Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6lx3_P.pdb H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.P OG SER 102.P O no hydrogen 2.979 N/A PHE 5.P N TYR 23.P O no hydrogen 3.111 N/A GLU 8.P N GLU 8.P OE1 no hydrogen 3.039 N/A SER 12.P OG ASN 11.P O no hydrogen 2.614 N/A GLU 14.P N SER 110.P O no hydrogen 3.169 N/A GLY 15.P N LEU 82.P O no hydrogen 3.104 N/A SER 17.P OG ILE 79.P O no hydrogen 3.533 N/A VAL 18.P N ILE 79.P O no hydrogen 2.917 N/A ILE 20.P N VAL 77.P O no hydrogen 2.903 N/A CYS 22.P N PHE 75.P O no hydrogen 2.921 N/A TYR 23.P N PHE 5.P O no hydrogen 2.719 N/A TYR 24.P N GLY 73.P O no hydrogen 3.243 N/A TYR 24.P OH ASN 68.P OD1 no hydrogen 2.741 N/A THR 27.P N PRO 25.P O no hydrogen 2.718 N/A ASN 30.P ND2 THR 27.P OG1 no hydrogen 2.376 N/A ARG 31.P N THR 27.P O no hydrogen 3.298 N/A THR 33.P N VAL 29.P O no hydrogen 2.927 N/A ARG 34.P N THR 33.P OG1 no hydrogen 2.793 N/A ARG 34.P NH1 GLY 95.P O no hydrogen 2.589 N/A ARG 34.P NH1 ASN 97.P OD1 no hydrogen 2.763 N/A LYS 35.P NZ ASN 30.P O no hydrogen 2.363 N/A LYS 35.P NZ THR 33.P O no hydrogen 3.042 N/A TYR 36.P N GLY 93.P O no hydrogen 3.026 N/A TRP 37.P N ILE 50.P O no hydrogen 3.186 N/A CYS 38.P N LYS 91.P O no hydrogen 2.992 N/A CYS 38.P SG LYS 91.P O no hydrogen 3.925 N/A ARG 39.P N ILE 47.P O no hydrogen 3.124 N/A ARG 39.P NH1 ASP 85.P O no hydrogen 3.564 N/A ARG 39.P NH2 ASP 85.P O no hydrogen 2.982 N/A GLN 40.P NE2 GLY 41.P O no hydrogen 3.617 N/A CYS 46.P SG GLN 40.P OE1 no hydrogen 4.004 N/A ILE 47.P N ARG 39.P O no hydrogen 3.391 N/A LEU 49.P N TRP 37.P O no hydrogen 3.169 N/A SER 51.P N TYR 55.P O no hydrogen 2.806 N/A SER 51.P OG LYS 35.P O no hydrogen 3.480 N/A SER 52.P N LYS 35.P O no hydrogen 2.976 N/A GLU 53.P N SER 51.P OG no hydrogen 2.904 N/A SER 57.P N LEU 49.P O no hydrogen 2.920 N/A LYS 59.P N SER 57.P OG no hydrogen 3.330 N/A ARG 63.P N TYR 60.P O no hydrogen 3.483 N/A ARG 63.P NE LYS 59.P O no hydrogen 3.305 N/A ARG 63.P NH1 ALA 80.P O no hydrogen 2.968 N/A ARG 63.P NH1 ASP 86.P OD2 no hydrogen 3.426 N/A ARG 63.P NH2 ASP 86.P OD2 no hydrogen 3.511 N/A ASN 65.P N ASN 78.P O no hydrogen 3.009 N/A THR 67.P N VAL 76.P O no hydrogen 2.946 N/A PHE 69.P N THR 74.P O no hydrogen 2.887 N/A GLY 73.P N PHE 69.P O no hydrogen 3.132 N/A THR 74.P N PHE 69.P O no hydrogen 3.003 N/A THR 74.P OG1 CYS 22.P O no hydrogen 2.538 N/A THR 74.P OG1 PHE 75.P O no hydrogen 3.533 N/A PHE 75.P N CYS 22.P O no hydrogen 2.941 N/A VAL 76.P N THR 67.P O no hydrogen 2.854 N/A VAL 77.P N ILE 20.P O no hydrogen 2.886 N/A ASN 78.P N ASN 65.P O no hydrogen 2.925 N/A ASN 78.P