Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7e3l_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N VAL 36.A O no hydrogen 2.895 N/A SER 5.A N SER 34.A O no hydrogen 2.904 N/A SER 5.A OG SER 5.A O no hydrogen 2.615 N/A ARG 8.A NE PRO 135.A O no hydrogen 2.491 N/A ARG 8.A NH2 PRO 135.A O no hydrogen 2.504 N/A TYR 11.A OH LEU 28.A O no hydrogen 2.335 N/A TYR 12.A N LEU 141.A O no hydrogen 3.251 N/A SER 19.A OG SER 20.A OG no hydrogen 3.373 N/A SER 19.A OG GLU 179.A O no hydrogen 3.099 N/A SER 20.A N ASN 178.A O no hydrogen 2.608 N/A SER 20.A OG SER 19.A OG no hydrogen 3.373 N/A HIS 23.A N LEU 175.A O no hydrogen 2.962 N/A PHE 29.A N GLN 169.A O no hydrogen 2.865 N/A SER 34.A N SER 5.A OG no hydrogen 2.695 N/A ASN 35.A N SER 34.A OG no hydrogen 2.722 N/A VAL 36.A N THR 3.A O no hydrogen 2.946 N/A PHE 39.A N TYR 163.A O no hydrogen 3.270 N/A LEU 44.A N PHE 156.A O no hydrogen 2.866 N/A ALA 53.A N TYR 164.A O no hydrogen 3.249 N/A THR 55.A N ALA 162.A O no hydrogen 3.361 N/A GLU 56.A N ASN 112.A O no hydrogen 2.858 N/A ARG 62.A NE ASN 59.A O no hydrogen 2.831 N/A TRP 64.A N ILE 79.A O no hydrogen 2.929 N/A PHE 66.A N LEU 77.A O no hydrogen 3.364 N/A THR 68.A OG1 ASN 152.A O no hydrogen 2.544 N/A THR 69.A OG1 ASP 71.A O no hydrogen 3.454 N/A SER 72.A OG ASP 71.A OD2 no hydrogen 3.230 N/A SER 72.A OG PHE 93.A O no hydrogen 3.173 N/A THR 74.A OG1 LYS 73.A O no hydrogen 2.738 N/A SER 76.A OG THR 74.A O no hydrogen 3.094 N/A LEU 78.A N LYS 89.A O no hydrogen 3.070 N/A ALA 83.A N ASN 81.A OD1 no hydrogen 3.134 N/A VAL 87.A N VAL 80.A O no hydrogen 2.935 N/A LYS 89.A N LEU 78.A O no hydrogen 3.260 N/A GLU 92.A N ASN 102.A O no hydrogen 3.321 N/A PHE 93.A N CYS 91.A O no hydrogen 2.747 N/A PHE 95.A N ASP 71.A OD1 no hydrogen 2.325 N/A CYS 103.A SG ASN 101.A O no hydrogen 3.407 N/A THR 104.A OG1 GLN 75.A OE1 no hydrogen 2.564 N/A TYR 107.A N ILE 88.A O no hydrogen 2.927 N/A LYS 111.A N GLU 56.A O no hydrogen 3.133 N/A ASN 112.A N GLU 56.A O no hydrogen 3.005 N/A LEU 113.A N THR 129.A O no hydrogen 2.929 N/A GLU 115.A N LYS 127.A O no hydrogen 2.879 N/A PHE 116.A N PHE 52.A O no hydrogen 2.804 N/A VAL 117.A N TYR 125.A O no hydrogen 2.916 N/A LYS 119.A N LYS 123.A O no hydrogen 3.044 N/A LYS 119.A NZ TYR 11.A OH no hydrogen 2.502 N/A PHE 122.A N LEU 147.A O no hydrogen 2.970 N/A LYS 123.A N LYS 119.A O no hydrogen 2.823 N/A ILE 124.A N VAL 145.A O no hydrogen 2.995 N/A TYR 125.A N VAL 117.A O no hydrogen 2.916 N/A SER 126.A N GLU 142.A O no hydrogen 3.156 N/A LYS 127.A N GLU 115.A O no hydrogen 2.959 N/A HIS 128.A NE2 ASN 112.A OD1 no hydrogen 3.267 N/A THR 129.A N LEU 113.A O no hydrogen 2.883 N/A ILE 131.A N LYS 111.A O no hydrogen 3.459 N/A VAL 145.A N ILE 124.A O no hydrogen 3.497 N/A LEU 147.A N PHE 122.A O no hydrogen 2.817 N/A ARG 155.A N GLY 67.A O no hydrogen 3.149 N/A PHE 156.A N LEU 44.A O no hydrogen 2.966 N/A GLN 157.A N ILE 65.A O no hydrogen 2.889 N/A LEU 159.A N GLY 63.A O no hydrogen 2.715 N/A TYR 167.A OH PRO 45.A O no hydrogen 2.794 N/A GLN 169.A N PHE 29.A O no hydrogen 2.895 N/A ARG 171.A N ASP 27.A O no hydrogen 2.942 N/A ARG 171.A NE ASP 188.A OD2 no hydrogen 2.967 N/A ARG 171.A NH2 ASP 188.A OD2 no hydrogen 2.560 N/A PHE 173.A N THR 25.A O no hydrogen 3.228 N/A LEU 175.A N HIS 23.A O no hydrogen 2.808 N/A LYS 176.A N ASP 185.A O no hydrogen 2.800 N/A TYR 177.A N VAL 21.A O no hydrogen 3.345 N/A ASN 178.A N THR 182.A O no hydrogen 2.924 N/A GLY 181.A N ASN 178.A O no hydrogen 3.442 N/A THR 182.A N ASN 178.A OD1 no hydrogen 2.530 N/A THR 184.A N LYS 176.A O no hydrogen 2.908 N/A THR 184.A OG1 THR 