.027 N/A PHE 6.A N ASN 4.A OD1 no hydrogen 2.700 N/A ARG 8.A N SER 5.A O no hydrogen 3.275 N/A TYR 11.A OH ASP 27.A OD1 no hydrogen 3.338 N/A TYR 11.A OH LEU 28.A O no hydrogen 2.966 N/A TYR 12.A N LEU 153.A O no hydrogen 3.346 N/A TYR 12.A OH GLY 196.A O no hydrogen 2.927 N/A VAL 16.A N ASP 14.A OD1 no hydrogen 3.133 N/A SER 20.A N ASN 193.A O no hydrogen 3.194 N/A SER 20.A OG ASN 193.A O no hydrogen 3.538 N/A HIS 23.A N LEU 190.A O no hydrogen 2.996 N/A THR 25.A N PHE 188.A O no hydrogen 3.316 N/A ASP 27.A N ARG 186.A O no hydrogen 3.519 N/A LEU 28.A N ASP 27.A OD1 no hydrogen 2.599 N/A PHE 29.A N GLN 184.A O no hydrogen 2.766 N/A LEU 30.A N GLY 9.A O no hydrogen 3.318 N/A PHE 32.A N ASP 203.A OD2 no hydrogen 3.025 N/A PHE 33.A N PHE 6.A O no hydrogen 2.755 N/A SER 34.A N PRO 31.A O no hydrogen 3.328 N/A SER 34.A OG SER 5.A OG no hydrogen 3.027 N/A SER 34.A OG PRO 31.A O no hydrogen 2.757 N/A VAL 36.A N THR 3.A O no hydrogen 3.239 N/A TRP 38.A N ALA 1.A O no hydrogen 3.401 N/A PHE 39.A N TYR 178.A O no hydrogen 3.068 N/A LEU 48.A N PHE 168.A O no hydrogen 3.040 N/A PHE 50.A N THR 166.A O no hydrogen 2.542 N/A GLY 53.A N PHE 50.A O no hydrogen 3.165 N/A PHE 56.A N PHE 122.A O no hydrogen 2.929 N/A SER 58.A N ARG 120.A O no hydrogen 3.063 N/A SER 58.A OG GLU 60.A OE2 no hydrogen 2.263 N/A SER 58.A OG ARG 120.A O no hydrogen 3.338 N/A THR 59.A OG1 ALA 177.A O no hydrogen 2.525 N/A GLU 60.A N ASN 118.A O no hydrogen 2.845 N/A ARG 66.A NE ASN 63.A O no hydrogen 2.859 N/A TRP 68.A N ILE 83.A O no hydrogen 3.381 N/A ILE 69.A N GLN 169.A O no hydrogen 2.720 N/A PHE 70.A N LEU 81.A O no hydrogen 3.319 N/A GLY 71.A N ARG 167.A O no hydrogen 2.889 N/A THR 72.A OG1 THR 78.A OG1 no hydrogen 2.775 N/A THR 73.A OG1 ASP 75.A OD1 no hydrogen 2.519 N/A THR 73.A OG1 THR 78.A OG1 no hydrogen 2.998 N/A LYS 77.A N ASP 75.A OD1 no hydrogen 3.234 N/A THR 78.A OG1 THR 72.A OG1 no hydrogen 2.775 N/A THR 78.A OG1 THR 73.A OG1 no hydrogen 2.998 N/A SER 80.A OG PHE 70.A O no hydrogen 3.039 N/A LEU 81.A N PHE 70.A O no hydrogen 2.953 N/A LEU 82.A N LYS 93.A O no hydrogen 2.808 N/A ILE 83.A N TRP 68.A O no hydrogen 3.486 N/A VAL 84.A N VAL 91.A O no hydrogen 2.558 N/A ASN 85.A N ARG 66.A O no hydrogen 2.955 N/A ASN 86.A N ASN 89.A O no hydrogen 3.198 N/A ASN 89.A N ASN 86.A O no hydrogen 3.180 N/A VAL 91.A N VAL 84.A O no hydrogen 2.528 N/A LYS 93.A N LEU 82.A O no hydrogen 2.763 N/A LYS 93.A NZ GLU 112.A OE2 no hydrogen 3.398 N/A GLN 98.A NE2 PHE 99.A O no hydrogen 3.373 N/A TYR 113.A OH SER 115.A OG no hydrogen 2.967 N/A SER 115.A OG VAL 90.A O no hydrogen 3.287 N/A SER 115.A OG TYR 113.A OH no hydrogen 2.967 N/A LYS 117.A N GLU 60.A O no hydrogen 3.301 N/A LYS 117.A NZ ASN 141.A OD1 no hydrogen 3.418 N/A ASN 118.A N GLU 60.A O no hydrogen 3.319 N/A LEU 119.A N THR 138.A O no hydrogen 3.275 N/A ARG 120.A N SER 58.A O no hydrogen 2.887 N/A ARG 120.A NH1 ASN 118.A OD1 no hydrogen 3.357 N/A GLU 121.A N LYS 136.A O no hydrogen 3.352 N/A PHE 122.A N PHE 56.A O no hydrogen 2.762 N/A LYS 125.A N LYS 132.A O no hydrogen 3.422 N/A LYS 125.A NZ TYR 11.A OH no hydrogen 3.446 N/A LYS 125.A NZ TYR 134.A OH no hydrogen 3.318 N/A ASN 126.A ND2 ILE 163.A O no hydrogen 2.433 N/A ILE 127.A N TYR 130.A O no hydrogen 3.076 N/A TYR 130.A N ILE 127.A O no hydrogen 3.019 N/A PHE 131.A N LEU 159.A O no hydrogen 2.520 N/A LYS 132.A N LYS 125.A O no hydrogen 2.942 N/A LYS 132.A NZ ASP 158.A OD2 no hydrogen 3.114 N/A ILE 133.A N VAL 157.A O no hydrogen 2.740 N/A TYR 134.A N VAL 123.A O no hydrogen 3.261 N/A LYS 136.A N GLU 121.A O no hydrogen 3.165 N/A THR 138.A N LEU 119.A O no hydrogen 3.471 N/A THR 138.A OG1 PRO 139.A O no hydrogen 3.422 N/A ILE 140.A N LYS 117.A O no hydrogen 3.367 