Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6dmb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.A N ALA 3.A O no hydrogen 3.044 N/A ARG 8.A N PRO 4.A O no hydrogen 2.852 N/A ALA 9.A N LEU 5.A O no hydrogen 2.850 N/A LYS 10.A N TRP 6.A O no hydrogen 2.988 N/A GLN 12.A N ARG 8.A O no hydrogen 2.914 N/A GLN 12.A NE2 LYS 470.A O no hydrogen 3.178 N/A ARG 13.A N ALA 9.A O no hydrogen 2.890 N/A LEU 14.A N LYS 10.A O no hydrogen 2.989 N/A LEU 15.A N PHE 11.A O no hydrogen 2.946 N/A PHE 16.A N GLN 12.A O no hydrogen 2.844 N/A LYS 17.A N ARG 13.A O no hydrogen 2.978 N/A LEU 18.A N LEU 14.A O no hydrogen 3.008 N/A GLY 19.A N LEU 15.A O no hydrogen 2.934 N/A CYS 20.A N PHE 16.A O no hydrogen 2.970 N/A CYS 20.A SG PHE 16.A O no hydrogen 3.305 N/A TYR 21.A N LYS 17.A O no hydrogen 2.993 N/A ILE 22.A N LEU 18.A O no hydrogen 2.968 N/A GLN 23.A N GLY 19.A O no hydrogen 2.930 N/A LYS 24.A N CYS 20.A O no hydrogen 3.008 N/A ASN 25.A N ILE 22.A O no hydrogen 3.034 N/A CYS 26.A SG ALA 522.A O no hydrogen 3.691 N/A CYS 26.A SG SER 525.A OG no hydrogen 3.409 N/A VAL 31.A N GLY 27.A O no hydrogen 3.001 N/A VAL 32.A N LYS 28.A O no hydrogen 2.935 N/A GLY 33.A N PHE 29.A O no hydrogen 2.946 N/A LEU 34.A N LEU 30.A O no hydrogen 2.955 N/A LEU 35.A N VAL 31.A O no hydrogen 2.949 N/A ILE 36.A N VAL 32.A O no hydrogen 2.981 N/A PHE 37.A N GLY 33.A O no hydrogen 3.028 N/A ALA 39.A N LEU 35.A O no hydrogen 2.938 N/A PHE 40.A N ILE 36.A O no hydrogen 3.031 N/A ALA 41.A N PHE 37.A O no hydrogen 2.959 N/A VAL 42.A N GLY 38.A O no hydrogen 2.898 N/A GLY 43.A N ALA 39.A O no hydrogen 3.011 N/A LEU 44.A N ALA 41.A O no hydrogen 3.327 N/A THR 51.A OG1 THR 51.A O no hydrogen 2.567 N/A THR 51.A OG1 ASP 356.A OD1 no hydrogen 3.432 N/A GLU 55.A N ASN 52.A O no hydrogen 2.995 N/A LEU 56.A N ASN 52.A O no hydrogen 3.257 N/A GLY 61.A N SER 65.A OG no hydrogen 3.390 N/A LEU 68.A N VAL 64.A O no hydrogen 3.200 N/A ASN 69.A N SER 65.A O no hydrogen 2.927 N/A TYR 70.A N ARG 66.A O no hydrogen 2.954 N/A TYR 70.A OH GLU 775.A O no hydrogen 2.715 N/A THR 71.A N GLU 67.A O no hydrogen 2.944 N/A THR 71.A OG1 GLU 67.A O no hydrogen 2.920 N/A THR 71.A OG1 TYR 814.A OH no hydrogen 2.588 N/A ARG 72.A N LEU 68.A O no hydrogen 2.892 N/A GLN 73.A N TYR 70.A O no hydrogen 3.297 N/A LYS 74.A N TYR 70.A O no hydrogen 2.994 N/A LYS 74.A NZ GLU 775.A OE1 no hydrogen 3.321 N/A ILE 75.A N THR 71.A O no hydrogen 2.827 N/A GLU 78.A N GLU 78.A OE1 no hydrogen 2.646 N/A ASN 82.A N LEU 294.A O no hydrogen 2.931 N/A GLN 84.A NE2 ASN 82.A O no hydrogen 2.359 N/A MET 86.A N THR 290.A O no hydrogen 2.997 N/A GLN 88.A N LEU 288.A O no hydrogen 3.049 N/A GLN 88.A NE2 THR 89.A O no hydrogen 3.106 N/A THR 89.A N LYS 346.A O no hydrogen 3.081 N/A ASN 96.A ND2 SER 284.A OG no hydrogen 2.538 N/A VAL 97.A N ALA 285.A O no hydrogen 3.111 N/A LEU 98.A N ASN 96.A O no hydrogen 2.766 N/A ALA 102.A N THR 99.A OG1 no hydrogen 3.115 N/A LEU 103.A N THR 99.A O no hydrogen 2.928 N/A LEU 104.A N THR 100.A O no hydrogen 2.851 N/A GLN 105.A N GLU 101.A O no hydrogen 2.866 N/A GLN 105.A NE2 SER 338.A O no hydrogen 3.537 N/A HIS 106.A N ALA 102.A O no hydrogen 2.908 N/A LEU 107.A N LEU 103.A O no hydrogen 2.820 N/A ASP 108.A N LEU 104.A O no hydrogen 2.881 N/A SER 109.A N GLN 105.A O no hydrogen 2.892 N/A SER 109.A OG GLN 105.A O no hydrogen 2.609 N/A ALA 110.A N HIS 106.A O no hydrogen 2.900 N/A LEU 111.A N LEU 107.A O no hydrogen 2.816 N/A GLN 112.A N ASP 108.A O no hydrogen 2.904 N/A ALA 113.A N SER 109.A O no hydrogen 2.931 N/A SER 114.A N LEU 111.A O no hydrogen 3.030 N/A SER 114.A