182.A O no hydrogen 3.206 N/A VAL 187.A N LEU 174.A O no hydrogen 3.070 N/A CYS 189.A N THR 172.A O no hydrogen 3.171 N/A ALA 190.A N ASP 188.A OD1 no hydrogen 2.723 N/A LEU 191.A N ASP 188.A O no hydrogen 3.359 N/A SER 195.A N ASP 192.A O no hydrogen 2.671 N/A SER 195.A OG ASP 192.A OD1 no hydrogen 2.987 N/A GLU 196.A N ASP 192.A O no hydrogen 2.956 N/A THR 197.A N PRO 193.A O no hydrogen 2.899 N/A THR 197.A OG1 PRO 193.A O no hydrogen 3.097 N/A LYS 198.A N LEU 194.A O no hydrogen 2.941 N/A CYS 199.A N SER 195.A O no hydrogen 2.904 N/A THR 200.A N GLU 196.A O no hydrogen 2.912 N/A THR 200.A OG1 GLU 196.A O no hydrogen 3.098 N/A THR 200.A OG1 THR 197.A O no hydrogen 2.991 N/A LEU 201.A N THR 197.A O no hydrogen 2.951 N/A LYS 202.A N CYS 199.A O no hydrogen 3.360 N/A SER 203.A N LYS 198.A O no hydrogen 3.330 N/A SER 203.A OG THR 205.A O no hydrogen 2.369 N/A THR 205.A N SER 203.A OG no hydrogen 2.774 N/A VAL 206.A N THR 500.A OG1 no hydrogen 3.188 N/A LYS 208.A NZ ASP 541.A OD1 no hydrogen 2.905 N/A LYS 208.A NZ ASP 541.A OD2 no hydrogen 3.510 N/A GLY 209.A N THR 497.A O no hydrogen 2.883 N/A TYR 211.A OH GLU 207.A O no hydrogen 2.274 N/A THR 213.A N VAL 493.A O no hydrogen 2.974 N/A THR 213.A OG1 VAL 493.A O no hydrogen 3.420 N/A SER 214.A OG GLU 196.A OE1 no hydrogen 2.875 N/A VAL 218.A N SER 489.A O no hydrogen 3.297 N/A THR 221.A N CYS 436.A O no hydrogen 2.945 N/A SER 223.A OG ASN 438.A O no hydrogen 3.209 N/A ILE 224.A N ASN 438.A O no hydrogen 2.943 N/A VAL 225.A N THR 429.A OG1 no hydrogen 2.908 N/A ARG 226.A N ASN 440.A O no hydrogen 2.990 N/A ARG 226.A NE ASP 476.A OD1 no hydrogen 3.060 N/A ARG 226.A NH2 ASP 476.A OD1 no hydrogen 2.840 N/A ARG 226.A NH2 ASP 476.A OD2 no hydrogen 2.864 N/A ASN 232.A ND2 ASN 258.A O no hydrogen 2.993 N/A CYS 234.A N VAL 260.A O no hydrogen 3.335 N/A PHE 236.A N CYS 234.A O no hydrogen 3.002 N/A VAL 239.A N PHE 236.A O no hydrogen 3.175 N/A PHE 240.A N PHE 236.A O no hydrogen 3.180 N/A ALA 250.A N SER 247.A O no hydrogen 3.233 N/A ASN 252.A N SER 297.A O no hydrogen 3.240 N/A LYS 254.A N ALA 295.A O no hydrogen 2.819 N/A ILE 256.A N VAL 293.A O no hydrogen 2.873 N/A CYS 259.A SG SER 257.A O no hydrogen 3.934 N/A VAL 260.A N ASN 232.A O no hydrogen 2.832 N/A TYR 267.A N TYR 263.A O no hydrogen 3.165 N/A SER 269.A OG SER 271.A OG no hydrogen 2.902 N/A SER 271.A OG SER 269.A O no hydrogen 3.098 N/A SER 271.A OG SER 269.A OG no hydrogen 2.902 N/A THR 274.A N ALA 333.A O no hydrogen 3.070 N/A LYS 276.A N VAL 331.A O no hydrogen 3.099 N/A TYR 278.A N GLY 329.A O no hydrogen 2.775 N/A LYS 284.A N SER 281.A O no hydrogen 3.448 N/A CYS 289.A SG ALA 420.A O no hydrogen 4.036 N/A PHE 290.A N VAL 422.A O no hydrogen 3.261 N/A THR 291.A N GLU 414.A O no hydrogen 3.349 N/A THR 291.A OG1 LEU 416.A O no hydrogen 3.253 N/A ASN 292.A N GLU 414.A O no hydrogen 3.395 N/A VAL 293.A N ILE 256.A O no hydrogen 3.269 N/A TYR 294.A N SER 412.A O no hydrogen 3.024 N/A ALA 295.A N LYS 254.A O no hydrogen 2.876 N/A ASP 296.A N VAL 410.A O no hydrogen 3.002 N/A SER 297.A N ASN 252.A O no hydrogen 3.038 N/A PHE 298.A N VAL 408.A O no hydrogen 3.173 N/A ILE 300.A N TYR 406.A O no hydrogen 2.981 N/A ARG 301.A NH1 ASP 303.A OD2 no hydrogen 2.997 N/A GLY 302.A N GLN 404.A O no hydrogen 3.046 N/A ASP 303.A N GLY 402.A O no hydrogen 2.991 N/A GLU 304.A N ARG 301.A O no hydrogen 2.969 N/A VAL 305.A N GLY 302.A O no hydrogen 3.490 N/A GLN 307.A N GLU 304.A O no hydrogen 2.950 N/A ILE 308.A N VAL 305.A O no hydrogen 3.117 N/A ALA 309.A N GLN 307.A O no hydrogen 2.923 N/A GLY 314.A N ASP 318.A OD2 no hydrogen 3.204 