N/A LEU 142.A N PHE 116.A O no hydrogen 3.230 N/A LEU 146.A N ASP 145.A OD1 no hydrogen 2.706 N/A LEU 153.A N VAL 10.A O no hydrogen 3.003 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.636 N/A LEU 156.A N ILE 133.A O no hydrogen 2.742 N/A LEU 159.A N PHE 131.A O no hydrogen 2.612 N/A ILE 161.A N LEU 159.A O no hydrogen 2.833 N/A GLY 162.A N GLY 129.A O no hydrogen 2.978 N/A THR 166.A N GLY 71.A O no hydrogen 3.135 N/A ARG 167.A N GLY 71.A O no hydrogen 2.758 N/A PHE 168.A N LEU 48.A O no hydrogen 2.798 N/A GLN 169.A N ILE 69.A O no hydrogen 2.787 N/A GLN 169.A NE2 ASN 45.A O no hydrogen 2.656 N/A THR 170.A OG1 GLY 67.A O no hydrogen 3.472 N/A LEU 171.A N GLY 67.A O no hydrogen 3.254 N/A ALA 173.A N ILE 64.A O no hydrogen 2.835 N/A TYR 178.A N PHE 39.A O no hydrogen 3.317 N/A TYR 178.A OH ASP 44.A O no hydrogen 3.252 N/A GLY 181.A N TYR 55.A O no hydrogen 3.208 N/A GLN 184.A N PHE 29.A O no hydrogen 2.642 N/A ARG 186.A N GLN 184.A O no hydrogen 2.622 N/A PHE 188.A N THR 25.A O no hydrogen 3.255 N/A LEU 189.A N VAL 202.A O no hydrogen 3.475 N/A LEU 190.A N HIS 23.A O no hydrogen 2.988 N/A LYS 191.A N ASP 200.A O no hydrogen 3.447 N/A TYR 192.A N VAL 21.A O no hydrogen 3.113 N/A ASN 193.A N THR 197.A O no hydrogen 3.230 N/A GLU 194.A N GLU 194.A OE1 no hydrogen 2.737 N/A ASN 195.A N ASN 193.A OD1 no hydrogen 2.911 N/A GLY 196.A N ASN 193.A O no hydrogen 2.908 N/A THR 197.A N ASN 193.A OD1 no hydrogen 3.004 N/A THR 199.A N LYS 191.A O no hydrogen 3.184 N/A ALA 201.A N ASP 200.A OD1 no hydrogen 2.605 N/A VAL 202.A N LEU 189.A O no hydrogen 3.374 N/A CYS 204.A SG THR 187.A O no hydrogen 3.366 N/A ALA 205.A N ASP 203.A OD1 no hydrogen 3.083 N/A LEU 206.A N ASP 203.A O no hydrogen 2.986 N/A SER 210.A N ASP 207.A OD1 no hydrogen 2.586 N/A SER 210.A OG ASP 207.A OD1 no hydrogen 2.834 N/A GLU 211.A N ASP 207.A O no hydrogen 2.879 N/A THR 212.A N PRO 208.A O no hydrogen 2.928 N/A THR 212.A OG1 PRO 208.A O no hydrogen 3.057 N/A THR 212.A OG1 LEU 209.A O no hydrogen 2.465 N/A LYS 213.A N LEU 209.A O no hydrogen 2.930 N/A CYS 214.A N SER 210.A O no hydrogen 2.870 N/A THR 215.A N GLU 211.A O no hydrogen 2.886 N/A THR 215.A OG1 GLU 211.A O no hydrogen 2.813 N/A THR 215.A OG1 GLU 211.A OE2 no hydrogen 3.236 N/A LEU 216.A N THR 212.A O no hydrogen 2.945 N/A LYS 217.A N CYS 214.A O no hydrogen 3.311 N/A LYS 217.A NZ CYS 214.A O no hydrogen 3.316 N/A SER 218.A N LYS 213.A O no hydrogen 3.190 N/A SER 218.A OG LEU 216.A O no hydrogen 3.114 N/A GLU 222.A N GLU 222.A OE1 no hydrogen 2.708 N/A LYS 223.A NZ ASP 556.A OD1 no hydrogen 2.655 N/A LYS 223.A NZ ASP 556.A OD2 no hydrogen 2.940 N/A GLY 224.A N THR 512.A O no hydrogen 3.448 N/A TYR 226.A N VAL 510.A O no hydrogen 3.164 N/A TYR 226.A OH GLU 222.A O no hydrogen 2.974 N/A THR 228.A N VAL 508.A O no hydrogen 3.432 N/A THR 228.A OG1 VAL 508.A O no hydrogen 3.540 N/A PHE 231.A N GLY 506.A O no hydrogen 2.536 N/A GLN 234.A NE2 ARG 232.A O no hydrogen 2.881 N/A THR 236.A N CYS 451.A O no hydrogen 3.443 N/A ILE 239.A N ASN 453.A O no hydrogen 2.897 N/A VAL 240.A N THR 444.A OG1 no hydrogen 3.117 N/A ASN 244.A ND2 GLN 493.A OE1 no hydrogen 2.581 N/A VAL 254.A N PRO 250.A O no hydrogen 3.261 N/A PHE 255.A N PHE 251.A O no hydrogen 2.871 N/A ASN 256.A N GLY 252.A O no hydrogen 2.926 N/A ALA 257.A N GLU 253.A O no hydrogen 2.694 N/A LYS 269.A N ALA 310.A O no hydrogen 3.378 N/A ASN 273.A N THR 436.A OG1 no hydrogen 2.884 N/A CYS 274.A SG ASN 247.A OD1 no hydrogen 3.777 N/A CYS 274.A SG SER 272.A O no hydrogen 3.533 N/A CYS 274.A SG ASN 273.A O no hydrogen 3.513 N/A ALA 276.A N CYS 438.A O no hydrogen 2.782 N/A VAL 280.A N ASP 277.A O no hydrogen 3.373 N/A TYR 282.A N TYR 278.A O no hydrogen 2.910 N/A ASN 