OG LEU 111.A O no hydrogen 2.507 N/A ARG 115.A N LEU 111.A O no hydrogen 3.337 N/A VAL 118.A N TRP 125.A O no hydrogen 3.365 N/A MET 120.A N ARG 123.A O no hydrogen 3.403 N/A ASN 122.A ND2 ASN 122.A O no hydrogen 2.772 N/A TRP 125.A N VAL 118.A O no hydrogen 3.219 N/A LEU 130.A N LEU 127.A O no hydrogen 2.992 N/A TYR 143.A N THR 141.A O no hydrogen 2.882 N/A ILE 148.A N MET 144.A O no hydrogen 2.885 N/A GLU 149.A N ASP 145.A O no hydrogen 2.928 N/A TYR 150.A N GLN 146.A O no hydrogen 2.900 N/A LEU 151.A N ILE 148.A O no hydrogen 2.786 N/A ILE 157.A N MET 291.A O no hydrogen 3.179 N/A THR 158.A OG1 ILE 156.A O no hydrogen 2.762 N/A THR 158.A OG1 THR 290.A OG1 no hydrogen 3.395 N/A TRP 164.A N PRO 223.A O no hydrogen 2.411 N/A TRP 164.A NE1 THR 185.A O no hydrogen 3.064 N/A ALA 167.A N TRP 164.A O no hydrogen 3.142 N/A LYS 168.A N GLU 165.A O no hydrogen 2.752 N/A GLN 170.A N ALA 167.A O no hydrogen 2.956 N/A SER 171.A OG SER 171.A O no hydrogen 2.621 N/A THR 173.A OG1 GLY 172.A O no hydrogen 2.626 N/A PHE 192.A N ASP 188.A O no hydrogen 3.049 N/A LEU 193.A N PRO 189.A O no hydrogen 2.874 N/A GLU 194.A N LEU 190.A O no hydrogen 2.856 N/A GLU 195.A N GLU 191.A O no hydrogen 2.927 N/A LEU 196.A N PHE 192.A O no hydrogen 2.920 N/A LYS 197.A N GLU 194.A O no hydrogen 2.994 N/A LYS 198.A N GLU 194.A O no hydrogen 2.945 N/A LYS 198.A NZ GLU 194.A OE2 no hydrogen 3.186 N/A ASN 200.A N LYS 198.A O no hydrogen 2.939 N/A VAL 203.A N GLN 202.A OE1 no hydrogen 2.936 N/A MET 209.A N SER 205.A O no hydrogen 2.935 N/A LEU 210.A N TRP 206.A O no hydrogen 2.919 N/A ASN 211.A N GLU 207.A O no hydrogen 2.996 N/A LYS 212.A N GLU 208.A O no hydrogen 2.898 N/A ALA 213.A N LEU 210.A O no hydrogen 3.112 N/A VAL 215.A N LEU 210.A O no hydrogen 3.476 N/A HIS 217.A N ASP 221.A OD2 no hydrogen 3.436 N/A ARG 222.A NH1 GLY 218.A O no hydrogen 2.347 N/A ARG 222.A NH2 HIS 256.A O no hydrogen 3.567 N/A CYS 224.A SG ASN 226.A O no hydrogen 3.775 N/A ASP 231.A N ASP 229.A OD2 no hydrogen 2.753 N/A THR 235.A OG1 MET 220.A O no hydrogen 3.513 N/A ALA 236.A N PRO 233.A O no hydrogen 3.295 N/A LYS 239.A N ALA 236.A O no hydrogen 3.468 N/A LYS 239.A NZ CYS 232.A O no hydrogen 2.416 N/A LYS 243.A N SER 241.A O no hydrogen 2.652 N/A ASN 252.A N VAL 250.A O no hydrogen 2.813 N/A CYS 255.A SG PRO 159.A O no hydrogen 3.196 N/A GLY 257.A N MET 263.A O no hydrogen 3.136 N/A SER 259.A N GLY 257.A O no hydrogen 2.736 N/A ARG 260.A N GLU 214.A O no hydrogen 3.343 N/A ARG 260.A NH2 ASP 221.A OD2 no hydrogen 3.547 N/A MET 263.A N SER 259.A O no hydrogen 3.068 N/A GLN 266.A N GLN 266.A OE1 no hydrogen 2.969 N/A GLN 266.A NE2 GLU 640.A OE1 no hydrogen 3.177 N/A GLN 266.A NE2 GLU 640.A OE2 no hydrogen 2.865 N/A GLU 268.A N GLU 268.A OE1 no hydrogen 3.030 N/A LEU 269.A N GLN 266.A O no hydrogen 3.156 N/A VAL 271.A N GLU 267.A O no hydrogen 3.403 N/A GLY 272.A N ALA 287.A O no hydrogen 2.439 N/A THR 274.A OG1 GLY 272.A O no hydrogen 2.406 N/A VAL 275.A N SER 284.A O no hydrogen 3.387 N/A VAL 283.A N VAL 275.A O no hydrogen 3.057 N/A HIS 286.A ND1 GLY 273.A O no hydrogen 2.811 N/A LEU 288.A N GLN 88.A O no hydrogen 3.385 N/A GLN 289.A N ILE 270.A O no hydrogen 2.685 N/A THR 290.A OG1 ILE 157.A O no hydrogen 2.473 N/A THR 290.A OG1 THR 158.A OG1 no hydrogen 3.395 N/A MET 291.A N ILE 157.A O no hydrogen 2.959 N/A LEU 294.A N ASN 82.A O no hydrogen 3.370 N/A LYS 298.A NZ GLU 77.A OE2 no hydrogen 2.535 N/A GLN 299.A N THR 296.A OG1 no hydrogen 3.095 N/A MET 300.A N THR 296.A O no hydrogen 2.822 N/A TYR 301.A N PRO 297.A O no hydrogen 2.962 N/A GLU 302.A N LYS 298.A O