N/A TYR 319.A N LYS 315.A O no hydrogen 3.180 N/A ASN 320.A N ILE 316.A O no hydrogen 3.155 N/A ASN 320.A ND2 LYS 315.A O no hydrogen 2.933 N/A ASN 320.A ND2 ARG 352.A O no hydrogen 3.327 N/A TYR 321.A N ILE 316.A O no hydrogen 2.798 N/A TYR 321.A OH ASP 296.A OD2 no hydrogen 2.837 N/A GLY 329.A N TYR 278.A O no hydrogen 3.034 N/A CYS 330.A N LEU 411.A O no hydrogen 3.113 N/A VAL 331.A N LYS 276.A O no hydrogen 3.010 N/A ILE 332.A N VAL 409.A O no hydrogen 3.008 N/A ALA 333.A N THR 274.A O no hydrogen 3.064 N/A TRP 334.A N ARG 407.A O no hydrogen 3.163 N/A SER 336.A N PRO 405.A O no hydrogen 3.370 N/A ASN 337.A N ASN 335.A OD1 no hydrogen 3.140 N/A ASN 337.A ND2 PRO 397.A O no hydrogen 3.432 N/A LEU 339.A N SER 336.A O no hydrogen 3.214 N/A ASP 340.A N SER 336.A O no hydrogen 3.198 N/A SER 341.A OG ASN 337.A O no hydrogen 2.570 N/A SER 341.A OG ASN 337.A OD1 no hydrogen 2.243 N/A GLY 345.A N LYS 342.A O no hydrogen 2.527 N/A ASN 346.A ND2 ASP 340.A O no hydrogen 3.304 N/A ASN 348.A N ASN 346.A OD1 no hydrogen 3.167 N/A TYR 349.A OH ASP 340.A OD1 no hydrogen 3.269 N/A TYR 351.A N GLN 391.A O no hydrogen 2.959 N/A ARG 352.A N ASN 320.A OD1 no hydrogen 3.055 N/A ARG 352.A NH1 SER 367.A O no hydrogen 3.279 N/A ARG 352.A NH2 SER 367.A O no hydrogen 2.381 N/A LEU 353.A N PRO 389.A O no hydrogen 2.806 N/A ARG 355.A NH1 SER 357.A O no hydrogen 2.960 N/A ARG 355.A NH2 ASP 365.A OD2 no hydrogen 3.377 N/A LYS 356.A NZ TYR 371.A OH no hydrogen 3.340 N/A LYS 356.A NZ GLN 372.A O no hydrogen 3.136 N/A LEU 359.A N ASP 318.A O no hydrogen 2.982 N/A PHE 362.A N LYS 322.A O no hydrogen 3.141 N/A SER 367.A N ASP 365.A OD1 no hydrogen 2.837 N/A SER 367.A OG ASP 365.A OD1 no hydrogen 2.974 N/A SER 367.A OG ASP 365.A OD2 no hydrogen 2.958 N/A TYR 371.A N TYR 387.A O no hydrogen 2.918 N/A GLN 372.A NE2 GLY 374.A O no hydrogen 3.057 N/A ALA 373.A N ASN 385.A O no hydrogen 2.881 N/A CYS 378.A SG THR 376.A O no hydrogen 3.859 N/A CYS 378.A SG ASN 385.A O no hydrogen 3.962 N/A VAL 381.A N CYS 378.A O no hydrogen 3.302 N/A GLY 383.A N CYS 386.A O no hydrogen 3.185 N/A CYS 386.A SG PHE 384.A O no hydrogen 4.023 N/A TYR 387.A N TYR 371.A O no hydrogen 3.168 N/A GLN 391.A N TYR 351.A O no hydrogen 3.096 N/A GLN 391.A NE2 SER 392.A O no hydrogen 3.064 N/A SER 392.A OG TYR 349.A O no hydrogen 3.496 N/A SER 392.A OG TYR 393.A O no hydrogen 3.426 N/A TYR 393.A N TYR 349.A O no hydrogen 2.887 N/A TYR 393.A OH GLU 304.A OE1 no hydrogen 2.924 N/A GLN 396.A N ASN 399.A OD1 no hydrogen 3.321 N/A ASN 399.A N GLN 396.A O no hydrogen 3.393 N/A TYR 406.A N ILE 300.A O no hydrogen 2.701 N/A ARG 407.A N TRP 334.A O no hydrogen 2.983 N/A ARG 407.A NE ASP 340.A OD2 no hydrogen 2.880 N/A ARG 407.A NH2 ASP 340.A OD1 no hydrogen 2.990 N/A VAL 408.A N PHE 298.A O no hydrogen 3.035 N/A VAL 409.A N ILE 332.A O no hydrogen 2.827 N/A VAL 410.A N ASP 296.A O no hydrogen 2.877 N/A LEU 411.A N CYS 330.A O no hydrogen 2.956 N/A SER 412.A N TYR 294.A O no hydrogen 2.851 N/A PHE 413.A N THR 328.A O no hydrogen 3.241 N/A GLU 414.A N ASN 292.A O no hydrogen 3.008 N/A ALA 418.A N LEU 416.A O no hydrogen 2.731 N/A THR 421.A OG1 THR 291.A O no hydrogen 3.341 N/A VAL 422.A N PHE 290.A O no hydrogen 3.148 N/A CYS 423.A SG ALA 420.A O no hydrogen 3.047 N/A THR 429.A OG1 VAL 225.A O no hydrogen 2.964 N/A THR 429.A OG1 ASN 430.A O no hydrogen 3.460 N/A LEU 431.A N ASN 430.A OD1 no hydrogen 2.635 N/A ASN 434.A N LEU 450.A O no hydrogen 3.178 N/A LYS 435.A NZ LYS 433.A O no hydrogen 3.495 N/A VAL 437.A N GLY 448.A O no hydrogen 2.906 N/A ASN 438.A N GLU 222.A O no hydrogen 2.929 N/A ASN 