283.A N SER 279.A O no hydrogen 2.935 N/A SER 284.A N VAL 280.A O no hydrogen 2.919 N/A ALA 285.A N LEU 281.A O no hydrogen 2.903 N/A THR 289.A N ALA 348.A O no hydrogen 3.133 N/A THR 289.A OG1 SER 288.A O no hydrogen 2.752 N/A TYR 293.A N GLY 344.A O no hydrogen 3.267 N/A LYS 299.A N SER 296.A O no hydrogen 2.826 N/A CYS 304.A SG ASN 457.A OD1 no hydrogen 3.851 N/A PHE 305.A N VAL 437.A O no hydrogen 3.009 N/A ALA 310.A N LYS 269.A O no hydrogen 3.269 N/A ASP 311.A N VAL 425.A O no hydrogen 3.181 N/A PHE 313.A N VAL 423.A O no hydrogen 2.991 N/A ILE 315.A N TYR 421.A O no hydrogen 3.052 N/A ARG 316.A N GLU 319.A OE1 no hydrogen 2.743 N/A ASP 318.A N GLY 417.A O no hydrogen 3.043 N/A VAL 320.A N GLY 317.A O no hydrogen 3.014 N/A GLN 322.A N GLU 319.A O no hydrogen 2.785 N/A ALA 324.A N ARG 321.A O no hydrogen 3.433 N/A ASP 333.A N GLY 329.A O no hydrogen 3.215 N/A TYR 334.A N LYS 330.A O no hydrogen 2.905 N/A TYR 334.A OH LEU 368.A O no hydrogen 3.010 N/A ASN 335.A N ILE 331.A O no hydrogen 2.741 N/A LYS 337.A NZ ALA 332.A O no hydrogen 3.087 N/A ASP 341.A N ASP 341.A OD1 no hydrogen 2.562 N/A VAL 346.A N LYS 291.A O no hydrogen 3.267 N/A ILE 347.A N VAL 424.A O no hydrogen 3.087 N/A ALA 348.A N THR 289.A O no hydrogen 3.403 N/A TRP 349.A N ARG 422.A O no hydrogen 3.332 N/A ASN 350.A ND2 GLN 419.A OE1 no hydrogen 2.691 N/A SER 351.A N PRO 420.A O no hydrogen 3.373 N/A SER 351.A OG TRP 349.A O no hydrogen 3.464 N/A ASN 352.A N ASN 350.A OD1 no hydrogen 3.393 N/A LEU 354.A N SER 351.A O no hydrogen 2.804 N/A ASP 355.A N SER 351.A O no hydrogen 3.035 N/A SER 356.A OG LYS 357.A O no hydrogen 3.562 N/A SER 356.A OG GLN 411.A O no hydrogen 2.701 N/A ASN 361.A ND2 ASP 355.A O no hydrogen 2.541 N/A TYR 362.A OH GLY 359.A O no hydrogen 3.299 N/A TYR 366.A N GLN 406.A O no hydrogen 2.987 N/A LEU 374.A N ASP 333.A O no hydrogen 3.382 N/A PHE 377.A N LYS 337.A O no hydrogen 2.846 N/A ARG 379.A NH1 TRP 266.A O no hydrogen 2.582 N/A THR 383.A OG1 SER 382.A O no hydrogen 2.504 N/A TYR 386.A N TYR 402.A O no hydrogen 3.212 N/A ALA 388.A N ASN 400.A O no hydrogen 3.167 N/A CYS 393.A SG VAL 396.A O no hydrogen 3.578 N/A VAL 396.A N CYS 393.A O no hydrogen 3.148 N/A GLU 397.A N GLU 397.A OE1 no hydrogen 2.647 N/A GLY 398.A N CYS 401.A O no hydrogen 3.435 N/A CYS 401.A N GLY 398.A O no hydrogen 3.324 N/A CYS 401.A SG TYR 386.A O no hydrogen 3.829 N/A CYS 401.A SG VAL 396.A O no hydrogen 3.117 N/A LEU 405.A N PHE 403.A O no hydrogen 3.058 N/A GLN 406.A N TYR 366.A O no hydrogen 3.110 N/A SER 407.A OG TYR 364.A O no hydrogen 3.416 N/A TYR 408.A OH GLU 319.A OE1 no hydrogen 3.177 N/A PHE 410.A N ASN 361.A OD1 no hydrogen 3.069 N/A GLN 411.A NE2 GLY 409.A O no hydrogen 3.196 N/A GLN 419.A N GLY 415.A O no hydrogen 2.866 N/A GLN 419.A NE2 ASN 414.A O no hydrogen 3.509 N/A TYR 421.A N ILE 315.A O no hydrogen 2.841 N/A TYR 421.A OH VAL 416.A O no hydrogen 3.292 N/A ARG 422.A N TRP 349.A O no hydrogen 3.224 N/A ARG 422.A NE ASP 355.A OD2 no hydrogen 3.403 N/A ARG 422.A NH2 ASP 355.A OD1 no hydrogen 3.349 N/A VAL 423.A N PHE 313.A O no hydrogen 2.894 N/A VAL 424.A N ILE 347.A O no hydrogen 3.062 N/A VAL 425.A N ASP 311.A O no hydrogen 3.158 N/A HIS 432.A NE2 PHE 478.A O no hydrogen 3.021 N/A THR 436.A OG1 ASN 273.A OD1 no hydrogen 2.203 N/A CYS 438.A N CYS 274.A O no hydrogen 3.141 N/A LYS 441.A N GLY 439.A O no hydrogen 2.878 N/A THR 444.A N VAL 240.A O no hydrogen 2.617 N/A THR 444.A OG1 VAL 240.A O no hydrogen 3.470 N/A THR 444.A OG1 ASN 445.A O no hydrogen 3.445 N/A LEU 446.A N ASN 445.A OD1 no hydrogen 2.647 N/A LYS 448.A NZ LEU 446.A O no hydrogen 3.345 N/A LYS 450.A NZ GLU 237.A OE2 no hydrogen 2.338 N/A ASN 453.A N GLU 237.A O no hydrogen 3.086 N/A PHE 