no hydrogen 2.920 N/A HIS 303.A N GLN 299.A O no hydrogen 2.857 N/A PHE 304.A N MET 300.A O no hydrogen 2.665 N/A SER 311.A OG SER 311.A O no hydrogen 2.469 N/A ALA 320.A N ASN 316.A O no hydrogen 3.350 N/A ALA 321.A N GLU 317.A O no hydrogen 2.938 N/A ALA 322.A N ASP 318.A O no hydrogen 2.941 N/A ILE 323.A N LYS 319.A O no hydrogen 2.956 N/A LEU 324.A N ALA 320.A O no hydrogen 2.967 N/A GLU 325.A N ALA 321.A O no hydrogen 2.913 N/A ALA 326.A N ALA 322.A O no hydrogen 2.912 N/A TRP 327.A N ILE 323.A O no hydrogen 2.916 N/A TRP 327.A NE1 VAL 116.A O no hydrogen 3.148 N/A GLN 328.A N LEU 324.A O no hydrogen 2.967 N/A ARG 329.A N GLU 325.A O no hydrogen 2.934 N/A THR 330.A N ALA 326.A O no hydrogen 2.968 N/A THR 330.A OG1 ALA 326.A O no hydrogen 2.725 N/A TYR 331.A N TRP 327.A O no hydrogen 2.840 N/A VAL 332.A N GLN 328.A O no hydrogen 3.017 N/A VAL 334.A N THR 330.A O no hydrogen 3.026 N/A VAL 335.A N TYR 331.A O no hydrogen 2.943 N/A HIS 336.A N VAL 332.A O no hydrogen 2.916 N/A GLN 337.A N GLU 333.A O no hydrogen 2.997 N/A SER 338.A N VAL 335.A O no hydrogen 3.372 N/A SER 338.A OG VAL 334.A O no hydrogen 3.123 N/A SER 338.A OG VAL 335.A O no hydrogen 3.273 N/A LYS 346.A N THR 89.A O no hydrogen 3.196 N/A LYS 346.A NZ THR 89.A OG1 no hydrogen 3.141 N/A LYS 346.A NZ ASP 594.A OD2 no hydrogen 2.937 N/A LEU 348.A N ILE 87.A O no hydrogen 3.146 N/A THR 353.A N THR 351.A OG1 no hydrogen 2.977 N/A THR 353.A OG1 GLU 325.A OE1 no hydrogen 2.613 N/A THR 353.A OG1 GLN 328.A OE1 no hydrogen 2.970 N/A THR 354.A N THR 351.A OG1 no hydrogen 3.082 N/A ASP 357.A N THR 353.A O no hydrogen 2.853 N/A ILE 358.A N THR 354.A O no hydrogen 2.914 N/A LEU 359.A N LEU 355.A O no hydrogen 2.997 N/A LYS 360.A N ASP 356.A O no hydrogen 2.860 N/A SER 361.A N ASP 357.A O no hydrogen 2.899 N/A PHE 362.A N ILE 358.A O no hydrogen 2.863 N/A SER 363.A N LEU 359.A O no hydrogen 2.891 N/A SER 363.A OG LEU 359.A O no hydrogen 3.038 N/A ALA 371.A N VAL 367.A O no hydrogen 2.944 N/A SER 372.A N ILE 368.A O no hydrogen 2.871 N/A GLY 373.A N ARG 369.A O no hydrogen 2.933 N/A TYR 374.A N VAL 370.A O no hydrogen 2.987 N/A TYR 374.A OH PRO 432.A O no hydrogen 2.592 N/A LEU 375.A N ALA 371.A O no hydrogen 2.920 N/A LEU 376.A N SER 372.A O no hydrogen 2.894 N/A MET 377.A N GLY 373.A O no hydrogen 2.924 N/A LEU 378.A N TYR 374.A O no hydrogen 2.938 N/A ALA 379.A N LEU 375.A O no hydrogen 3.233 N/A TYR 380.A N MET 377.A O no hydrogen 3.135 N/A ALA 381.A N MET 377.A O no hydrogen 2.920 N/A CYS 382.A N LEU 378.A O no hydrogen 2.952 N/A THR 384.A N TYR 380.A O no hydrogen 2.929 N/A THR 384.A OG1 TYR 380.A O no hydrogen 2.317 N/A MET 385.A N CYS 382.A O no hydrogen 3.354 N/A SER 391.A OG CYS 390.A O no hydrogen 2.591 N/A ALA 400.A N ALA 396.A O no hydrogen 2.960 N/A GLY 401.A N GLY 398.A O no hydrogen 3.237 N/A VAL 402.A N GLY 398.A O no hydrogen 2.983 N/A VAL 405.A N GLY 401.A O no hydrogen 2.896 N/A ALA 406.A N VAL 402.A O no hydrogen 2.961 N/A LEU 407.A N LEU 403.A O no hydrogen 2.875 N/A SER 408.A N LEU 404.A O no hydrogen 2.908 N/A VAL 409.A N VAL 405.A O no hydrogen 2.924 N/A ALA 410.A N ALA 406.A O no hydrogen 2.969 N/A ALA 411.A N LEU 407.A O no hydrogen 2.948 N/A ALA 411.A N SER 408.A O no hydrogen 3.220 N/A GLY 412.A N SER 408.A O no hydrogen 2.885 N/A LEU 413.A N VAL 409.A O no hydrogen 2.962 N/A LEU 415.A N ALA 411.A O no hydrogen 2.929 N/A CYS 416.A N GLY 412.A O no hydrogen 2.982 N/A CYS 416.A SG GLY 412.A O no hydrogen 3.268 N/A SER 417.A N GLY 414.A O no hydrogen 3.278 N/A SER 417.A OG GLY 43.A O no hydrogen 3.181 N/A SER 417.A OG GLY 414.A O