440.A N ILE 224.A O no hydrogen 2.874 N/A GLY 443.A N ASN 442.A OD1 no hydrogen 2.465 N/A GLY 446.A N PHE 439.A O no hydrogen 2.992 N/A GLY 448.A N VAL 437.A O no hydrogen 2.941 N/A SER 453.A N ILE 482.A O no hydrogen 3.261 N/A SER 453.A OG ASP 484.A OD1 no hydrogen 3.447 N/A LYS 455.A N SER 453.A OG no hydrogen 2.924 N/A LEU 458.A N GLN 461.A OE1 no hydrogen 2.837 N/A GLN 461.A N LEU 458.A O no hydrogen 2.980 N/A ASP 466.A N THR 470.A O no hydrogen 3.010 N/A ASP 469.A N ASP 466.A O no hydrogen 2.872 N/A THR 470.A OG1 ASP 466.A OD1 no hydrogen 2.659 N/A ASP 472.A N GLY 464.A O no hydrogen 2.866 N/A VAL 474.A N LEU 483.A O no hydrogen 2.896 N/A ARG 475.A N GLN 462.A O no hydrogen 3.203 N/A ASP 476.A N GLU 481.A O no hydrogen 3.125 N/A GLN 478.A N ASP 476.A OD1 no hydrogen 3.512 N/A GLN 478.A NE2 PHE 227.A O no hydrogen 2.751 N/A THR 479.A N ASP 476.A OD2 no hydrogen 2.888 N/A THR 479.A OG1 ASP 476.A OD2 no hydrogen 2.707 N/A GLU 481.A N THR 479.A O no hydrogen 2.568 N/A LEU 483.A N VAL 474.A O no hydrogen 2.898 N/A ASP 484.A N THR 451.A O no hydrogen 2.898 N/A GLY 491.A N PHE 216.A O no hydrogen 2.906 N/A VAL 493.A N SER 214.A O no hydrogen 3.029 N/A SER 494.A N LEU 509.A O no hydrogen 2.973 N/A VAL 495.A N TYR 211.A O no hydrogen 2.871 N/A ILE 496.A N ALA 507.A O no hydrogen 2.891 N/A THR 497.A N GLY 209.A O no hydrogen 2.972 N/A THR 497.A OG1 PRO 498.A O no hydrogen 2.564 N/A THR 500.A N VAL 206.A O no hydrogen 3.083 N/A THR 502.A N GLY 499.A O no hydrogen 2.708 N/A SER 503.A N GLY 499.A O no hydrogen 3.362 N/A GLN 505.A N SER 503.A OG no hydrogen 3.319 N/A ALA 507.A N ILE 496.A O no hydrogen 2.984 N/A VAL 508.A N ILE 529.A O no hydrogen 2.958 N/A LEU 509.A N SER 494.A O no hydrogen 2.897 N/A TYR 510.A N CYS 527.A O no hydrogen 3.001 N/A GLN 511.A N GLY 492.A O no hydrogen 2.925 N/A GLN 511.A NE2 SER 494.A OG no hydrogen 2.900 N/A CYS 515.A SG PHE 521.A O no hydrogen 3.918 N/A THR 516.A N GLU 517.A OE1 no hydrogen 2.854 N/A PHE 521.A N LEU 528.A O no hydrogen 2.887 N/A GLN 522.A NE2 THR 523.A O no hydrogen 2.411 N/A THR 523.A N GLY 526.A O no hydrogen 3.095 N/A THR 523.A OG1 GLY 526.A O no hydrogen 3.445 N/A ALA 525.A N THR 523.A OG1 no hydrogen 2.904 N/A GLY 526.A N THR 523.A OG1 no hydrogen 2.989 N/A CYS 527.A N TYR 510.A O no hydrogen 2.901 N/A ILE 529.A N VAL 508.A O no hydrogen 2.862 N/A GLY 530.A N ASN 519.A O no hydrogen 2.992 N/A GLU 532.A N ILE 558.A O no hydrogen 2.982 N/A ASN 536.A ND2 TYR 538.A OH no hydrogen 2.436 N/A SER 537.A OG ASN 536.A O no hydrogen 2.608 N/A SER 537.A OG THR 562.A O no hydrogen 3.235 N/A ILE 544.A N ILE 548.A O no hydrogen 3.196 N/A ILE 548.A N GLY 545.A O no hydrogen 2.925 N/A CYS 549.A N TYR 561.A O no hydrogen 2.921 N/A ALA 550.A N ILE 542.A O no hydrogen 3.288 N/A SER 551.A N ILE 559.A O no hydrogen 2.885 N/A SER 551.A OG ALA 550.A O no hydrogen 2.745 N/A SER 551.A OG TYR 561.A OH no hydrogen 2.657 N/A GLN 553.A N SER 557.A O no hydrogen 2.938 N/A GLN 556.A NE2 THR 554.A OG1 no hydrogen 2.393 N/A SER 557.A N GLN 553.A O no hydrogen 2.853 N/A ILE 559.A N SER 551.A O no hydrogen 2.862 N/A ALA 560.A N GLU 532.A O no hydrogen 2.889 N/A TYR 561.A N CYS 549.A O no hydrogen 2.908 N/A TYR 561.A OH GLU 539.A O no hydrogen 3.088 N/A TYR 561.A OH SER 551.A OG no hydrogen 2.657 N/A MET 563.A N GLY 547.A O no hydrogen 3.182 N/A SER 564.A N TYR 538.A O no hydrogen 3.056 N/A TYR 573.A N VAL 571.A O no hydrogen 2.626 N/A SER 574.A OG ASN 575.A OD1 no hydrogen 3.323 N/A SER 574.A OG ASN 576.A OD1 no hydrogen 3.199 N/A ASN 576.A N SER 574.A OG no hydrogen 3.169 N/A ILE 578.A N PHE 914.A O no