454.A N GLY 461.A O no hydrogen 3.169 N/A ASN 455.A N ILE 239.A O no hydrogen 3.155 N/A PHE 456.A N LEU 459.A O no hydrogen 3.057 N/A GLY 458.A N ASN 455.A OD1 no hydrogen 2.968 N/A LEU 459.A N PHE 456.A O no hydrogen 3.043 N/A VAL 464.A N THR 501.A O no hydrogen 3.234 N/A THR 466.A N ASP 499.A O no hydrogen 3.129 N/A THR 466.A OG1 GLU 467.A O no hydrogen 3.513 N/A SER 468.A OG ILE 497.A O no hydrogen 2.352 N/A LEU 473.A N GLN 476.A OE1 no hydrogen 3.176 N/A GLN 476.A N LEU 473.A O no hydrogen 2.984 N/A GLN 477.A NE2 ARG 490.A O no hydrogen 3.611 N/A GLY 479.A N ALA 488.A O no hydrogen 3.261 N/A ARG 480.A NH1 ASP 484.A OD1 no hydrogen 2.726 N/A ASP 481.A N THR 485.A O no hydrogen 2.928 N/A ILE 482.A N ASP 481.A OD1 no hydrogen 2.432 N/A ASP 484.A N ASP 481.A O no hydrogen 3.072 N/A ASP 487.A N GLY 479.A O no hydrogen 3.206 N/A VAL 489.A N LEU 498.A O no hydrogen 3.203 N/A ASP 491.A N GLU 496.A O no hydrogen 3.147 N/A GLN 493.A N ASP 491.A OD1 no hydrogen 3.454 N/A THR 494.A OG1 GLU 496.A OE1 no hydrogen 2.695 N/A THR 494.A OG1 GLU 496.A OE2 no hydrogen 2.598 N/A GLU 496.A N THR 494.A O no hydrogen 2.788 N/A LEU 498.A N VAL 489.A O no hydrogen 2.947 N/A ASP 499.A N THR 466.A O no hydrogen 3.084 N/A ILE 500.A N ASP 487.A O no hydrogen 3.419 N/A THR 501.A N VAL 464.A O no hydrogen 3.211 N/A GLY 506.A N PHE 231.A O no hydrogen 3.143 N/A VAL 508.A N SER 229.A O no hydrogen 3.255 N/A SER 509.A N LEU 524.A O no hydrogen 2.799 N/A SER 509.A OG LEU 524.A O no hydrogen 3.319 N/A VAL 510.A N TYR 226.A O no hydrogen 2.950 N/A ILE 511.A N ALA 522.A O no hydrogen 2.950 N/A THR 512.A N GLY 224.A O no hydrogen 3.322 N/A THR 512.A OG1 PRO 513.A O no hydrogen 2.924 N/A THR 517.A N GLY 514.A O no hydrogen 3.172 N/A THR 517.A OG1 ASN 516.A OD1 no hydrogen 3.061 N/A GLN 520.A N SER 518.A OG no hydrogen 3.174 N/A ALA 522.A N ILE 511.A O no hydrogen 3.170 N/A VAL 523.A N ILE 544.A O no hydrogen 3.184 N/A LEU 524.A N SER 509.A O no hydrogen 2.877 N/A TYR 525.A N CYS 542.A O no hydrogen 2.652 N/A GLN 526.A N GLY 507.A O no hydrogen 2.604 N/A ASP 527.A N ALA 540.A O no hydrogen 3.443 N/A CYS 530.A SG GLN 537.A OE1 no hydrogen 3.303 N/A THR 531.A OG1 GLU 532.A OE1 no hydrogen 2.524 N/A GLU 532.A N GLU 532.A OE1 no hydrogen 2.904 N/A PHE 536.A N LEU 543.A O no hydrogen 2.809 N/A GLN 537.A NE2 THR 538.A O no hydrogen 3.293 N/A THR 538.A N GLY 541.A O no hydrogen 3.382 N/A THR 538.A OG1 GLY 541.A O no hydrogen 2.930 N/A GLY 541.A N THR 538.A O no hydrogen 3.500 N/A CYS 542.A N TYR 525.A O no hydrogen 2.644 N/A LEU 543.A N PHE 536.A O no hydrogen 3.159 N/A ILE 544.A N VAL 523.A O no hydrogen 2.941 N/A GLY 545.A N ASN 534.A O no hydrogen 2.933 N/A VAL 549.A N ALA 575.A O no hydrogen 2.581 N/A SER 552.A OG SER 579.A OG no hydrogen 2.894 N/A ILE 557.A N ALA 565.A O no hydrogen 2.830 N/A ILE 559.A N ILE 563.A O no hydrogen 3.074 N/A GLY 560.A N ILE 563.A O no hydrogen 3.156 N/A ILE 563.A N GLY 560.A O no hydrogen 3.106 N/A CYS 564.A N TYR 576.A O no hydrogen 2.881 N/A ALA 565.A N ILE 557.A O no hydrogen 2.858 N/A SER 566.A N ILE 574.A O no hydrogen 3.201 N/A GLN 568.A N SER 572.A O no hydrogen 3.278 N/A GLN 568.A NE2 SER 566.A OG no hydrogen 2.698 N/A SER 572.A N GLN 568.A O no hydrogen 2.935 N/A ILE 574.A N SER 566.A O no hydrogen 3.142 N/A ALA 575.A N GLU 547.A O no hydrogen 2.639 N/A TYR 576.A N CYS 564.A O no hydrogen 2.879 N/A TYR 576.A OH GLU 554.A O no hydrogen 2.836 N/A MET 578.A N GLY 562.A O no hydrogen 3.330 N/A SER 579.A N TYR 553.A O no hydrogen 2.680 N/A SER 579.A OG SER 552.A OG no hydrogen 2.894 N/A TYR 588.A N VAL 586.A O no hydrogen 2.769 N/A SER 589.A OG TYR 588.A O no hydrogen 2.760 N/A ILE 593.A N PHE 930.A O no hydrogen 2.556 N/A ILE 595.A N LYS 