Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7sjr_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A N ASN 55.A OD1 no hydrogen 2.776 N/A SER 3.A N GLU 6.A OE1 no hydrogen 3.367 N/A SER 3.A OG GLU 6.A OE1 no hydrogen 2.558 N/A GLU 6.A N SER 3.A OG no hydrogen 3.275 N/A LEU 7.A N SER 3.A O no hydrogen 2.785 N/A SER 8.A N PRO 4.A O no hydrogen 2.840 N/A SER 8.A OG PRO 4.A O no hydrogen 3.223 N/A SER 8.A OG VAL 5.A O no hydrogen 2.622 N/A ALA 9.A N VAL 5.A O no hydrogen 2.948 N/A ALA 10.A N GLU 6.A O no hydrogen 3.025 N/A LEU 11.A N SER 8.A O no hydrogen 2.936 N/A THR 17.A OG1 ASP 18.A OD1 no hydrogen 2.725 N/A GLU 19.A N ASP 18.A OD1 no hydrogen 2.662 N/A ALA 21.A N ASP 18.A O no hydrogen 2.911 N/A ALA 22.A N ASP 18.A O no hydrogen 3.269 N/A ALA 25.A N ALA 21.A O no hydrogen 2.912 N/A ALA 26.A N VAL 23.A O no hydrogen 3.309 N/A LEU 31.A N LEU 288.A O no hydrogen 3.114 N/A VAL 33.A N ALA 290.A O no hydrogen 2.789 N/A ALA 35.A N GLY 292.A O no hydrogen 3.202 N/A GLY 36.A N LEU 323.A O no hydrogen 3.173 N/A ALA 39.A N GLY 36.A O no hydrogen 3.139 N/A LYS 41.A NZ ASP 261.A OD1 no hydrogen 2.676 N/A LYS 41.A NZ ASP 261.A OD2 no hydrogen 2.986 N/A ALA 47.A N GLU 43.A O no hydrogen 2.906 N/A ARG 48.A N THR 44.A O no hydrogen 2.858 N/A VAL 49.A N MET 45.A O no hydrogen 2.984 N/A VAL 50.A N ALA 46.A O no hydrogen 2.868 N/A TRP 51.A N ALA 47.A O no hydrogen 2.912 N/A LEU 52.A N ARG 48.A O no hydrogen 2.969 N/A VAL 53.A N VAL 49.A O no hydrogen 2.944 N/A ALA 54.A N VAL 50.A O no hydrogen 2.867 N/A ASN 55.A N TRP 51.A O no hydrogen 2.931 N/A ASN 55.A ND2 TYR 2.A O no hydrogen 3.299 N/A GLY 56.A N LEU 52.A O no hydrogen 2.943 N/A PHE 57.A N LEU 52.A O no hydrogen 3.089 N/A THR 59.A OG1 SER 61.A OG no hydrogen 2.939 N/A SER 61.A OG THR 59.A OG1 no hydrogen 2.939 N/A SER 61.A OG GLU 94.A OE2 no hydrogen 3.553 N/A GLN 62.A N THR 59.A O no hydrogen 3.035 N/A VAL 63.A N PRO 60.A O no hydrogen 3.270 N/A LEU 64.A N VAL 257.A O no hydrogen 2.829 N/A GLY 65.A N THR 97.A O no hydrogen 2.939 N/A LEU 66.A N LEU 259.A O no hydrogen 2.736 N/A THR 67.A N SER 99.A O no hydrogen 3.322 N/A ALA 72.A N THR 69.A OG1 no hydrogen 3.373 N/A ALA 73.A N THR 69.A O no hydrogen 2.940 N/A GLY 74.A N ARG 70.A O no hydrogen 2.917 N/A GLN 75.A N LYS 71.A O no hydrogen 2.924 N/A LEU 76.A N ALA 72.A O no hydrogen 2.953 N/A LEU 77.A N ALA 73.A O no hydrogen 2.917 N/A ARG 78.A N GLY 74.A O no hydrogen 2.942 N/A ARG 79.A N GLN 75.A O no hydrogen 2.974 N/A ARG 79.A NE THR 42.A O no hydrogen 3.463 N/A VAL 80.A N LEU 76.A O no hydrogen 2.925 N/A ARG 81.A N LEU 77.A O no hydrogen 2.894 N/A THR 82.A N ARG 78.A O no hydrogen 2.981 N/A ARG 83.A N ARG 79.A O no hydrogen 3.004 N/A ARG 83.A NH1 GLU 43.A OE2 no hydrogen 2.343 N/A ARG 83.A NH2 GLU 43.A OE1 no hydrogen 2.600 N/A ARG 83.A NH2 GLU 43.A