hydrogen 2.956 N/A ILE 580.A N LYS 912.A O no hydrogen 2.978 N/A THR 582.A N GLN 910.A O no hydrogen 2.603 N/A THR 582.A OG1 GLN 910.A O no hydrogen 2.912 N/A PHE 584.A N ASN 583.A OD1 no hydrogen 2.852 N/A THR 585.A N VAL 907.A O no hydrogen 2.893 N/A THR 585.A OG1 VAL 907.A O no hydrogen 3.407 N/A THR 589.A N HIS 903.A O no hydrogen 2.917 N/A GLU 591.A N PHE 901.A O no hydrogen 2.980 N/A LEU 593.A N VAL 899.A O no hydrogen 2.933 N/A MET 597.A N GLN 640.A OE1 no hydrogen 2.546 N/A LYS 599.A NZ ASP 641.A OD2 no hydrogen 3.001 N/A LYS 599.A NZ PRO 701.A O no hydrogen 3.357 N/A THR 600.A OG1 TYR 846.A OH no hydrogen 3.329 N/A SER 601.A N THR 698.A O no hydrogen 2.878 N/A ASP 603.A N GLY 696.A O no hydrogen 3.213 N/A THR 605.A OG1 ASP 603.A OD1 no hydrogen 3.001 N/A MET 606.A N ASP 603.A OD1 no hydrogen 2.471 N/A TYR 607.A N ASP 603.A O no hydrogen 2.957 N/A TYR 607.A OH LEU 801.A O no hydrogen 3.356 N/A ILE 608.A N CYS 604.A O no hydrogen 3.125 N/A CYS 609.A N THR 605.A O no hydrogen 2.928 N/A SER 616.A N SER 612.A O no hydrogen 2.956 N/A SER 616.A OG SER 612.A O no hydrogen 3.463 N/A SER 616.A OG THR 613.A O no hydrogen 2.633 N/A ASN 617.A N THR 613.A O no hydrogen 2.936 N/A LEU 618.A N GLU 614.A O no hydrogen 2.945 N/A LEU 619.A N CYS 615.A O no hydrogen 2.804 N/A LEU 620.A N SER 616.A O no hydrogen 2.990 N/A GLN 621.A N LEU 618.A O no hydrogen 3.093 N/A TYR 622.A N LEU 619.A O no hydrogen 2.822 N/A THR 627.A OG1 SER 624.A O no hydrogen 2.545 N/A GLN 628.A N SER 624.A O no hydrogen 2.929 N/A LEU 629.A N PHE 625.A O no hydrogen 3.030 N/A ASN 630.A N CYS 626.A O no hydrogen 2.918 N/A ARG 631.A N THR 627.A O no hydrogen 2.986 N/A ALA 632.A N GLN 628.A O no hydrogen 3.023 N/A LEU 633.A N LEU 629.A O no hydrogen 3.013 N/A THR 634.A N ASN 630.A O no hydrogen 3.008 N/A THR 634.A OG1 ARG 631.A O no hydrogen 2.847 N/A GLY 635.A N ARG 631.A O no hydrogen 3.017 N/A ILE 636.A N ALA 632.A O no hydrogen 3.082 N/A ALA 637.A N LEU 633.A O no hydrogen 2.971 N/A VAL 638.A N THR 634.A O no hydrogen 3.015 N/A VAL 638.A N GLY 635.A O no hydrogen 3.313 N/A GLU 639.A N GLY 635.A O no hydrogen 3.021 N/A GLN 640.A N ILE 636.A O no hydrogen 3.119 N/A GLN 640.A NE2 ILE 636.A O no hydrogen 3.653 N/A LYS 642.A N VAL 638.A O no hydrogen 3.114 N/A ASN 643.A N GLU 639.A O no hydrogen 2.951 N/A ASN 643.A ND2 VAL 595.A O no hydrogen 3.665 N/A THR 644.A N GLN 640.A O no hydrogen 3.087 N/A GLN 645.A N ASP 641.A O no hydrogen 2.926 N/A GLU 646.A N LYS 642.A O no hydrogen 2.955 N/A VAL 647.A N ASN 643.A O no hydrogen 2.993 N/A PHE 648.A N THR 644.A O no hydrogen 3.013 N/A ALA 649.A N GLN 645.A O no hydrogen 2.951 N/A GLN 650.A N PHE 648.A O no hydrogen 2.577 N/A THR 657.A OG1 PRO 658.A O no hydrogen 3.420 N/A LYS 661.A NZ PRO 658.A O no hydrogen 2.736 N/A LYS 661.A NZ PRO 659.A O no hydrogen 2.442 N/A LYS 661.A NZ ILE 660.A O no hydrogen 3.096 N/A PHE 666.A N PHE 663.A O no hydrogen 3.009 N/A SER 669.A N ASN 667.A OD1 no hydrogen 3.211 N/A SER 669.A OG ASN 667.A OD1 no hydrogen 3.163 N/A ILE 671.A N PHE 668.A O no hydrogen 3.172 N/A LEU 672.A N PHE 668.A O no hydrogen 2.926 N/A SER 678.A OG SER 678.A O no hydrogen 2.631 N/A LYS 679.A N GLU 707.A OE2 no hydrogen 2.980 N/A ARG 680.A N SER 678.A O no hydrogen 2.601 N/A SER 681.A N GLU 684.A OE1 no hydrogen 2.915 N/A SER 681.A OG GLN 670.A O no hydrogen 3.346 N/A SER 681.A OG LEU 672.A O no hydrogen 3.031 N/A ASP 685.A N SER 681.A O no hydrogen 2.935 N/A LEU 686.A N PHE 682.A O no hydrogen 2.977 N/A LEU 687.A N ILE 683.A O no hydrogen 2.938 N/A PHE 688.A N GLU 684.A O no hydrogen 2.910 N/A ASN 689.A N ASP 