928.A O no hydrogen 3.282 N/A THR 597.A N GLN 926.A O no hydrogen 2.712 N/A THR 600.A N VAL 923.A O no hydrogen 3.264 N/A ILE 601.A N GLN 781.A OE1 no hydrogen 3.364 N/A THR 604.A N HIS 919.A O no hydrogen 3.437 N/A GLU 606.A N PHE 917.A O no hydrogen 3.311 N/A LEU 608.A N VAL 915.A O no hydrogen 3.457 N/A VAL 610.A N HIS 913.A O no hydrogen 3.249 N/A SER 611.A OG MET 612.A O no hydrogen 3.356 N/A LYS 614.A NZ ASP 656.A OD2 no hydrogen 2.644 N/A THR 615.A N THR 613.A O no hydrogen 3.083 N/A ASP 618.A N GLY 712.A O no hydrogen 3.256 N/A THR 620.A OG1 ASP 618.A OD2 no hydrogen 2.998 N/A TYR 622.A N ASP 618.A O no hydrogen 2.951 N/A ILE 623.A N CYS 619.A O no hydrogen 2.924 N/A CYS 624.A N THR 620.A O no hydrogen 2.875 N/A CYS 630.A N SER 627.A OG no hydrogen 3.277 N/A CYS 630.A SG ILE 623.A O no hydrogen 3.867 N/A SER 631.A N SER 627.A O no hydrogen 2.976 N/A ASN 632.A N THR 628.A O no hydrogen 2.897 N/A LEU 633.A N GLU 629.A O no hydrogen 2.990 N/A LEU 634.A N CYS 630.A O no hydrogen 2.847 N/A LEU 635.A N SER 631.A O no hydrogen 2.959 N/A GLN 636.A N LEU 633.A O no hydrogen 3.279 N/A TYR 637.A N LEU 634.A O no hydrogen 3.083 N/A GLN 643.A N SER 639.A O no hydrogen 3.012 N/A LEU 644.A N CYS 641.A O no hydrogen 2.928 N/A ASN 645.A N CYS 641.A O no hydrogen 2.956 N/A ARG 646.A N THR 642.A O no hydrogen 2.900 N/A ALA 647.A N GLN 643.A O no hydrogen 3.034 N/A LEU 648.A N LEU 644.A O no hydrogen 2.921 N/A THR 649.A N ASN 645.A O no hydrogen 2.915 N/A THR 649.A OG1 ASN 645.A O no hydrogen 2.831 N/A GLY 650.A N ARG 646.A O no hydrogen 2.946 N/A ILE 651.A N ALA 647.A O no hydrogen 3.014 N/A ALA 652.A N LEU 648.A O no hydrogen 2.934 N/A VAL 653.A N THR 649.A O no hydrogen 2.931 N/A GLU 654.A N GLY 650.A O no hydrogen 2.946 N/A GLN 655.A N ILE 651.A O no hydrogen 3.004 N/A ASP 656.A N VAL 653.A O no hydrogen 3.073 N/A LYS 657.A N VAL 653.A O no hydrogen 2.994 N/A LYS 657.A NZ GLU 661.A OE2 no hydrogen 2.555 N/A ASN 658.A N GLU 654.A O no hydrogen 2.910 N/A ASN 658.A ND2 GLN 655.A OE1 no hydrogen 3.095 N/A THR 659.A N GLN 655.A O no hydrogen 3.039 N/A THR 659.A OG1 GLN 655.A O no hydrogen 3.131 N/A GLN 660.A N ASP 656.A O no hydrogen 2.920 N/A GLU 661.A N LYS 657.A O no hydrogen 2.912 N/A VAL 662.A N ASN 658.A O no hydrogen 2.949 N/A PHE 663.A N THR 659.A O no hydrogen 2.993 N/A ALA 664.A N GLN 660.A O no hydrogen 2.882 N/A GLN 665.A N PHE 663.A O no hydrogen 2.871 N/A GLN 668.A NE2 TYR 670.A OH no hydrogen 3.136 N/A THR 672.A OG1 PRO 673.A O no hydrogen 3.545 N/A LYS 676.A NZ PRO 673.A O no hydrogen 2.968 N/A LYS 676.A NZ PRO 674.A O no hydrogen 3.548 N/A PHE 681.A N PHE 678.A O no hydrogen 3.299 N/A ILE 686.A N PHE 683.A O no hydrogen 3.006 N/A LEU 687.A N PHE 683.A O no hydrogen 3.208 N/A ASP 689.A N ARG 696.A O no hydrogen 3.343 N/A SER 691.A N ASP 689.A OD1 no hydrogen 3.009 N/A LYS 692.A N ASP 689.A O no hydrogen 3.306 N/A LYS 692.A NZ ASP 701.A OD2 no hydrogen 3.094 N/A ARG 696.A N SER 694.A O no hydrogen 2.611 N/A ARG 696.A NE ASP 701.A OD1 no hydrogen 3.030 N/A SER 697.A OG GLN 909.A OE1 no hydrogen 3.464 N/A GLU 700.A N SER 697.A OG no hydrogen 3.378 N/A ASP 701.A N SER 697.A O no hydrogen 2.924 N/A LEU 702.A N PRO 698.A O no hydrogen 2.912 N/A LEU 703.A N ILE 699.A O no hydrogen 2.911 N/A PHE 704.A N GLU 700.A O no hydrogen 2.944 N/A ASN 705.A N ASP 701.A O no hydrogen 2.947 N/A ASN 705.A N LEU 702.A O no hydrogen 3.251 N/A LYS 706.A N LEU 703.A O no hydrogen 3.389 N/A LYS 706.A NZ LEU 793.A O no hydrogen 2.294 N/A THR 714.A N SER 616.A O no hydrogen 3.403 N/A LEU 716.A N LYS 614.A O no hydrogen 3.348 N/A THR 721.A OG1 GLU 723.A OE1 no hydrogen 3.513 N/A GLU 723.A N GLU 723.A OE1 no hydrogen 2.714 N/A ILE 725.A N THR 721.A O no hydrogen 