OE2 no hydrogen 2.999 N/A LEU 84.A N VAL 80.A O no hydrogen 2.935 N/A ALA 85.A N ARG 81.A O no hydrogen 2.909 N/A ARG 86.A N THR 82.A O no hydrogen 2.923 N/A LEU 87.A N ARG 83.A O no hydrogen 2.942 N/A ALA 88.A N ALA 85.A O no hydrogen 3.135 N/A GLY 89.A N ARG 86.A O no hydrogen 2.997 N/A ASP 93.A N SER 92.A OG no hydrogen 2.397 N/A GLU 94.A N GLU 94.A OE1 no hydrogen 2.745 N/A SER 99.A N GLY 65.A O no hydrogen 2.914 N/A PHE 104.A N THR 100.A O no hydrogen 3.066 N/A ALA 105.A N TYR 101.A O no hydrogen 2.904 N/A GLY 106.A N HIS 102.A O no hydrogen 2.909 N/A THR 107.A N ALA 103.A O no hydrogen 2.947 N/A THR 107.A OG1 ALA 103.A O no hydrogen 3.330 N/A LEU 108.A N PHE 104.A O no hydrogen 2.877 N/A LEU 109.A N ALA 105.A O no hydrogen 2.918 N/A ARG 110.A N GLY 106.A O no hydrogen 2.905 N/A GLU 111.A N THR 107.A O no hydrogen 2.942 N/A GLU 111.A N LEU 108.A O no hydrogen 3.317 N/A HIS 112.A N LEU 108.A O no hydrogen 2.920 N/A HIS 112.A N LEU 109.A O no hydrogen 3.183 N/A LEU 116.A N GLY 113.A O no hydrogen 2.630 N/A LEU 125.A N MET 228.A O no hydrogen 3.264 N/A GLU 129.A N SER 126.A OG no hydrogen 3.400 N/A LEU 133.A N LEU 130.A O no hydrogen 2.557 N/A ALA 134.A N LEU 130.A O no hydrogen 2.819 N/A TYR 135.A N TRP 131.A O no hydrogen 2.921 N/A ASP 136.A N LEU 133.A O no hydrogen 2.787 N/A VAL 137.A N LEU 133.A O no hydrogen 3.109 N/A CYS 139.A SG TYR 135.A O no hydrogen 3.211 N/A ALA 140.A N ASP 136.A O no hydrogen 3.009 N/A THR 147.A OG1 GLU 207.A OE2 no hydrogen 2.472 N/A ALA 153.A N THR 150.A O no hydrogen 3.059 N/A THR 155.A OG1 ALA 134.A O no hydrogen 3.494 N/A VAL 158.A N VAL 154.A O no hydrogen 2.871 N/A LEU 159.A N THR 155.A O no hydrogen 2.909 N/A ARG 160.A N ALA 156.A O no hydrogen 2.920 N/A LEU 161.A N MET 157.A O no hydrogen 2.862 N/A SER 162.A N VAL 158.A O no hydrogen 2.895 N/A GLY 163.A N LEU 159.A O no hydrogen 2.819 N/A ALA 164.A N LEU 161.A O no hydrogen 2.869 N/A LEU 165.A N LEU 161.A O no hydrogen 2.938 N/A GLU 167.A N ALA 164.A O no hydrogen 3.066 N/A HIS 168.A N ALA 164.A O no hydrogen 2.928 N/A VAL 170.A N LEU 165.A O no hydrogen 3.255 N/A ARG 176.A NE ASP 173.A O no hydrogen 2.504 N/A ARG 176.A NH2 ASP 173.A O no hydrogen 2.898 N/A GLU 183.A N HIS 179.A O no hydrogen 2.890 N/A ARG 184.A N VAL 180.A O no hydrogen 2.949 N/A VAL 186.A N LEU 182.A O no hydrogen 2.892 N/A HIS 187.A N GLU 183.A O no hydrogen 2.963 N/A THR 188.A OG1 ARG 184.A O no hydrogen 3.306 N/A LEU 199.A N SER 195.A O no hydrogen 3.455 N/A MET 201.A N TRP 197.A O no hydrogen 3.360 N/A LEU 202.A N LEU 198.A O no hydrogen 3.275 N/A ALA 203.A N LEU 199.A O no hydrogen 2.927 N/A THR 204.A N ARG 200.A O no hydrogen 3.362 N/A THR 204.A N MET 201.A O no hydrogen 3.205 N/A THR 204.A OG1 MET 201.A O no hydrogen 2.525 N/A THR 204.A OG1 LEU 650.A O no hydrogen 2.985 N/A GLN 