685.A O no hydrogen 2.925 N/A LYS 690.A N LEU 686.A O no hydrogen 2.987 N/A LYS 690.A N LEU 687.A O no hydrogen 3.220 N/A THR 698.A N SER 601.A O no hydrogen 2.932 N/A THR 698.A N GLY 696.A O no hydrogen 2.835 N/A THR 698.A OG1 SER 601.A O no hydrogen 3.353 N/A LEU 700.A N LYS 599.A O no hydrogen 2.941 N/A MET 708.A N THR 705.A O no hydrogen 2.724 N/A ILE 709.A N THR 705.A O no hydrogen 3.044 N/A ALA 710.A N ASP 706.A O no hydrogen 2.895 N/A GLN 711.A N GLU 707.A O no hydrogen 2.947 N/A TYR 712.A N MET 708.A O no hydrogen 2.935 N/A THR 713.A N ILE 709.A O no hydrogen 3.009 N/A THR 713.A OG1 GLU 684.A OE2 no hydrogen 3.244 N/A THR 713.A OG1 ALA 710.A O no hydrogen 3.054 N/A SER 714.A N ALA 710.A O no hydrogen 2.924 N/A ALA 715.A N GLN 711.A O no hydrogen 2.918 N/A LEU 716.A N TYR 712.A O no hydrogen 3.031 N/A LEU 717.A N THR 713.A O no hydrogen 2.945 N/A ALA 718.A N SER 714.A O no hydrogen 2.929 N/A GLY 719.A N ALA 715.A O no hydrogen 2.930 N/A THR 720.A N LEU 716.A O no hydrogen 2.953 N/A THR 720.A OG1 LEU 716.A O no hydrogen 3.119 N/A ILE 721.A N LEU 717.A O no hydrogen 2.978 N/A THR 722.A N ALA 718.A O no hydrogen 2.971 N/A THR 722.A OG1 ALA 718.A O no hydrogen 2.883 N/A SER 723.A N GLY 719.A O no hydrogen 2.916 N/A SER 723.A OG LEU 733.A O no hydrogen 3.246 N/A GLY 724.A N THR 720.A O no hydrogen 2.987 N/A THR 726.A OG1 SER 723.A O no hydrogen 2.950 N/A THR 726.A OG1 SER 723.A OG no hydrogen 2.744 N/A GLY 728.A N TRP 725.A O no hydrogen 2.885 N/A ALA 729.A N THR 726.A O no hydrogen 2.941 N/A LEU 733.A N THR 726.A OG1 no hydrogen 3.353 N/A GLN 734.A N GLN 734.A OE1 no hydrogen 2.549 N/A GLN 740.A N PRO 736.A O no hydrogen 2.981 N/A GLN 740.A NE2 THR 720.A O no hydrogen 3.669 N/A MET 741.A N PHE 737.A O no hydrogen 2.895 N/A ALA 742.A N ALA 738.A O no hydrogen 2.925 N/A TYR 743.A N MET 739.A O no hydrogen 2.979 N/A ARG 744.A N GLN 740.A O no hydrogen 2.926 N/A PHE 745.A N MET 741.A O no hydrogen 2.904 N/A ASN 746.A N ALA 742.A O no hydrogen 2.929 N/A GLY 747.A N TYR 743.A O no hydrogen 2.927 N/A GLY 747.A N ARG 744.A O no hydrogen 3.318 N/A ILE 748.A N PHE 745.A O no hydrogen 2.645 N/A THR 751.A OG1 ASN 753.A OD1 no hydrogen 3.137 N/A THR 751.A OG1 GLN 945.A OE1 no hydrogen 3.023 N/A ASN 753.A ND2 GLU 757.A OE2 no hydrogen 3.519 N/A ASN 753.A ND2 GLU 950.A OE2 no hydrogen 3.091 N/A VAL 754.A N THR 751.A O no hydrogen 3.355 N/A TYR 756.A N GLN 752.A O no hydrogen 3.043 N/A GLU 757.A N ASN 753.A O no hydrogen 2.859 N/A ASN 758.A N VAL 754.A O no hydrogen 3.018 N/A ASN 758.A N LEU 755.A O no hydrogen 2.919 N/A GLN 759.A NE2 GLY 664.A O no hydrogen 3.122 N/A ILE 762.A N ASN 758.A O no hydrogen 2.978 N/A ALA 763.A N GLN 759.A O no hydrogen 2.911 N/A ASN 764.A N LYS 760.A O no hydrogen 2.989 N/A GLN 765.A N LEU 761.A O no hydrogen 2.971 N/A GLN 765.A NE2 PHE 584.A O no hydrogen 3.387 N/A PHE 766.A N ILE 762.A O no hydrogen 2.938 N/A ASN 767.A N ALA 763.A O no hydrogen 2.977 N/A ASN 767.A ND2 GLY 665.A O no hydrogen 3.614 N/A SER 768.A N ASN 764.A O no hydrogen 2.980 N/A SER 768.A OG ASN 764.A O no hydrogen 2.811 N/A ALA 769.A N GLN 765.A O no hydrogen 2.976 N/A ILE 770.A N PHE 766.A O no hydrogen 2.991 N/A GLY 771.A N ASN 767.A O no hydrogen 3.013 N/A LYS 772.A N SER 768.A O no hydrogen 2.968 N/A ILE 773.A N ALA 769.A O no hydrogen 2.972 N/A GLN 774.A N ILE 770.A O no hydrogen 3.036 N/A GLN 774.A NE2 GLN 670.A OE1 no hydrogen 3.129 N/A ASP 775.A N GLY 771.A O no hydrogen 2.969 N/A SER 776.A N LYS 772.A O no hydrogen 2.881 N/A LEU 777.A N ILE 773.A O no hydrogen 3.025 N/A SER 778.A N GLN 774.A O no hydrogen 2.896 N/A SER 