no hydrogen 2.734 N/A ILE 419.A N LEU 415.A O no hydrogen 3.425 N/A GLY 420.A N LEU 418.A O no hydrogen 2.786 N/A ILE 421.A N ILE 419.A O no hydrogen 2.572 N/A SER 422.A OG ASN 48.A O no hydrogen 2.338 N/A SER 422.A OG GLU 50.A OE2 no hydrogen 3.299 N/A SER 422.A OG PHE 423.A O no hydrogen 3.352 N/A PHE 423.A N ASN 48.A O no hydrogen 2.825 N/A THR 427.A OG1 GLN 504.A OE1 no hydrogen 2.779 N/A THR 428.A OG1 GLN 429.A OE1 no hydrogen 2.485 N/A VAL 430.A N THR 427.A O no hydrogen 3.250 N/A LEU 431.A N THR 427.A O no hydrogen 2.968 N/A PHE 433.A N VAL 430.A O no hydrogen 2.784 N/A LEU 434.A N LEU 431.A O no hydrogen 3.134 N/A ALA 435.A N LEU 431.A O no hydrogen 2.990 N/A GLY 437.A N LEU 434.A O no hydrogen 2.978 N/A GLY 439.A N ALA 435.A O no hydrogen 3.071 N/A VAL 440.A N LEU 436.A O no hydrogen 2.954 N/A ASP 441.A N GLY 437.A O no hydrogen 3.016 N/A ASP 442.A N VAL 438.A O no hydrogen 3.109 N/A VAL 443.A N GLY 439.A O no hydrogen 3.021 N/A PHE 444.A N VAL 440.A O no hydrogen 2.948 N/A LEU 445.A N ASP 441.A O no hydrogen 3.090 N/A LEU 446.A N ASP 442.A O no hydrogen 3.037 N/A ALA 447.A N VAL 443.A O no hydrogen 2.872 N/A HIS 448.A N PHE 444.A O no hydrogen 3.015 N/A ALA 449.A N LEU 445.A O no hydrogen 2.964 N/A PHE 450.A N LEU 446.A O no hydrogen 2.985 N/A SER 451.A N ALA 447.A O no hydrogen 2.949 N/A SER 451.A N HIS 448.A O no hydrogen 3.252 N/A LYS 457.A N ASN 456.A OD1 no hydrogen 2.632 N/A ARG 458.A N ASN 456.A OD1 no hydrogen 3.375 N/A CYS 468.A SG ALA 449.A O no hydrogen 3.663 N/A CYS 468.A SG GLU 467.A OE1 no hydrogen 3.620 N/A ARG 471.A N GLU 467.A O no hydrogen 2.990 N/A THR 472.A N LEU 469.A O no hydrogen 3.157 N/A THR 472.A OG1 CYS 468.A O no hydrogen 3.074 N/A GLY 473.A N LEU 469.A O no hydrogen 2.887 N/A VAL 476.A N THR 472.A O no hydrogen 3.040 N/A ALA 477.A N GLY 473.A O no hydrogen 2.947 N/A LEU 478.A N ALA 474.A O no hydrogen 2.941 N/A THR 479.A N SER 475.A O no hydrogen 3.045 N/A THR 479.A OG1 SER 475.A O no hydrogen 3.474 N/A THR 479.A OG1 VAL 476.A O no hydrogen 2.730 N/A SER 480.A N VAL 476.A O no hydrogen 3.020 N/A SER 480.A OG VAL 476.A O no hydrogen 3.474 N/A ILE 481.A N ALA 477.A O no hydrogen 2.980 N/A SER 482.A N LEU 478.A O no hydrogen 3.030 N/A SER 482.A OG LEU 478.A O no hydrogen 2.924 N/A SER 482.A OG THR 479.A O no hydrogen 2.629 N/A ASN 483.A N THR 479.A O no hydrogen 2.984 N/A VAL 484.A N SER 480.A O no hydrogen 2.990 N/A THR 485.A N ILE 481.A O no hydrogen 3.039 N/A THR 485.A OG1 ILE 481.A O no hydrogen 3.347 N/A PHE 487.A N ASN 483.A O no hydrogen 2.974 N/A PHE 488.A N VAL 484.A O no hydrogen 2.968 N/A MET 489.A N THR 485.A O no hydrogen 2.976 N/A ALA 490.A N ALA 486.A O no hydrogen 2.918 N/A ALA 491.A N PHE 487.A O no hydrogen 2.914 N/A LEU 498.A N ILE 495.A O no hydrogen 2.832 N/A ARG 499.A N ILE 495.A O no hydrogen 3.350 N/A ARG 499.A NE ALA 491.A O no hydrogen 3.466 N/A ARG 499.A NE ILE 493.A O no hydrogen 2.934 N/A ARG 499.A NH2 ILE 493.A O no hydrogen 2.631 N/A ALA 500.A N PRO 496.A O no hydrogen 2.934 N/A PHE 501.A N ALA 497.A O no hydrogen 2.942 N/A SER 502.A N LEU 498.A O no hydrogen 2.930 N/A SER 502.A OG LEU 498.A O no hydrogen 3.001 N/A SER 502.A OG ARG 499.A O no hydrogen 3.159 N/A LEU 503.A N ARG 499.A O no hydrogen 3.020 N/A ALA 505.A N PHE 501.A O no hydrogen 3.007 N/A ALA 506.A N SER 502.A O no hydrogen 2.976 N/A VAL 507.A N LEU 503.A O no hydrogen 2.990 N/A VAL 508.A N GLN 504.A O no hydrogen 2.989 N/A VAL 509.A N ALA 505.A O no hydrogen 2.985 N/A VAL 510.A N ALA 506.A O no hydrogen 3.014 N/A PHE 511.A N VAL 507.A O no hydrogen 3.006 N/A ASN 512.A N VAL 