205.A N MET 201.A O no hydrogen 3.486 N/A GLN 205.A NE2 MET 201.A O no hydrogen 3.674 N/A GLN 205.A NE2 TRP 649.A O no hydrogen 3.576 N/A THR 206.A N LEU 202.A O no hydrogen 3.020 N/A THR 206.A OG1 LEU 202.A O no hydrogen 3.202 N/A THR 206.A OG1 ALA 203.A O no hydrogen 2.575 N/A GLU 207.A N ALA 203.A O no hydrogen 2.876 N/A ARG 208.A N THR 204.A O no hydrogen 2.888 N/A ARG 208.A NH1 GLN 205.A OE1 no hydrogen 2.469 N/A ARG 208.A NH2 TRP 649.A O no hydrogen 2.934 N/A ARG 208.A NH2 ASP 652.A O no hydrogen 3.243 N/A THR 209.A N GLN 205.A O no hydrogen 3.019 N/A THR 209.A OG1 THR 206.A O no hydrogen 2.792 N/A GLU 210.A N THR 206.A O no hydrogen 2.948 N/A GLU 210.A N GLU 207.A O no hydrogen 2.988 N/A LEU 211.A N GLU 207.A O no hydrogen 2.859 N/A VAL 212.A N ARG 208.A O no hydrogen 3.078 N/A ILE 215.A N LEU 211.A O no hydrogen 3.067 N/A ASP 216.A N VAL 212.A O no hydrogen 2.952 N/A ALA 217.A N PRO 213.A O no hydrogen 2.855 N/A LEU 218.A N LEU 214.A O no hydrogen 3.126 N/A HIS 219.A N ILE 215.A O no hydrogen 3.472 N/A GLN 220.A N ASP 216.A O no hydrogen 3.430 N/A ARG 221.A N ALA 217.A O no hydrogen 3.013 N/A ARG 221.A NE GLU 225.A OE2 no hydrogen 3.382 N/A ARG 221.A NH1 ASP 136.A OD2 no hydrogen 3.115 N/A ARG 221.A NH2 ASP 136.A OD2 no hydrogen 2.498 N/A MET 222.A N LEU 218.A O no hydrogen 2.926 N/A ARG 223.A N HIS 219.A O no hydrogen 2.899 N/A ALA 224.A N GLN 220.A O no hydrogen 2.952 N/A LYS 226.A N ARG 223.A O no hydrogen 3.301 N/A VAL 227.A N MET 222.A O no hydrogen 3.158 N/A MET 228.A N ARG 123.A O no hydrogen 3.047 N/A PHE 230.A N ASP 229.A OD1 no hydrogen 2.254 N/A GLN 233.A N ASP 229.A O no hydrogen 2.911 N/A MET 234.A N PHE 230.A O no hydrogen 3.032 N/A ALA 235.A N GLY 231.A O no hydrogen 2.960 N/A ALA 236.A N MET 232.A O no hydrogen 2.897 N/A ALA 237.A N GLN 233.A O no hydrogen 2.978 N/A ALA 238.A N MET 234.A O no hydrogen 2.913 N/A ARG 239.A N ALA 235.A O no hydrogen 2.923 N/A LEU 240.A N ALA 236.A O no hydrogen 2.927 N/A ALA 241.A N ALA 237.A O no hydrogen 2.933 N/A ALA 242.A N ALA 238.A O no hydrogen 2.923 N/A ARG 243.A N ARG 239.A O no hydrogen 2.926 N/A PHE 244.A N LEU 240.A O no hydrogen 2.964 N/A GLN 246.A N GLN 246.A OE1 no hydrogen 2.559 N/A GLU 249.A N PRO 245.A O no hydrogen 2.941 N/A GLN 250.A N GLN 246.A O no hydrogen 2.889 N/A LEU 251.A N VAL 247.A O no hydrogen 2.926 N/A ARG 252.A N GLY 248.A O no hydrogen 2.876 N/A GLN 253.A N GLU 249.A O no hydrogen 2.940 N/A ARG 254.A N GLN 250.A O no hydrogen 2.978 N/A PHE 255.A N LEU 251.A O no hydrogen 2.914 N/A ARG 256.A N GLN 62.A O no hydrogen 2.939 N/A ARG 256.A NH1 ASP 283.A OD2 no hydrogen 3.119 N/A ARG 256.A NH2 ASP 283.A OD2 no hydrogen 2.360 N/A VAL 257.A N GLN 62.A O no hydrogen 3.344 N/A LEU 260.A N THR 289.A O no hydrogen 3.106 N/A ASP 261.A N LEU 66.A O no hydrogen 2.838 N/A GLN 