ND2 ASN 65.P O no hydrogen 3.450 N/A ASN 78.P ND2 ASN 65.P OD1 no hydrogen 3.201 N/A ILE 79.P N VAL 18.P O no hydrogen 2.919 N/A ALA 80.P N ARG 63.P O no hydrogen 2.827 N/A LEU 82.P N ASN 16.P O no hydrogen 3.430 N/A SER 83.P OG LEU 82.P O no hydrogen 2.809 N/A ASP 86.P N SER 83.P O no hydrogen 2.827 N/A SER 87.P OG VAL 109.P O no hydrogen 3.016 N/A GLY 88.P N LEU 107.P O no hydrogen 2.875 N/A TYR 90.P N VAL 105.P O no hydrogen 2.937 N/A TYR 90.P OH ASP 86.P O no hydrogen 2.723 N/A LYS 91.P N CYS 38.P O no hydrogen 2.894 N/A LYS 91.P NZ SER 102.P OG no hydrogen 2.764 N/A CYS 92.P N PHE 103.P O no hydrogen 2.989 N/A CYS 92.P SG PHE 103.P O no hydrogen 3.970 N/A GLY 93.P N TYR 36.P O no hydrogen 3.038 N/A LEU 94.P N LEU 101.P O no hydrogen 3.083 N/A GLY 95.P N ARG 34.P O no hydrogen 2.551 N/A ASN 97.P ND2 THR 48.P OG1 no hydrogen 2.446 N/A ARG 99.P N ILE 96.P O no hydrogen 3.450 N/A PHE 103.P N CYS 92.P O no hydrogen 2.884 N/A VAL 105.P N TYR 90.P O no hydrogen 2.966 N/A SER 106.P OG GLU 9.P OE1 no hydrogen 3.199 N/A GLU 108.P N VAL 10.P O no hydrogen 3.262 N/A VAL 109.P N SER 87.P OG no hydrogen 2.892 N/A SER 110.P N SER 12.P O no hydrogen 3.177 N/A TYR 122.P N ASP 216.P O no hydrogen 2.827 N/A THR 123.P OG1 GLN 218.P OE1 no hydrogen 3.088 N/A VAL 124.P N GLN 218.P O no hydrogen 3.007 N/A GLY 127.P N LEU 192.P O no hydrogen 3.289 N/A ARG 128.P N ASP 125.P O no hydrogen 3.390 N/A VAL 130.P N ILE 189.P O no hydrogen 2.953 N/A ILE 132.P N VAL 187.P O no hydrogen 2.866 N/A ASN 133.P N TYR 122.P OH no hydrogen 3.068 N/A LYS 137.P NZ SER 210.P OG no hydrogen 3.390 N/A ASN 140.P ND2 ALA 204.P O no hydrogen 2.698 N/A ASN 140.P ND2 ASN 211.P OD1 no hydrogen 3.387 N/A ARG 144.P NH2 TYR 164.P O no hydrogen 3.509 N/A LYS 145.P NZ ASN 140.P O no hydrogen 2.972 N/A SER 146.P N GLN 203.P O no hydrogen 2.880 N/A SER 146.P OG LEU 147.P O no hydrogen 3.289 N/A LEU 147.P N ILE 159.P O no hydrogen 2.920 N/A TYR 148.P N LEU 201.P O no hydrogen 2.902 N/A LYS 149.P N VAL 156.P O no hydrogen 3.279 N/A LYS 149.P NZ TYR 169.P OH no hydrogen 3.350 N/A VAL 156.P N LYS 149.P O no hydrogen 3.127 N/A ASN 168.P N ASN 166.P OD1 no hydrogen 3.080 N/A TYR 169.P N ASN 166.P O no hydrogen 3.148 N/A THR 170.P OG1 ASN 166.P O no hydrogen 3.168 N/A THR 170.P OG1 PRO 167.P O no hydrogen 2.726 N/A ARG 172.P NH1 ASP 196.P OD1 no hydrogen 3.289 N/A ARG 172.P NH2 ASN 168.P O no hydrogen 2.659 N/A ARG 174.P N VAL 188.P O no hydrogen 3.040 N/A VAL 187.P N ILE 132.P O no hydrogen 2.959 N/A VAL 188.P N ARG 174.P O no hydrogen 2.947 N/A ILE 189.P N VAL 130.P O no hydrogen 2.912 N/A ASN 190.P