508.A O no hydrogen 2.850 N/A PHE 513.A N VAL 509.A O no hydrogen 2.928 N/A ALA 514.A N VAL 510.A O no hydrogen 3.018 N/A MET 515.A N PHE 511.A O no hydrogen 2.918 N/A VAL 516.A N ASN 512.A O no hydrogen 2.947 N/A LEU 517.A N PHE 513.A O no hydrogen 3.004 N/A LEU 518.A N ALA 514.A O no hydrogen 2.968 N/A ILE 519.A N VAL 516.A O no hydrogen 3.382 N/A PHE 520.A N VAL 516.A O no hydrogen 3.028 N/A ALA 522.A N ILE 519.A O no hydrogen 2.795 N/A ILE 523.A N ILE 519.A O no hydrogen 3.220 N/A LEU 524.A N PHE 520.A O no hydrogen 2.943 N/A SER 525.A OG GLN 23.A OE1 no hydrogen 3.249 N/A MET 526.A N ALA 522.A O no hydrogen 3.005 N/A ASP 527.A N ILE 523.A O no hydrogen 2.919 N/A LEU 528.A N LEU 524.A O no hydrogen 2.865 N/A TYR 529.A N SER 525.A O no hydrogen 2.984 N/A ARG 530.A N MET 526.A O no hydrogen 2.980 N/A ARG 530.A NE ARG 530.A O no hydrogen 3.537 N/A ARG 530.A NH2 ARG 535.A O no hydrogen 2.472 N/A ARG 531.A N ASP 527.A O no hydrogen 2.837 N/A PHE 540.A N THR 536.A O no hydrogen 2.931 N/A ALA 541.A N LEU 537.A O no hydrogen 2.819 N/A GLU 542.A N SER 538.A O no hydrogen 2.914 N/A HIS 544.A N PHE 540.A O no hydrogen 2.938 N/A TYR 545.A N GLU 542.A O no hydrogen 3.146 N/A ALA 546.A N GLU 542.A O no hydrogen 2.950 N/A PHE 548.A N TYR 545.A O no hydrogen 2.966 N/A LEU 549.A N ALA 546.A O no hydrogen 2.969 N/A ALA 554.A N LYS 551.A O no hydrogen 2.991 N/A LYS 555.A NZ LEU 549.A O no hydrogen 2.464 N/A PHE 560.A N VAL 556.A O no hydrogen 2.955 N/A LEU 561.A N VAL 557.A O no hydrogen 2.896 N/A PHE 562.A N VAL 558.A O no hydrogen 2.913 N/A LEU 563.A N ILE 559.A O no hydrogen 2.928 N/A GLY 564.A N PHE 560.A O no hydrogen 3.037 N/A LEU 565.A N LEU 561.A O no hydrogen 2.961 N/A LEU 566.A N PHE 562.A O no hydrogen 2.854 N/A GLY 567.A N LEU 563.A O no hydrogen 3.000 N/A VAL 568.A N GLY 564.A O no hydrogen 3.025 N/A SER 569.A N LEU 565.A O no hydrogen 2.940 N/A SER 569.A OG VAL 870.A O no hydrogen 2.664 N/A LEU 570.A N LEU 566.A O no hydrogen 2.929 N/A TYR 571.A N GLY 567.A O no hydrogen 3.068 N/A GLY 572.A N VAL 568.A O no hydrogen 2.997 N/A THR 573.A N SER 569.A O no hydrogen 2.861 N/A THR 573.A OG1 SER 569.A O no hydrogen 3.423 N/A THR 573.A OG1 LEU 570.A O no hydrogen 2.455 N/A THR 574.A N LEU 570.A O no hydrogen 3.022 N/A ARG 575.A N GLY 572.A O no hydrogen 3.257 N/A ARG 575.A NH2 THR 574.A O no hydrogen 3.486 N/A LEU 582.A N ASP 581.A OD1 no hydrogen 2.709 N/A ILE 585.A N LEU 582.A O no hydrogen 3.492 N/A THR 590.A OG1 PRO 587.A O no hydrogen 3.370 N/A ARG 591.A NE HIS 336.A ND1 no hydrogen 3.120 N/A GLU 592.A N GLU 592.A OE1 no hydrogen 2.704 N/A TYR 593.A N THR 590.A OG1 no hydrogen 3.001 N/A ASP 594.A N THR 590.A O no hydrogen 2.967 N/A PHE 595.A N ARG 591.A O no hydrogen 2.878 N/A ILE 596.A N GLU 592.A O no hydrogen 2.936 N/A ALA 597.A N TYR 593.A O no hydrogen 2.991 N/A ALA 598.A N ASP 594.A O no hydrogen 2.954 N/A GLN 599.A N PHE 595.A O no hydrogen 2.861 N/A PHE 600.A N ILE 596.A O no hydrogen 2.986 N/A LYS 601.A N ALA 597.A O no hydrogen 2.955 N/A TYR 602.A N ALA 598.A O no hydrogen 2.921 N/A TYR 602.A N GLN 599.A O no hydrogen 3.159 N/A PHE 603.A N GLN 599.A O no hydrogen 2.748 N/A SER 604.A OG ASN 784.A O no hydrogen 2.721 N/A SER 604.A OG ASN 784.A OD1 no hydrogen 3.482 N/A TYR 606.A N LEU 783.A O no hydrogen 3.099 N/A ASN 607.A ND2 PHE 781.A O no hydrogen 3.258 N/A MET 608.A N PHE 781.A O no hydrogen 3.170 N/A ILE 610.A N PHE 779.A O no hydrogen 3.335 N/A VAL 611.A N TYR 814.A O no hydrogen 3.339 N/A THR 612.A OG1 TYR 617.A OH no hydrogen 2.386 N/A THR 612.A OG1 ALA 777.A O no hydrogen 3.542 N/A GLN 613.A N