264.A NE2 GLU 262.A OE1 no hydrogen 2.453 N/A THR 266.A OG1 GLN 270.A OE1 no hydrogen 2.284 N/A GLN 270.A N GLY 267.A O no hydrogen 3.056 N/A ARG 271.A N GLY 267.A O no hydrogen 2.932 N/A SER 275.A OG ARG 271.A O no hydrogen 3.496 N/A SER 276.A N ILE 272.A O no hydrogen 3.348 N/A SER 276.A OG ALA 241.A O no hydrogen 2.424 N/A VAL 291.A N LEU 260.A O no hydrogen 3.328 N/A SER 297.A OG SER 297.A O no hydrogen 2.416 N/A THR 301.A OG1 THR 301.A O no hydrogen 2.379 N/A ARG 305.A N ASN 302.A O no hydrogen 2.985 N/A PHE 306.A N LEU 303.A O no hydrogen 3.203 N/A THR 308.A OG1 THR 307.A O no hydrogen 2.364 N/A ASP 309.A N PHE 306.A O no hydrogen 2.828 N/A PHE 310.A N PHE 306.A O no hydrogen 2.916 N/A TYR 312.A N THR 316.A O no hydrogen 3.093 N/A SER 313.A OG TYR 312.A O no hydrogen 2.482 N/A THR 316.A N ASP 314.A OD1 no hydrogen 2.996 N/A THR 316.A OG1 ASP 314.A OD1 no hydrogen 2.487 N/A THR 316.A OG1 ASP 314.A OD2 no hydrogen 3.283 N/A THR 320.A OG1 PRO 319.A O no hydrogen 2.757 N/A LEU 321.A N VAL 32.A O no hydrogen 3.079 N/A LEU 323.A N ILE 34.A O no hydrogen 2.894 N/A THR 325.A OG1 ARG 324.A O no hydrogen 2.439 N/A THR 325.A OG1 THR 325.A O no hydrogen 2.430 N/A SER 326.A OG THR 333.A OG1 no hydrogen 3.274 N/A ARG 328.A NH2 GLU 626.A OE1 no hydrogen 2.787 N/A ASN 329.A ND2 GLU 709.A O no hydrogen 2.845 N/A SER 332.A OG ASN 329.A O no hydrogen 3.152 N/A THR 333.A N ASN 329.A O no hydrogen 3.100 N/A THR 333.A OG1 SER 326.A OG no hydrogen 3.274 N/A THR 333.A OG1 ASN 329.A O no hydrogen 3.345 N/A LEU 334.A N PRO 330.A O no hydrogen 2.420 N/A ALA 337.A N SER 332.A O no hydrogen 2.408 N/A ALA 339.A N VAL 336.A O no hydrogen 2.587 N/A GLU 342.A N SER 341.A OG no hydrogen 2.814 N/A GLU 352.A N GLU 352.A OE1 no hydrogen 2.693 N/A ARG 357.A N LEU 712.A O no hydrogen 3.083 N/A CYS 358.A N GLU 747.A O no hydrogen 3.000 N/A CYS 358.A SG GLU 747.A O no hydrogen 3.459 N/A LEU 361.A N GLY 716.A O no hydrogen 3.214 N/A ALA 365.A N ASN 363.A OD1 no hydrogen 3.133 N/A GLU 367.A N ASN 363.A O no hydrogen 2.832 N/A ARG 368.A N VAL 364.A O no hydrogen 2.888 N/A ASP 369.A N ALA 365.A O no hydrogen 2.868 N/A TRP 370.A N ALA 366.A O no hydrogen 2.901 N/A TRP 370.A NE1 GLU 749.A OE1 no hydrogen 2.947 N/A VAL 371.A N GLU 367.A O no hydrogen 2.959 N/A ALA 372.A N ARG 368.A O no hydrogen 2.888 N/A ASP 373.A N ASP 369.A O no hydrogen 2.830 N/A HIS 374.A N TRP 370.A O no hydrogen 2.995 N/A LEU 375.A N VAL 371.A O no hydrogen 2.976 N/A ALA 376.A N ALA 372.A O no hydrogen 2.821 N/A ARG 377.A N ASP 373.A O no hydrogen 2.912 N/A ARG 377.A NE ASP 373.A O no hydrogen 3.473 N/A ALA 378.A N HIS 374.A O no hydrogen 2.981 N/A TYR 379.A N LEU 375.A O no hydrogen 2.899 N/A HIS 380.A N ALA 376.A O no hydrogen 2.884 N/A GLY 381.A N ARG 377.A O no hydrogen 3.016 N/A ALA 382.A N TYR 379.A O no