779.A N ASP 775.A O no hydrogen 2.942 N/A THR 780.A N SER 776.A O no hydrogen 2.998 N/A LEU 784.A N ALA 781.A O no hydrogen 3.495 N/A GLN 788.A N LEU 784.A O no hydrogen 3.033 N/A GLN 788.A NE2 ASN 792.A OD1 no hydrogen 3.336 N/A ASP 789.A N GLY 785.A O no hydrogen 2.828 N/A VAL 790.A N LYS 786.A O no hydrogen 3.029 N/A VAL 791.A N LEU 787.A O no hydrogen 3.047 N/A ASN 792.A N GLN 788.A O no hydrogen 2.950 N/A GLN 793.A N ASP 789.A O no hydrogen 2.892 N/A ASN 794.A N VAL 790.A O no hydrogen 3.093 N/A ALA 795.A N VAL 791.A O no hydrogen 2.985 N/A GLN 796.A N ASN 792.A O no hydrogen 2.938 N/A ALA 797.A N GLN 793.A O no hydrogen 3.016 N/A LEU 798.A N ASN 794.A O no hydrogen 3.021 N/A ASN 799.A N ALA 795.A O no hydrogen 2.960 N/A THR 800.A N GLN 796.A O no hydrogen 2.955 N/A THR 800.A OG1 GLN 796.A O no hydrogen 3.419 N/A LEU 801.A N ALA 797.A O no hydrogen 2.997 N/A VAL 802.A N LEU 798.A O no hydrogen 2.965 N/A LYS 803.A N ASN 799.A O no hydrogen 2.929 N/A GLN 804.A N THR 800.A O no hydrogen 2.994 N/A LEU 805.A N VAL 802.A O no hydrogen 2.882 N/A SER 806.A N LYS 803.A O no hydrogen 3.403 N/A ALA 811.A N ASN 808.A O no hydrogen 2.886 N/A SER 813.A OG VAL 815.A O no hydrogen 3.149 N/A LEU 820.A N LEU 816.A O no hydrogen 2.898 N/A SER 821.A N ASN 817.A O no hydrogen 2.947 N/A SER 821.A OG ASP 818.A O no hydrogen 2.807 N/A ARG 822.A N ASP 818.A O no hydrogen 2.956 N/A LEU 823.A N ILE 819.A O no hydrogen 2.675 N/A GLU 827.A N ASP 824.A O no hydrogen 2.937 N/A ALA 828.A N ASP 824.A O no hydrogen 2.868 N/A GLU 829.A N PRO 825.A O no hydrogen 2.820 N/A GLN 831.A N GLU 827.A O no hydrogen 3.020 N/A ILE 832.A N ALA 828.A O no hydrogen 2.853 N/A ASP 833.A N GLU 829.A O no hydrogen 2.907 N/A ARG 834.A N VAL 830.A O no hydrogen 2.999 N/A LEU 835.A N GLN 831.A O no hydrogen 3.021 N/A ILE 836.A N ILE 832.A O no hydrogen 2.803 N/A THR 837.A N ASP 833.A O no hydrogen 2.982 N/A THR 837.A OG1 ASP 833.A O no hydrogen 3.082 N/A GLY 838.A N ARG 834.A O no hydrogen 3.031 N/A ARG 839.A N LEU 835.A O no hydrogen 2.945 N/A ARG 839.A NH1 ILE 608.A O no hydrogen 2.368 N/A LEU 840.A N ILE 836.A O no hydrogen 2.897 N/A GLN 841.A N THR 837.A O no hydrogen 3.020 N/A SER 842.A N GLY 838.A O no hydrogen 3.045 N/A SER 842.A OG ARG 839.A O no hydrogen 2.943 N/A LEU 843.A N ARG 839.A O no hydrogen 2.942 N/A GLN 844.A N LEU 840.A O no hydrogen 2.983 N/A THR 845.A N GLN 841.A O no hydrogen 3.035 N/A THR 845.A OG1 GLN 841.A O no hydrogen 3.271 N/A TYR 846.A N SER 842.A O no hydrogen 3.030 N/A VAL 847.A N LEU 843.A O no hydrogen 2.982 N/A THR 848.A N GLN 844.A O no hydrogen 2.993 N/A THR 848.A OG1 GLN 844.A O no hydrogen 3.460 N/A GLN 849.A N THR 845.A O no hydrogen 3.042 N/A GLN 850.A N TYR 846.A O no hydrogen 2.999 N/A LEU 851.A N VAL 847.A O no hydrogen 2.955 N/A ILE 852.A N THR 848.A O no hydrogen 3.076 N/A ARG 853.A N GLN 849.A O no hydrogen 3.036 N/A ALA 854.A N GLN 850.A O no hydrogen 2.911 N/A ALA 855.A N LEU 851.A O no hydrogen 3.017 N/A GLU 856.A N ILE 852.A O no hydrogen 3.081 N/A ILE 857.A N ARG 853.A O no hydrogen 2.973 N/A ARG 858.A N ALA 854.A O no hydrogen 2.935 N/A ARG 858.A NE GLU 639.A OE2 no hydrogen 3.200 N/A ALA 859.A N ALA 855.A O no hydrogen 3.035 N/A SER 860.A N GLU 856.A O no hydrogen 3.049 N/A SER 860.A OG PRO 594.A O no hydrogen 3.266 N/A ALA 861.A N ILE 857.A O no hydrogen 2.884 N/A ASN 862.A N ARG 858.A O no hydrogen 2.963 N/A LEU 863.A N ALA 859.A O no hydrogen 3.043 N/A ALA 864.A N SER 860.A O no hydrogen 2.967 N/A ALA 865.A N ALA 861.A O no hydrogen 2.930 N/A THR 866.A N ASN 862.A O no hydrogen 2.986 N/A THR 866.A OG1 ASN 