2.953 N/A ALA 726.A N ASP 722.A O no hydrogen 2.879 N/A GLN 727.A N GLU 723.A O no hydrogen 2.922 N/A TYR 728.A N MET 724.A O no hydrogen 2.974 N/A THR 729.A N ILE 725.A O no hydrogen 2.922 N/A THR 729.A OG1 ILE 725.A O no hydrogen 3.282 N/A THR 729.A OG1 ALA 726.A O no hydrogen 2.827 N/A SER 730.A N ALA 726.A O no hydrogen 2.888 N/A ALA 731.A N GLN 727.A O no hydrogen 2.937 N/A LEU 732.A N TYR 728.A O no hydrogen 2.921 N/A LEU 733.A N THR 729.A O no hydrogen 2.931 N/A ALA 734.A N SER 730.A O no hydrogen 2.926 N/A GLY 735.A N ALA 731.A O no hydrogen 2.888 N/A THR 736.A N LEU 732.A O no hydrogen 2.914 N/A THR 736.A OG1 LEU 732.A O no hydrogen 2.925 N/A ILE 737.A N LEU 733.A O no hydrogen 2.932 N/A THR 738.A N ALA 734.A O no hydrogen 2.961 N/A THR 738.A OG1 ALA 734.A O no hydrogen 2.860 N/A SER 739.A N GLY 735.A O no hydrogen 2.881 N/A SER 739.A OG GLY 735.A O no hydrogen 2.516 N/A GLY 740.A N THR 736.A O no hydrogen 2.936 N/A THR 742.A N SER 739.A O no hydrogen 3.100 N/A THR 742.A OG1 SER 739.A O no hydrogen 2.784 N/A THR 742.A OG1 PRO 747.A O no hydrogen 3.552 N/A THR 742.A OG1 LEU 749.A O no hydrogen 3.204 N/A GLY 744.A N TRP 741.A O no hydrogen 3.170 N/A ALA 745.A N TRP 741.A O no hydrogen 2.984 N/A GLY 746.A N THR 742.A O no hydrogen 2.884 N/A LEU 749.A N THR 742.A OG1 no hydrogen 2.989 N/A GLN 750.A N GLN 750.A OE1 no hydrogen 2.682 N/A ILE 751.A N THR 738.A O no hydrogen 2.598 N/A GLN 756.A N PRO 752.A O no hydrogen 3.014 N/A MET 757.A N PHE 753.A O no hydrogen 2.906 N/A ALA 758.A N PRO 754.A O no hydrogen 2.925 N/A TYR 759.A N MET 755.A O no hydrogen 2.998 N/A ARG 760.A N GLN 756.A O no hydrogen 2.897 N/A ARG 760.A NE LEU 904.A O no hydrogen 2.820 N/A ARG 760.A NH2 LEU 904.A O no hydrogen 2.675 N/A PHE 761.A N MET 757.A O no hydrogen 2.949 N/A ASN 762.A N ALA 758.A O no hydrogen 2.923 N/A GLY 763.A N TYR 759.A O no hydrogen 2.913 N/A ILE 764.A N PHE 761.A O no hydrogen 3.279 N/A GLY 765.A N ASN 762.A O no hydrogen 3.223 N/A VAL 766.A N PHE 761.A O no hydrogen 3.394 N/A ASN 769.A ND2 GLU 966.A OE2 no hydrogen 2.752 N/A VAL 770.A N THR 767.A O no hydrogen 3.113 N/A TYR 772.A N GLN 768.A O no hydrogen 2.990 N/A GLU 773.A N ASN 769.A O no hydrogen 2.884 N/A ASN 774.A N VAL 770.A O no hydrogen 2.947 N/A ILE 778.A N ASN 774.A O no hydrogen 2.873 N/A ALA 779.A N GLN 775.A O no hydrogen 2.922 N/A ASN 780.A N LYS 776.A O no hydrogen 2.953 N/A GLN 781.A N LEU 777.A O no hydrogen 2.889 N/A GLN 781.A NE2 LEU 777.A O no hydrogen 2.967 N/A PHE 782.A N ILE 778.A O no hydrogen 2.870 N/A ASN 783.A N ALA 779.A O no hydrogen 2.964 N/A SER 784.A N ASN 780.A O no hydrogen 2.914 N/A SER 784.A OG ASN 780.A O no hydrogen 3.113 N/A ALA 785.A N GLN 781.A O no hydrogen 2.822 N/A ILE 786.A N PHE 782.A O no hydrogen 2.904 N/A GLY 787.A N ASN 783.A O no hydrogen 2.982 N/A LYS 788.A N SER 784.A O no hydrogen 2.884 N/A ILE 789.A N ALA 785.A O no hydrogen 2.878 N/A GLN 790.A N ILE 786.A O no hydrogen 2.932 N/A ASP 791.A N GLY 787.A O no hydrogen 2.922 N/A SER 792.A N LYS 788.A O no hydrogen 2.859 N/A SER 792.A OG LYS 788.A O no hydrogen 2.574 N/A LEU 793.A N ILE 789.A O no hydrogen 2.876 N/A SER 794.A N GLN 790.A O no hydrogen 2.950 N/A SER 794.A OG GLN 790.A O no hydrogen 2.866 N/A SER 794.A OG GLN 790.A OE1 no hydrogen 3.379 N/A SER 795.A N SER 792.A O no hydrogen 3.206 N/A SER 795.A OG ASP 791.A O no hydrogen 2.715 N/A THR 796.A N SER 792.A O no hydrogen 2.871 N/A ALA 799.A N THR 796.A O no hydrogen 3.435 N/A GLY 801.A N SER 798.A O no hydrogen 3.110 N/A LEU 803.A N LEU 800.A O no hydrogen 3.115 N/A GLN 804.A N LEU 800.A O no hydrogen 2.974 N/A ASP 805.A N GLY 801.A O no hydrogen 2.884 N/A VAL 807.A N LEU 803.A O no hydrogen 3.079 N/A ASN 808.A N GLN 804.A