hydrogen 3.155 N/A ILE 383.A N HIS 380.A O no hydrogen 2.893 N/A GLY 384.A N HIS 380.A O no hydrogen 3.336 N/A ARG 385.A N GLY 381.A O no hydrogen 2.897 N/A ARG 385.A NH1 GLY 386.A O no hydrogen 3.176 N/A GLY 386.A N ILE 383.A O no hydrogen 3.105 N/A ALA 388.A N ALA 382.A O no hydrogen 3.377 N/A THR 391.A OG1 ARG 613.A O no hydrogen 3.205 N/A ALA 393.A N VAL 629.A O no hydrogen 3.258 N/A VAL 394.A N GLN 615.A O no hydrogen 2.916 N/A LEU 395.A N ALA 631.A O no hydrogen 2.921 N/A VAL 396.A N LEU 617.A O no hydrogen 3.384 N/A ARG 398.A NE ASP 401.A OD2 no hydrogen 2.524 N/A MET 405.A N ALA 402.A O no hydrogen 3.264 N/A ALA 406.A N ALA 403.A O no hydrogen 2.957 N/A ALA 408.A N PRO 404.A O no hydrogen 2.941 N/A LEU 409.A N ALA 406.A O no hydrogen 3.382 N/A THR 410.A N ALA 406.A O no hydrogen 2.868 N/A ARG 412.A N LEU 409.A O no hydrogen 3.056 N/A GLY 413.A N LEU 409.A O no hydrogen 2.528 N/A VAL 416.A N VAL 614.A O no hydrogen 3.432 N/A ALA 423.A N GLY 420.A O no hydrogen 3.041 N/A VAL 427.A N VAL 424.A O no hydrogen 2.818 N/A ALA 428.A N VAL 424.A O no hydrogen 2.968 N/A VAL 431.A N VAL 427.A O no hydrogen 2.918 N/A ALA 432.A N ALA 428.A O no hydrogen 2.889 N/A MET 433.A N ASP 429.A O no hydrogen 2.898 N/A LEU 434.A N LEU 430.A O no hydrogen 2.966 N/A ARG 435.A N VAL 431.A O no hydrogen 2.905 N/A LEU 436.A N ALA 432.A O no hydrogen 2.936 N/A ILE 437.A N MET 433.A O no hydrogen 2.958 N/A ALA 438.A N LEU 434.A O no hydrogen 2.928 N/A ASP 439.A N ARG 435.A O no hydrogen 2.952 N/A ALA 442.A N PRO 440.A O no hydrogen 2.700 N/A ALA 445.A N ALA 442.A O no hydrogen 3.152 N/A VAL 446.A N ALA 442.A O no hydrogen 2.960 N/A MET 447.A N GLY 443.A O no hydrogen 2.953 N/A ARG 448.A NE ASP 429.A OD1 no hydrogen 2.856 N/A ARG 448.A NH2 ASP 429.A OD1 no hydrogen 3.526 N/A ILE 449.A N ALA 445.A O no hydrogen 3.001 N/A LEU 450.A N VAL 446.A O no hydrogen 2.854 N/A THR 451.A N MET 447.A O no hydrogen 2.925 N/A THR 451.A OG1 MET 447.A O no hydrogen 2.934 N/A GLY 452.A N ILE 449.A O no hydrogen 3.330 N/A ARG 454.A NH1 GLU 522.A OE1 no hydrogen 2.928 N/A ARG 454.A NH1 GLU 522.A OE2 no hydrogen 3.111 N/A ILE 462.A N GLY 458.A O no hydrogen 2.964 N/A ALA 463.A N ALA 459.A O no hydrogen 2.900 N/A ALA 464.A N ARG 460.A O no hydrogen 2.922 N/A LEU 465.A N ASP 461.A O no hydrogen 2.878 N/A TRP 466.A N ILE 462.A O no hydrogen 2.929 N/A ARG 467.A N ALA 463.A O no hydrogen 2.871 N/A ARG 468.A N ALA 464.A O no hydrogen 2.976 N/A ARG 468.A NE ASP 501.A O no hydrogen 2.973 N/A ARG 468.A NE PRO 502.A O no hydrogen 2.909 N/A ARG 468.A NH2 ASP 501.A O no hydrogen 3.211 N/A ALA 469.A N LEU 465.A O no hydrogen 2.916 N/A VAL 470.A N TRP 466.A O no hydrogen 2.906 N/A GLU 471.A N ARG 467.A O no hydrogen 2.935 N/A LEU 472.A N ARG 468.A O no hydrogen 2.919 N/A ASP 473.A N VAL 470.A O no hydrogen 