862.A O no hydrogen 3.441 N/A LYS 867.A N LEU 863.A O no hydrogen 2.920 N/A LYS 867.A NZ PHE 881.A O no hydrogen 3.364 N/A MET 868.A N ALA 864.A O no hydrogen 2.927 N/A SER 869.A N ALA 865.A O no hydrogen 2.990 N/A GLU 870.A N THR 866.A O no hydrogen 2.955 N/A CYS 871.A N LYS 867.A O no hydrogen 2.888 N/A CYS 871.A SG SER 890.A OG no hydrogen 3.725 N/A VAL 872.A N MET 868.A O no hydrogen 2.983 N/A LEU 873.A N MET 868.A O no hydrogen 3.487 N/A GLN 875.A NE2 ARG 744.A O no hydrogen 3.279 N/A GLN 875.A NE2 HIS 887.A O no hydrogen 2.910 N/A LYS 877.A NZ GLY 747.A O no hydrogen 3.198 N/A PHE 881.A N ARG 878.A O no hydrogen 3.175 N/A TYR 886.A N TYR 906.A O no hydrogen 3.027 N/A LEU 888.A N VAL 904.A O no hydrogen 2.982 N/A MET 889.A N VAL 904.A O no hydrogen 3.431 N/A SER 890.A OG CYS 871.A O no hydrogen 2.765 N/A PHE 891.A N LEU 902.A O no hydrogen 3.299 N/A GLN 893.A N VAL 900.A O no hydrogen 2.804 N/A GLN 893.A NE2 PRO 892.A O no hydrogen 2.193 N/A VAL 899.A N LEU 593.A O no hydrogen 2.911 N/A VAL 900.A N GLN 893.A O no hydrogen 2.934 N/A PHE 901.A N GLU 591.A O no hydrogen 2.869 N/A LEU 902.A N PHE 891.A O no hydrogen 2.893 N/A HIS 903.A N THR 589.A O no hydrogen 2.881 N/A HIS 903.A NE2 GLU 591.A OE1 no hydrogen 2.609 N/A VAL 904.A N MET 889.A O no hydrogen 2.943 N/A THR 905.A N SER 587.A O no hydrogen 3.054 N/A THR 905.A OG1 SER 587.A OG no hydrogen 2.366 N/A THR 905.A OG1 LYS 884.A O no hydrogen 3.395 N/A TYR 906.A N TYR 886.A O no hydrogen 2.804 N/A VAL 907.A N THR 585.A O no hydrogen 2.915 N/A ALA 909.A N ASN 583.A O no hydrogen 2.832 N/A LYS 912.A N ILE 580.A O no hydrogen 2.858 N/A PHE 914.A N ILE 578.A O no hydrogen 2.872 N/A PHE 914.A N LYS 912.A O no hydrogen 3.217 N/A THR 915.A N SER 936.A O no hydrogen 3.014 N/A THR 916.A N ASN 576.A O no hydrogen 2.982 N/A THR 916.A OG1 PHE 934.A O no hydrogen 2.809 N/A ILE 920.A N HIS 927.A O no hydrogen 3.043 N/A CYS 921.A N VAL 972.A O no hydrogen 2.928 N/A ALA 926.A N SER 962.A O no hydrogen 2.950 N/A HIS 927.A N ILE 920.A O no hydrogen 2.888 N/A PHE 928.A N PHE 960.A O no hydrogen 2.957 N/A ARG 930.A N ASN 958.A O no hydrogen 2.764 N/A ARG 930.A NH1 ASP 957.A O no hydrogen 2.432 N/A VAL 933.A N THR 944.A O no hydrogen 2.900 N/A VAL 935.A N PHE 942.A O no hydrogen 2.874 N/A SER 936.A OG HIS 940.A O no hydrogen 2.996 N/A GLY 938.A N SER 936.A OG no hydrogen 3.041 N/A THR 939.A OG1 ASN 937.A OD1 no hydrogen 3.254 N/A THR 939.A OG1 HIS 940.A ND1 no hydrogen 2.456 N/A HIS 940.A N ASN 937.A OD1 no hydrogen 3.302 N/A PHE 942.A N VAL 935.A O no hydrogen 2.934 N/A VAL 943.A N GLN 952.A O no hydrogen 3.254 N/A THR 944.A N VAL 933.A O no hydrogen 2.932 N/A THR 944.A OG1 GLN 945.A O no hydrogen 3.447 N/A GLN 945.A NE2 PHE 948.A O no hydrogen 3.646 N/A ASN 947.A ND2 GLY 749.A O no hydrogen 3.348 N/A TYR 949.A N PRO 581.A O no hydrogen 2.959 N/A GLU 950.A N THR 944.A OG1 no hydrogen 2.958 N/A GLN 952.A NE2 PRO 951.A O no hydrogen 2.949 N/A ASP 957.A N THR 955.A OG1 no hydrogen 2.721 N/A ASN 958.A N THR 955.A OG1 no hydrogen 3.275 N/A THR 959.A OG1 PHE 928.A O no hydrogen 2.346 N/A THR 959.A OG1 PHE 960.A O no hydrogen 3.330 N/A PHE 960.A N PHE 928.A O no hydrogen 2.899 N/A SER 962.A N ALA 926.A O no hydrogen 2.899 N/A SER 962.A OG VAL 961.A O no hydrogen 2.303 N/A CYS 965.A N GLY 924.A O no hydrogen 2.654 N/A ASN 974.A N CYS 921.A O no hydrogen 2.895 N/A TYR 977.A N ILE 954.A O no hydrogen 3.229 N/A LEU 980.A N ASP 978.A OD1 no hydrogen 3.199 N/A LEU 984.A N LEU 980.A O no hydrogen 2.894 N/A ASP 985.A N GLN 981.A O no hydrogen 2.914 N/A SER 986.A N PRO 982.A O no hydrogen 2.903 N/A