SER 812.A O no hydrogen 3.222 N/A ASN 619.A N ASP 616.A O no hydrogen 2.646 N/A ASN 619.A ND2 ASP 616.A OD2 no hydrogen 2.717 N/A GLN 621.A NE2 TYR 617.A O no hydrogen 3.529 N/A LEU 624.A N GLN 621.A O no hydrogen 3.297 N/A ASP 626.A N HIS 622.A O no hydrogen 3.008 N/A LEU 627.A N LEU 623.A O no hydrogen 2.809 N/A HIS 628.A N LEU 624.A O no hydrogen 2.972 N/A ARG 629.A N TYR 625.A O no hydrogen 2.931 N/A SER 630.A N ASP 626.A O no hydrogen 2.884 N/A SER 630.A OG ASP 626.A O no hydrogen 2.803 N/A SER 630.A OG TYR 806.A OH no hydrogen 2.559 N/A PHE 631.A N LEU 627.A O no hydrogen 2.978 N/A SER 632.A N HIS 628.A O no hydrogen 2.986 N/A ASN 633.A N ARG 629.A O no hydrogen 2.992 N/A ASN 633.A N SER 630.A O no hydrogen 3.129 N/A ASN 633.A ND2 ASN 633.A O no hydrogen 2.645 N/A VAL 634.A N PHE 631.A O no hydrogen 3.345 N/A LYS 643.A N GLU 641.A O no hydrogen 2.862 N/A HIS 651.A N MET 648.A O no hydrogen 2.967 N/A PHE 653.A N TRP 649.A O no hydrogen 2.966 N/A ARG 654.A N LEU 650.A O no hydrogen 2.817 N/A ARG 654.A NE TYR 625.A OH no hydrogen 3.178 N/A ASP 655.A N HIS 651.A O no hydrogen 2.919 N/A TRP 656.A N TYR 652.A O no hydrogen 2.890 N/A LEU 657.A N PHE 653.A O no hydrogen 3.003 N/A GLN 658.A N ARG 654.A O no hydrogen 2.827 N/A GLY 659.A N ASP 655.A O no hydrogen 2.944 N/A LEU 660.A N TRP 656.A O no hydrogen 2.921 N/A GLN 661.A N LEU 657.A O no hydrogen 2.930 N/A ASP 662.A N GLN 658.A O no hydrogen 2.942 N/A ALA 663.A N GLY 659.A O no hydrogen 2.899 N/A PHE 664.A N LEU 660.A O no hydrogen 2.933 N/A ASP 665.A N GLN 661.A O no hydrogen 2.862 N/A SER 666.A N ASP 662.A O no hydrogen 2.911 N/A ASP 667.A N ALA 663.A O no hydrogen 2.897 N/A GLU 669.A N GLU 669.A OE1 no hydrogen 2.823 N/A THR 670.A N TRP 668.A O no hydrogen 2.751 N/A SER 682.A OG ASP 667.A OD1 no hydrogen 3.016 N/A SER 682.A OG ASP 667.A OD2 no hydrogen 3.133 N/A TYR 689.A N GLY 685.A O no hydrogen 2.447 N/A TYR 689.A OH ILE 673.A O no hydrogen 2.723 N/A TYR 689.A OH MET 674.A O no hydrogen 2.604 N/A LYS 690.A N VAL 686.A O no hydrogen 2.912 N/A LYS 690.A NZ THR 764.A O no hydrogen 2.950 N/A LEU 691.A N ALA 688.A O no hydrogen 3.324 N/A LEU 692.A N ALA 688.A O no hydrogen 2.867 N/A THR 695.A N PRO 701.A O no hydrogen 3.452 N/A ARG 698.A NE ARG 698.A O no hydrogen 3.187 N/A LEU 707.A N ILE 704.A O no hydrogen 3.064 N/A THR 708.A N SER 705.A O no hydrogen 3.263 N/A THR 708.A OG1 SER 705.A O no hydrogen 3.208 N/A LYS 709.A N GLN 706.A O no hydrogen 3.083 N/A ARG 711.A NE GLN 710.A O no hydrogen 2.435 N/A ARG 711.A NH1 GLN 710.A O no hydrogen 3.107 N/A ASN 720.A N GLN 621.A OE1 no hydrogen 2.897 N/A ASN 720.A ND2 LEU 712.A O no hydrogen 3.160 N/A SER 722.A OG PRO 618.A O no hydrogen 3.290 N/A SER 722.A OG ASN 720.A O no hydrogen 3.437 N/A TYR 725.A N ALA 723.A O no hydrogen 2.681 N/A THR 729.A OG1 ILE 726.A O no hydrogen 3.115 N/A TRP 731.A N TYR 727.A O no hydrogen 2.988 N/A VAL 732.A N LEU 728.A O no hydrogen 2.854 N/A SER 733.A N THR 729.A O no hydrogen 2.994 N/A SER 733.A OG THR 729.A O no hydrogen 3.189 N/A ASN 734.A N ALA 730.A O no hydrogen 2.924 N/A TYR 739.A N PRO 736.A O no hydrogen 2.889 N/A ALA 740.A N PRO 736.A O no hydrogen 2.907 N/A ALA 741.A N VAL 737.A O no hydrogen 2.876 N/A ALA 744.A N SER 742.A OG no hydrogen 3.245 N/A ILE 746.A N TYR 739.A OH no hydrogen 2.901 N/A LYS 757.A NZ TYR 678.A O no hydrogen 3.321 N/A MET 761.A N ASP 759.A OD2 no hydrogen 3.197 N/A THR 764.A OG1 MET 761.A O no hydrogen 2.266 N/A GLN 778.A NE2 GLN 743.A O no hydrogen 2.614 N/A PHE 781.A N MET 608.A O no hydrogen 2.706 N/A LEU 783.A N TYR 606.A O no hydrogen 3.126 