3.282 N/A GLY 478.A N ASP 481.A OD2 no hydrogen 3.249 N/A ILE 482.A N GLY 478.A O no hydrogen 2.777 N/A VAL 483.A N THR 479.A O no hydrogen 2.931 N/A ALA 484.A N ALA 480.A O no hydrogen 3.042 N/A GLN 485.A N ASP 481.A O no hydrogen 3.278 N/A CYS 494.A SG ASP 497.A OD2 no hydrogen 3.402 N/A ASP 497.A N CYS 494.A O no hydrogen 3.142 N/A ILE 499.A N VAL 495.A O no hydrogen 3.402 N/A CYS 500.A N ASP 497.A O no hydrogen 3.197 N/A CYS 500.A SG ALA 496.A O no hydrogen 3.759 N/A ASP 501.A N ASP 497.A O no hydrogen 3.058 N/A ARG 507.A NH2 GLU 471.A OE1 no hydrogen 3.331 N/A TYR 508.A OH PRO 502.A O no hydrogen 2.444 N/A TYR 513.A N SER 509.A O no hydrogen 3.017 N/A ARG 515.A NH1 ARG 456.A O no hydrogen 3.103 N/A ILE 516.A N GLY 512.A O no hydrogen 3.341 N/A VAL 517.A N TYR 513.A O no hydrogen 2.962 N/A ALA 518.A N GLU 514.A O no hydrogen 2.910 N/A LEU 519.A N ARG 515.A O no hydrogen 2.893 N/A GLY 520.A N ILE 516.A O no hydrogen 2.936 N/A ARG 521.A N VAL 517.A O no hydrogen 2.955 N/A GLU 522.A N ALA 518.A O no hydrogen 2.931 N/A LEU 523.A N LEU 519.A O no hydrogen 2.908 N/A THR 524.A N GLY 520.A O no hydrogen 2.929 N/A THR 524.A OG1 GLY 520.A O no hydrogen 2.876 N/A MET 525.A N ARG 521.A O no hydrogen 2.894 N/A LEU 526.A N GLU 522.A O no hydrogen 2.960 N/A ARG 527.A N LEU 523.A O no hydrogen 2.875 N/A ARG 527.A NH2 LEU 436.A O no hydrogen 3.019 N/A ALA 528.A N MET 525.A O no hydrogen 3.394 N/A HIS 529.A N LEU 526.A O no hydrogen 2.639 N/A HIS 532.A N HIS 529.A O no hydrogen 2.754 N/A GLU 536.A N PRO 533.A O no hydrogen 3.181 N/A LEU 537.A N PRO 533.A O no hydrogen 2.956 N/A VAL 538.A N LEU 534.A O no hydrogen 3.019 N/A GLU 540.A N GLU 536.A O no hydrogen 2.950 N/A VAL 541.A N LEU 537.A O no hydrogen 2.950 N/A ARG 542.A N VAL 538.A O no hydrogen 2.977 N/A ARG 543.A N ALA 539.A O no hydrogen 2.903 N/A VAL 544.A N GLU 540.A O no hydrogen 2.946 N/A LEU 545.A N VAL 541.A O no hydrogen 2.964 N/A GLU 550.A N GLY 546.A O no hydrogen 2.953 N/A ALA 551.A N LEU 547.A O no hydrogen 2.885 N/A ARG 552.A N ALA 549.A O no hydrogen 3.090 N/A ALA 553.A N ALA 549.A O no hydrogen 2.975 N/A TRP 561.A NE1 GLU 787.A OE2 no hydrogen 3.076 N/A GLY 563.A N GLU 565.A OE1 no hydrogen 2.786 N/A THR 564.A OG1 ASP 548.A OD1 no hydrogen 3.543 N/A GLU 565.A N GLU 565.A OE1 no hydrogen 2.420 N/A ASN 566.A ND2 GLU 426.A OE2 no hydrogen 3.507 N/A ASP 568.A N THR 564.A O no hydrogen 2.936 N/A ARG 569.A N GLU 565.A O no hydrogen 2.873 N/A PHE 570.A N ASN 566.A O no hydrogen 2.927 N/A SER 571.A N LEU 567.A O no hydrogen 2.912 N/A ASP 572.A N ASP 568.A O no hydrogen 2.888 N/A LEU 573.A N ARG 569.A O no hydrogen 2.917 N/A VAL 574.A N PHE 570.A O no hydrogen 2.911 N/A SER 575.A N SER 571.A O no hydrogen 2.896 N/A ASP 576.A N LEU 573.A O no hydrogen 3.089 N/A PHE 577.A N LEU 573.A O no hydrogen 2.865 