O no hydrogen 2.896 N/A ASN 808.A ND2 GLN 804.A OE1 no hydrogen 3.386 N/A GLN 809.A N ASP 805.A O no hydrogen 2.850 N/A ASN 810.A N VAL 806.A O no hydrogen 3.009 N/A ALA 811.A N VAL 807.A O no hydrogen 2.989 N/A GLN 812.A N ASN 808.A O no hydrogen 2.878 N/A ALA 813.A N GLN 809.A O no hydrogen 2.933 N/A LEU 814.A N ASN 810.A O no hydrogen 3.039 N/A ASN 815.A N ALA 811.A O no hydrogen 2.928 N/A THR 816.A N GLN 812.A O no hydrogen 2.879 N/A THR 816.A OG1 GLN 812.A O no hydrogen 2.603 N/A LEU 817.A N ALA 813.A O no hydrogen 2.972 N/A VAL 818.A N LEU 814.A O no hydrogen 2.961 N/A LYS 819.A N ASN 815.A O no hydrogen 2.886 N/A GLN 820.A N THR 816.A O no hydrogen 2.942 N/A LEU 821.A N VAL 818.A O no hydrogen 3.239 N/A SER 822.A N LYS 819.A O no hydrogen 3.067 N/A SER 822.A OG LYS 819.A O no hydrogen 2.977 N/A SER 823.A N GLN 820.A O no hydrogen 3.313 N/A SER 823.A OG GLN 820.A O no hydrogen 3.414 N/A ASN 824.A ND2 ALA 827.A O no hydrogen 2.756 N/A ALA 827.A N ASN 824.A O no hydrogen 3.356 N/A SER 830.A OG SER 823.A O no hydrogen 3.210 N/A VAL 831.A N SER 829.A OG no hydrogen 3.280 N/A ILE 835.A N VAL 831.A O no hydrogen 3.021 N/A LEU 836.A N LEU 832.A O no hydrogen 2.901 N/A SER 837.A N ASN 833.A O no hydrogen 2.915 N/A SER 837.A OG ASN 833.A O no hydrogen 3.024 N/A SER 837.A OG ASP 834.A O no hydrogen 3.273 N/A ARG 838.A N ILE 835.A O no hydrogen 3.314 N/A ARG 838.A NE ASP 834.A O no hydrogen 3.130 N/A LEU 839.A N ILE 835.A O no hydrogen 3.176 N/A GLU 843.A N ASP 840.A O no hydrogen 3.114 N/A ALA 844.A N ASP 840.A O no hydrogen 2.935 N/A GLU 845.A N PRO 841.A O no hydrogen 2.962 N/A GLU 845.A N GLU 845.A OE1 no hydrogen 3.054 N/A GLN 847.A N GLU 843.A O no hydrogen 3.081 N/A ILE 848.A N ALA 844.A O no hydrogen 2.861 N/A ASP 849.A N GLU 845.A O no hydrogen 2.854 N/A ARG 850.A N VAL 846.A O no hydrogen 2.963 N/A LEU 851.A N GLN 847.A O no hydrogen 3.059 N/A ILE 852.A N ILE 848.A O no hydrogen 2.822 N/A THR 853.A N ASP 849.A O no hydrogen 2.915 N/A THR 853.A OG1 ASP 849.A O no hydrogen 3.160 N/A THR 853.A OG1 ARG 850.A O no hydrogen 2.580 N/A GLY 854.A N ARG 850.A O no hydrogen 3.057 N/A ARG 855.A N LEU 851.A O no hydrogen 2.942 N/A ARG 855.A NH1 ILE 623.A O no hydrogen 3.166 N/A LEU 856.A N ILE 852.A O no hydrogen 2.864 N/A GLN 857.A N THR 853.A O no hydrogen 2.969 N/A SER 858.A N GLY 854.A O no hydrogen 3.013 N/A LEU 859.A N ARG 855.A O no hydrogen 2.955 N/A GLN 860.A N LEU 856.A O no hydrogen 2.915 N/A THR 861.A N GLN 857.A O no hydrogen 2.980 N/A THR 861.A OG1 GLN 857.A O no hydrogen 3.053 N/A TYR 862.A N SER 858.A O no hydrogen 3.007 N/A VAL 863.A N LEU 859.A O no hydrogen 2.928 N/A THR 864.A N GLN 860.A O no hydrogen 2.970 N/A THR 864.A OG1 GLN 860.A O no hydrogen 3.080 N/A GLN 865.A N THR 861.A O no hydrogen 3.021 N/A GLN 866.A N TYR 862.A O no hydrogen 2.935 N/A LEU 867.A N VAL 863.A O no hydrogen 2.908 N/A ILE 868.A N THR 864.A O no hydrogen 3.079 N/A ARG 869.A N GLN 865.A O no hydrogen 2.991 N/A ARG 869.A NH1 ASN 810.A OD1 no hydrogen 3.172 N/A ALA 870.A N GLN 866.A O no hydrogen 2.859 N/A ALA 871.A N LEU 867.A O no hydrogen 2.986 N/A GLU 872.A N ILE 868.A O no hydrogen 3.048 N/A ILE 873.A N ARG 869.A O no hydrogen 2.921 N/A ARG 874.A N ALA 870.A O no hydrogen 2.874 N/A ALA 875.A N ALA 871.A O no hydrogen 3.012 N/A SER 876.A N GLU 872.A O no hydrogen 3.008 N/A SER 876.A OG PRO 609.A O no hydrogen 3.021 N/A ALA 877.A N ILE 873.A O no hydrogen 2.866 N/A ASN 878.A N ARG 874.A O no hydrogen 2.951 N/A LEU 879.A N ALA 875.A O no hydrogen 3.012 N/A ALA 880.A N SER 876.A O no hydrogen 2.924 N/A ALA 881.A N ALA 877.A O no hydrogen 2.921 N/A THR 882.A N ASN 878.A O no hydrogen 2.954 N/A THR 882.A OG1 ASN 878.A O no hydrogen 2.976 N/A LYS 883.A