N/A ASN 784.A N TYR 636.A O no hydrogen 3.252 N/A THR 789.A OG1 ASP 578.A O no hydrogen 3.545 N/A ASP 791.A N ASP 788.A O no hydrogen 2.702 N/A VAL 793.A N THR 789.A O no hydrogen 2.950 N/A GLU 794.A N SER 790.A O no hydrogen 2.918 N/A ALA 795.A N ASP 791.A O no hydrogen 2.920 N/A ILE 796.A N PHE 792.A O no hydrogen 2.903 N/A GLU 797.A N VAL 793.A O no hydrogen 2.936 N/A LYS 798.A N GLU 794.A O no hydrogen 2.953 N/A VAL 799.A N ALA 795.A O no hydrogen 3.035 N/A ARG 800.A N ILE 796.A O no hydrogen 2.926 N/A ARG 800.A NH1 GLU 67.A OE2 no hydrogen 2.404 N/A ARG 800.A NH2 GLU 67.A OE1 no hydrogen 3.293 N/A ARG 800.A NH2 GLU 67.A OE2 no hydrogen 3.204 N/A THR 801.A N GLU 797.A O no hydrogen 2.939 N/A THR 801.A OG1 GLU 797.A O no hydrogen 3.048 N/A THR 801.A OG1 LYS 798.A O no hydrogen 3.117 N/A CYS 803.A N VAL 799.A O no hydrogen 3.038 N/A CYS 803.A SG VAL 799.A O no hydrogen 3.433 N/A SER 804.A N ARG 800.A O no hydrogen 2.890 N/A SER 804.A OG ARG 800.A O no hydrogen 3.047 N/A SER 804.A OG THR 801.A O no hydrogen 3.066 N/A ASN 805.A N THR 801.A O no hydrogen 2.869 N/A TYR 806.A N ILE 802.A O no hydrogen 3.002 N/A TYR 806.A OH SER 630.A OG no hydrogen 2.559 N/A THR 807.A N CYS 803.A O no hydrogen 2.903 N/A THR 807.A OG1 CYS 803.A O no hydrogen 2.295 N/A SER 808.A OG ASN 805.A O no hydrogen 2.867 N/A GLY 810.A N THR 807.A O no hydrogen 3.478 N/A LEU 811.A N TYR 806.A O no hydrogen 3.182 N/A SER 813.A OG LEU 811.A O no hydrogen 3.555 N/A TYR 814.A N VAL 611.A O no hydrogen 3.219 N/A TYR 814.A OH THR 71.A OG1 no hydrogen 2.588 N/A ASN 816.A N TYR 609.A O no hydrogen 3.165 N/A LEU 821.A N GLY 817.A O no hydrogen 3.272 N/A PHE 822.A N TYR 818.A O no hydrogen 3.013 N/A TRP 823.A N PRO 819.A O no hydrogen 2.935 N/A TYR 826.A OH GLY 579.A O no hydrogen 2.275 N/A ILE 827.A N GLU 824.A O no hydrogen 3.313 N/A LEU 835.A N HIS 831.A O no hydrogen 2.957 N/A PHE 836.A N TRP 832.A O no hydrogen 3.038 N/A ILE 837.A N LEU 833.A O no hydrogen 2.902 N/A SER 838.A N LEU 834.A O no hydrogen 2.999 N/A VAL 839.A N LEU 835.A O no hydrogen 2.956 N/A VAL 840.A N PHE 836.A O no hydrogen 2.959 N/A LEU 841.A N ILE 837.A O no hydrogen 2.950 N/A ALA 842.A N SER 838.A O no hydrogen 2.975 N/A CYS 843.A N VAL 839.A O no hydrogen 2.948 N/A CYS 843.A SG VAL 839.A O no hydrogen 3.604 N/A CYS 843.A SG VAL 840.A O no hydrogen 3.253 N/A THR 844.A N VAL 840.A O no hydrogen 2.972 N/A LEU 846.A N ALA 842.A O no hydrogen 3.021 N/A VAL 847.A N CYS 843.A O no hydrogen 2.958 N/A CYS 848.A N THR 844.A O no hydrogen 2.935 N/A CYS 848.A SG THR 844.A O no hydrogen 3.264 N/A ALA 849.A N PHE 845.A O no hydrogen 2.926 N/A VAL 850.A N VAL 847.A O no hydrogen 3.115 N/A PHE 851.A N VAL 847.A O no hydrogen 2.970 N/A ASN 854.A N LEU 852.A O no hydrogen 2.691 N/A TRP 856.A N ASN 854.A O no hydrogen 2.445 N/A GLY 859.A N PRO 855.A O no hydrogen 3.515 N/A ILE 861.A N THR 857.A O no hydrogen 3.008 N/A VAL 862.A N ALA 858.A O no hydrogen 2.985 N/A MET 863.A N GLY 859.A O no hydrogen 2.876 N/A VAL 864.A N ILE 860.A O no hydrogen 2.953 N/A LEU 865.A N ILE 861.A O no hydrogen 2.891 N/A ALA 866.A N VAL 862.A O no hydrogen 2.875 N/A LEU 867.A N MET 863.A O no hydrogen 3.019 N/A MET 868.A N VAL 864.A O no hydrogen 2.783 N/A THR 869.A N LEU 865.A O no hydrogen 2.961 N/A THR 869.A OG1 LEU 865.A O no hydrogen 3.372 N/A THR 869.A OG1 ALA 866.A O no hydrogen 3.092 N/A VAL 870.A N ALA 866.A O no hydrogen 2.970 N/A GLU 871.A N LEU 867.A O no hydrogen 2.946 N/A LEU 872.A N MET 868.A O no hydrogen 2.921 N/A PHE 873.A N THR 869.A O no hydrogen 2.853 N/A GLY 874.A N VAL 870.A O no hydrogen 