N/A ALA 578.A N VAL 574.A O no hydrogen 3.030 N/A SER 584.A OG GLY 582.A O no hydrogen 3.155 N/A SER 584.A OG ALA 583.A O no hydrogen 2.445 N/A ALA 587.A N SER 584.A O no hydrogen 3.112 N/A LEU 588.A N SER 584.A O no hydrogen 2.886 N/A TYR 591.A N ALA 587.A O no hydrogen 3.381 N/A LEU 592.A N LEU 588.A O no hydrogen 2.869 N/A ASP 593.A N LEU 589.A O no hydrogen 2.922 N/A ALA 594.A N ALA 590.A O no hydrogen 2.979 N/A ALA 595.A N TYR 591.A O no hydrogen 2.890 N/A VAL 596.A N LEU 592.A O no hydrogen 2.909 N/A GLU 597.A N ASP 593.A O no hydrogen 2.963 N/A VAL 598.A N ALA 594.A O no hydrogen 3.120 N/A ALA 605.A N ASN 566.A OD1 no hydrogen 3.372 N/A SER 610.A OG SER 610.A O no hydrogen 2.467 N/A ARG 613.A NH1 HIS 611.A O no hydrogen 2.995 N/A VAL 614.A N VAL 414.A O no hydrogen 3.318 N/A GLN 615.A N ALA 392.A O no hydrogen 3.293 N/A VAL 619.A N VAL 396.A O no hydrogen 2.885 N/A LYS 623.A NZ GLN 296.A O no hydrogen 3.301 N/A GLN 628.A NE2 PRO 390.A O no hydrogen 2.497 N/A VAL 630.A N THR 711.A O no hydrogen 3.402 N/A SER 636.A OG GLY 728.A O no hydrogen 3.318 N/A ALA 637.A N SER 636.A OG no hydrogen 2.570 N/A SER 642.A OG VAL 639.A O no hydrogen 2.483 N/A SER 642.A OG PHE 640.A O no hydrogen 3.495 N/A THR 643.A OG1 THR 643.A O no hydrogen 2.578 N/A THR 643.A OG1 ASP 690.A OD1 no hydrogen 3.239 N/A THR 644.A OG1 GLN 645.A OE1 no hydrogen 2.225 N/A ARG 647.A NE ASP 652.A OD1 no hydrogen 3.541 N/A TRP 649.A NE1 HIS 685.A NE2 no hydrogen 2.823 N/A LEU 650.A N THR 648.A OG1 no hydrogen 3.405 N/A ASP 652.A N THR 648.A O no hydrogen 3.261 N/A SER 654.A N ASP 652.A OD2 no hydrogen 3.013 N/A SER 654.A OG ASP 652.A OD2 no hydrogen 2.340 N/A LEU 660.A N PRO 657.A O no hydrogen 3.074 N/A ARG 661.A N PRO 657.A O no hydrogen 2.894 N/A ARG 661.A N PRO 658.A O no hydrogen 3.289 N/A ARG 664.A N ARG 661.A O no hydrogen 2.630 N/A ARG 664.A NH1 LEU 659.A O no hydrogen 2.824 N/A THR 666.A OG1 GLU 667.A OE1 no hydrogen 2.715 N/A GLU 667.A N GLU 667.A OE1 no hydrogen 2.493 N/A SER 679.A N ARG 675.A O no hydrogen 2.491 N/A SER 679.A OG ARG 675.A O no hydrogen 3.229 N/A SER 679.A OG LYS 676.A O no hydrogen 3.090 N/A ASP 680.A N LYS 676.A O no hydrogen 3.275 N/A LYS 681.A N ILE 677.A O no hydrogen 3.118 N/A ILE 682.A N LEU 678.A O no hydrogen 2.962 N/A SER 683.A OG ASP 680.A O no hydrogen 2.983 N/A ASP 684.A N ASP 680.A O no hydrogen 3.323 N/A HIS 685.A N LYS 681.A O no hydrogen 3.273 N/A LYS 686.A N ILE 682.A O no hydrogen 2.851 N/A LYS 687.A N SER 683.A O no hydrogen 2.908 N/A SER 688.A N ASP 684.A O no hydrogen 2.935 N/A SER 688.A OG GLU 667.A OE2 no hydrogen 2.893 N/A LEU 689.A N HIS 685.A O no hydrogen 2.866 N/A ASP 690.A N LYS 687.A O no hydrogen 3.030 N/A GLN 691.A N LYS 687.A O no hydrogen 3.135 N/A ARG 693.A N ASP 690.A O no hydrogen 2.750 N/A VAL 694.A N ASP 690.A O no