N LEU 879.A O no hydrogen 2.940 N/A LYS 883.A NZ PHE 897.A O no hydrogen 3.382 N/A MET 884.A N ALA 880.A O no hydrogen 2.894 N/A SER 885.A N ALA 881.A O no hydrogen 2.966 N/A SER 885.A OG ALA 881.A O no hydrogen 3.324 N/A GLU 886.A N THR 882.A O no hydrogen 2.910 N/A CYS 887.A SG HIS 903.A NE2 no hydrogen 2.991 N/A CYS 887.A SG SER 906.A OG no hydrogen 3.555 N/A VAL 888.A N MET 884.A O no hydrogen 3.004 N/A GLN 891.A NE2 ARG 760.A O no hydrogen 2.791 N/A GLN 891.A NE2 HIS 903.A O no hydrogen 3.588 N/A ARG 894.A N SER 892.A OG no hydrogen 3.247 N/A ARG 894.A NH1 GLU 886.A OE1 no hydrogen 3.157 N/A PHE 897.A N ARG 894.A O no hydrogen 3.235 N/A TYR 902.A OH ASN 963.A OD1 no hydrogen 2.301 N/A LEU 904.A N VAL 920.A O no hydrogen 3.040 N/A SER 906.A OG HIS 919.A ND1 no hydrogen 2.878 N/A GLN 909.A N VAL 916.A O no hydrogen 3.146 N/A GLN 909.A NE2 PRO 908.A O no hydrogen 2.730 N/A ALA 911.A N GLY 914.A O no hydrogen 3.218 N/A GLY 914.A N ALA 911.A O no hydrogen 3.220 N/A VAL 915.A N LEU 608.A O no hydrogen 3.464 N/A VAL 916.A N GLN 909.A O no hydrogen 3.187 N/A PHE 917.A N GLU 606.A O no hydrogen 3.196 N/A LEU 918.A N PHE 907.A O no hydrogen 3.462 N/A HIS 919.A N THR 604.A O no hydrogen 3.215 N/A HIS 919.A ND1 SER 906.A OG no hydrogen 2.878 N/A HIS 919.A NE2 GLU 606.A OE1 no hydrogen 2.981 N/A VAL 920.A N MET 905.A O no hydrogen 3.165 N/A THR 921.A N SER 602.A O no hydrogen 3.389 N/A THR 921.A OG1 LYS 900.A O no hydrogen 3.366 N/A TYR 922.A N TYR 902.A O no hydrogen 3.312 N/A TYR 922.A OH ASN 963.A O no hydrogen 2.561 N/A VAL 923.A N THR 600.A O no hydrogen 3.384 N/A ALA 925.A N ASN 598.A O no hydrogen 3.123 N/A LYS 928.A N ILE 595.A O no hydrogen 3.488 N/A PHE 930.A N ILE 593.A O no hydrogen 2.583 N/A CYS 937.A N VAL 988.A O no hydrogen 3.113 N/A CYS 937.A SG VAL 988.A O no hydrogen 3.943 N/A ALA 942.A N GLY 979.A O no hydrogen 3.302 N/A HIS 943.A N ILE 936.A O no hydrogen 3.267 N/A PHE 944.A N PHE 976.A O no hydrogen 3.017 N/A ARG 946.A NH1 THR 975.A O no hydrogen 2.634 N/A VAL 949.A N THR 960.A O no hydrogen 3.274 N/A VAL 951.A N PHE 958.A O no hydrogen 2.581 N/A SER 952.A OG HIS 956.A O no hydrogen 3.415 N/A ASN 953.A N HIS 956.A O no hydrogen 3.244 N/A GLY 954.A N SER 952.A OG no hydrogen 3.079 N/A THR 955.A N ASN 953.A OD1 no hydrogen 3.234 N/A THR 955.A OG1 ASN 953.A OD1 no hydrogen 3.461 N/A THR 955.A OG1 HIS 956.A ND1 no hydrogen 2.885 N/A HIS 956.A N ASN 953.A OD1 no hydrogen 3.209 N/A HIS 956.A ND1 THR 955.A OG1 no hydrogen 2.885 N/A PHE 958.A N VAL 951.A O no hydrogen 2.479 N/A THR 960.A N VAL 949.A O no hydrogen 3.332 N/A THR 960.A OG1 PHE 964.A O no hydrogen 3.120 N/A PHE 964.A N GLN 961.A O no hydrogen 3.406 N/A TYR 965.A N PRO 596.A O no hydrogen 2.945 N/A GLU 966.A N THR 960.A OG1 no hydrogen 2.659 N/A GLN 968.A N VAL 959.A O no hydrogen 3.214 N/A THR 972.A OG1 TYR 993.A O no hydrogen 3.446 N/A ASP 973.A N THR 971.A OG1 no hydrogen 3.230 N/A ASN 974.A N THR 971.A O no hydrogen 3.240 N/A ASN 974.A ND2 ILE 969.A O no hydrogen 3.670 N/A PHE 976.A N PHE 944.A O no hydrogen 3.408 N/A SER 978.A N ALA 942.A O no hydrogen 3.026 N/A CYS 981.A N GLY 940.A O no hydrogen 2.918 N/A CYS 981.A SG LYS 941.A O no hydrogen 3.666 N/A ASP 982.A N ASN 980.A OD1 no hydrogen 2.864 N/A VAL 988.A N ALA 935.A O no hydrogen 3.495 N/A VAL 992.A N HIS 938.A ND1 no hydrogen 3.491 N/A TYR 993.A N ILE 970.A O no hydrogen 3.285 N/A LEU 996.A N ASP 994.A OD1 no hydrogen 2.934 N/A GLN 997.A N ASP 994.A O no hydrogen 3.058 N/A GLU 999.A N LEU 996.A O no hydrogen 2.879 N/A LEU 1000.A N LEU 996.A O no hydrogen 2.971 N/A LEU 1000.A N GLN 997.A O no hydrogen 3.245 N/A ASP 1001.A N GLN 997.A O no hydrogen 2.884 N/A SER 1002.A N PRO 998.A O no hydrogen 2.933 N/A