2.980 N/A MET 875.A N GLU 871.A O no hydrogen 2.891 N/A MET 876.A N LEU 872.A O no hydrogen 2.898 N/A GLY 877.A N PHE 873.A O no hydrogen 2.990 N/A LEU 878.A N GLY 874.A O no hydrogen 2.888 N/A ILE 879.A N MET 875.A O no hydrogen 3.019 N/A SER 884.A OG LEU 883.A O no hydrogen 2.474 N/A VAL 886.A N SER 884.A O no hydrogen 2.695 N/A LEU 891.A N PRO 887.A O no hydrogen 2.948 N/A ILE 892.A N VAL 888.A O no hydrogen 3.057 N/A ALA 893.A N VAL 889.A O no hydrogen 2.878 N/A SER 894.A N ILE 890.A O no hydrogen 2.760 N/A VAL 895.A N LEU 891.A O no hydrogen 3.106 N/A GLY 896.A N ILE 892.A O no hydrogen 3.052 N/A ILE 897.A N ALA 893.A O no hydrogen 2.840 N/A GLY 898.A N SER 894.A O no hydrogen 2.950 N/A VAL 899.A N VAL 895.A O no hydrogen 3.107 N/A GLU 900.A N ILE 897.A O no hydrogen 3.004 N/A THR 902.A OG1 VAL 899.A O no hydrogen 2.555 N/A VAL 903.A N VAL 899.A O no hydrogen 3.007 N/A HIS 904.A N GLU 900.A O no hydrogen 3.113 N/A VAL 905.A N PHE 901.A O no hydrogen 3.172 N/A ALA 906.A N THR 902.A O no hydrogen 2.921 N/A LEU 907.A N VAL 903.A O no hydrogen 2.974 N/A ALA 908.A N HIS 904.A O no hydrogen 3.053 N/A PHE 909.A N VAL 905.A O no hydrogen 2.983 N/A LEU 910.A N ALA 906.A O no hydrogen 2.898 N/A THR 911.A N LEU 907.A O no hydrogen 3.063 N/A THR 911.A OG1 LEU 907.A O no hydrogen 3.111 N/A ARG 918.A NH2 ARG 918.A O no hydrogen 3.425 N/A ARG 919.A NH1 PHE 909.A O no hydrogen 3.332 N/A ALA 920.A N ASN 917.A O no hydrogen 3.063 N/A VAL 921.A N ASN 917.A O no hydrogen 3.105 N/A LEU 922.A N ARG 918.A O no hydrogen 3.097 N/A LEU 924.A N ALA 920.A O no hydrogen 2.948 N/A GLU 925.A N VAL 921.A O no hydrogen 2.853 N/A HIS 926.A N LEU 922.A O no hydrogen 2.907 N/A HIS 926.A NE2 GLU 452.A OE1 no hydrogen 3.292 N/A LEU 932.A N PHE 928.A O no hydrogen 2.980 N/A ASP 933.A N ALA 929.A O no hydrogen 2.920 N/A GLY 934.A N PRO 930.A O no hydrogen 2.852 N/A ALA 935.A N VAL 931.A O no hydrogen 2.985 N/A VAL 936.A N LEU 932.A O no hydrogen 2.959 N/A SER 937.A N ASP 933.A O no hydrogen 2.891 N/A SER 937.A OG GLY 934.A O no hydrogen 2.362 N/A THR 938.A N GLY 934.A O no hydrogen 3.359 N/A THR 938.A OG1 GLY 934.A O no hydrogen 3.081 N/A LEU 939.A N ALA 935.A O no hydrogen 3.041 N/A LEU 940.A N VAL 936.A O no hydrogen 2.886 N/A GLY 941.A N SER 937.A O no hydrogen 2.891 N/A VAL 942.A N LEU 939.A O no hydrogen 3.289 N/A LEU 943.A N LEU 939.A O no hydrogen 2.974 N/A ALA 946.A N LEU 943.A O no hydrogen 3.106 N/A ARG 955.A N ASP 951.A O no hydrogen 2.906 N/A TYR 956.A N PHE 952.A O no hydrogen 2.976 N/A ALA 959.A N ARG 955.A O no hydrogen 2.957 N/A VAL 960.A N TYR 956.A O no hydrogen 3.026 N/A ALA 962.A N PHE 958.A O no hydrogen 3.123 N/A LEU 964.A N VAL 960.A O no hydrogen 3.454 N/A THR 965.A N LEU 961.A O no hydrogen 3.369 N/A THR 965.A OG1 ALA 962.A O no hydrogen 2.653 N/A ILE 966.A N ALA 962.A O no hydrogen 2.968 N/A LEU 967.A N ILE 963.A O no hydrogen 2.842 N/A GLY 968.A N LEU 964.A O no hydrogen 2.837 N/A VAL 969.A N THR 965.A O no hydrogen 2.934 N/A LEU 970.A N ILE 966.A O no hydrogen 3.102 N/A ASN 971.A N LEU 967.A O no hydrogen 2.810 N/A GLY 972.A N GLY 968.A O no hydrogen 2.925 N/A LEU 973.A N VAL 969.A O no hydrogen 3.015 N/A VAL 974.A N LEU 970.A O no hydrogen 2.952 N/A LEU 975.A N ASN 971.A O no hydrogen 2.893 N/A LEU 976.A N GLY 972.A O no hydrogen 3.001 N/A LEU 979.A N LEU 975.A O no hydrogen 2.630 N/A LEU 980.A N LEU 976.A O no hydrogen 2.931 N/A SER 981.A N PRO 977.A O no hydrogen 2.873 N/A SER 981.A OG PRO 977.A O no hydrogen 2.509 N/A PHE 982.A N VAL 978.A O no hydrogen 2.983 N/A PHE 983.A N LEU 979.A O no hydrogen 3.260 N/A