hydrogen 3.350 N/A ASP 695.A N GLN 691.A O no hydrogen 2.895 N/A GLU 696.A N ARG 692.A O no hydrogen 2.922 N/A GLU 696.A N ARG 693.A O no hydrogen 3.058 N/A GLU 697.A N VAL 694.A O no hydrogen 2.766 N/A ARG 698.A N VAL 694.A O no hydrogen 3.277 N/A ARG 698.A NH2 ALA 339.A O no hydrogen 3.478 N/A ARG 699.A NE SER 297.A O no hydrogen 3.072 N/A LEU 701.A N GLU 697.A O no hydrogen 2.777 N/A TYR 702.A N ARG 698.A O no hydrogen 2.532 N/A VAL 703.A N ARG 699.A O no hydrogen 2.912 N/A ALA 704.A N LEU 700.A O no hydrogen 2.897 N/A ILE 705.A N LEU 701.A O no hydrogen 2.890 N/A THR 706.A N TYR 702.A O no hydrogen 2.923 N/A THR 706.A OG1 TYR 702.A O no hydrogen 2.769 N/A ARG 707.A N ALA 704.A O no hydrogen 3.251 N/A ALA 708.A N ILE 705.A O no hydrogen 2.959 N/A GLU 709.A N GLN 628.A O no hydrogen 3.172 N/A LEU 712.A N THR 355.A O no hydrogen 3.317 N/A LEU 713.A N VAL 630.A O no hydrogen 3.395 N/A SER 715.A N VAL 632.A O no hydrogen 3.213 N/A SER 715.A OG PRO 633.A O no hydrogen 3.056 N/A GLY 716.A N ALA 359.A O no hydrogen 2.769 N/A TRP 719.A N PRO 726.A O no hydrogen 3.025 N/A THR 722.A OG1 ALA 721.A O no hydrogen 2.566 N/A ARG 727.A NH1 GLU 723.A OE2 no hydrogen 3.563 N/A SER 730.A N LEU 635.A O no hydrogen 3.464 N/A SER 730.A OG LEU 635.A O no hydrogen 3.147 N/A SER 730.A OG SER 636.A O no hydrogen 3.048 N/A SER 730.A OG GLU 731.A O no hydrogen 2.449 N/A LYS 737.A N LEU 733.A O no hydrogen 2.447 N/A THR 738.A N CYS 734.A O no hydrogen 2.938 N/A THR 738.A OG1 CYS 734.A O no hydrogen 3.502 N/A ILE 739.A N GLU 735.A O no hydrogen 2.903 N/A LEU 740.A N LEU 736.A O no hydrogen 2.905 N/A GLU 741.A N LYS 737.A O no hydrogen 2.924 N/A GLU 747.A N ILE 356.A O no hydrogen 2.926 N/A ALA 752.A N LEU 360.A O no hydrogen 2.679 N/A ARG 758.A NH2 PRO 756.A O no hydrogen 3.234 N/A ARG 774.A N ASP 770.A O no hydrogen 2.917 N/A GLY 775.A N HIS 771.A O no hydrogen 2.910 N/A ALA 776.A N VAL 772.A O no hydrogen 2.867 N/A GLN 777.A N HIS 773.A O no hydrogen 2.921 N/A LEU 778.A N ARG 774.A O no hydrogen 2.901 N/A VAL 779.A N GLY 775.A O no hydrogen 2.893 N/A ALA 780.A N ALA 776.A O no hydrogen 2.899 N/A ALA 781.A N GLN 777.A O no hydrogen 2.896 N/A ALA 782.A N LEU 778.A O no hydrogen 2.921 N/A MET 783.A N VAL 779.A O no hydrogen 2.900 N/A ALA 784.A N ALA 780.A O no hydrogen 2.914 N/A GLY 785.A N ALA 781.A O no hydrogen 2.894 N/A ASP 792.A N GLY 788.A O no hydrogen 3.444 N/A VAL 793.A N TRP 789.A O no hydrogen 2.906 N/A ASP 794.A N ALA 790.A O no hydrogen 2.917 N/A ALA 795.A N ALA 791.A O no hydrogen 2.896 N/A LEU 796.A N ASP 792.A O no hydrogen 2.944 N/A LEU 797.A N VAL 793.A O no hydrogen 2.936 N/A ALA 798.A N ASP 794.A O no hydrogen 2.879 N/A GLU 799.A N ALA 795.A O no hydrogen 2.946 N/A ARG 800.A N LEU 796.A O no hydrogen 2.936 N/A GLU 801.A N LEU 797.A O no hydrogen 2.925 N/A