N ARG 172.P O no hydrogen 3.276 N/A GLN 191.P NE2 GLY 318.P O no hydrogen 2.413 N/A SER 195.P OG SER 195.P O no hydrogen 2.266 N/A ASP 196.P N ARG 193.P O no hydrogen 3.256 N/A GLN 199.P NE2 GLN 150.P O no hydrogen 3.382 N/A GLN 199.P NE2 GLN 199.P O no hydrogen 3.544 N/A TYR 200.P N ALA 215.P O no hydrogen 2.890 N/A LEU 201.P N TYR 148.P O no hydrogen 2.933 N/A CYS 202.P N LYS 213.P O no hydrogen 2.901 N/A GLN 203.P N SER 146.P O no hydrogen 2.958 N/A LYS 213.P N CYS 202.P O no hydrogen 2.921 N/A ALA 215.P N TYR 200.P O no hydrogen 2.919 N/A ASP 216.P N LYS 120.P O no hydrogen 2.806 N/A GLN 218.P N TYR 122.P O no hydrogen 2.895 N/A LEU 220.P N VAL 124.P O no hydrogen 2.917 N/A GLU 225.P N ALA 323.P O no hydrogen 3.024 N/A VAL 227.P N GLN 325.P O no hydrogen 2.902 N/A TYR 228.P OH PRO 3.P O no hydrogen 3.079 N/A GLU 229.P N PHE 327.P O no hydrogen 2.928 N/A LEU 231.P N ASN 329.P O no hydrogen 3.111 N/A LEU 231.P N SER 332.P OG no hydrogen 2.616 N/A ARG 232.P N LEU 297.P O no hydrogen 3.040 N/A ARG 232.P NE ILE 334.P O no hydrogen 3.184 N/A ARG 232.P NH2 ILE 334.P O no hydrogen 2.577 N/A SER 234.P OG LEU 430.P O no hydrogen 2.997 N/A VAL 235.P N ILE 294.P O no hydrogen 2.879 N/A PHE 237.P N VAL 292.P O no hydrogen 2.903 N/A CYS 239.P N PHE 290.P O no hydrogen 3.093 N/A GLU 244.P N GLU 244.P OE2 no hydrogen 2.655 N/A VAL 248.P N VAL 245.P O no hydrogen 3.184 N/A LYS 250.P NZ VAL 245.P O no hydrogen 3.279 N/A PHE 251.P N GLY 308.P O no hydrogen 3.000 N/A CYS 253.P N LEU 306.P O no hydrogen 2.950 N/A ARG 254.P N ASP 262.P O no hydrogen 3.138 N/A ARG 254.P NH1 GLU 300.P O no hydrogen 3.036 N/A ARG 254.P NH2 GLU 300.P O no hydrogen 3.117 N/A GLN 255.P N ARG 304.P O no hydrogen 2.979 N/A SER 256.P N ASN 260.P O no hydrogen 3.322 N/A SER 256.P OG ASN 260.P O no hydrogen 2.593 N/A SER 256.P OG ASN 260.P OD1 no hydrogen 2.608 N/A ASP 262.P N ARG 254.P O no hydrogen 3.035 N/A VAL 264.P N LEU 252.P O no hydrogen 2.887 N/A ASN 266.P ND2 GLY 313.P O no hydrogen 2.999 N/A THR 267.P N LYS 250.P O no hydrogen 3.227 N/A THR 267.P N ASN 266.P OD1 no hydrogen 2.823 N/A THR 267.P OG1 LYS 250.P O no hydrogen 2.974 N/A ALA 272.P N VAL 264.P O no hydrogen 2.935 N/A ARG 278.P NE ALA 274.P O no hydrogen 3.486 N/A ARG 278.P NH1 THR 295.P O no hydrogen 2.792 N/A ARG 278.P NH1 ASP 301.P OD2 no hydrogen 3.296 N/A ARG 278.P NH2 ASP 301.P OD2 no hydrogen 2.976 N/A ASN 282.P N SER 291.P O no hydrogen 2.967 N/A ASN 282.P ND2 SER 291.P O no hydrogen 3.669 N/A VAL 292.P N PHE 237.P O no hydrogen 2.941 N/A VAL 293.P N LEU 280.P O no hydrogen 2.891 N/A ILE 294.P N VAL 235.P O no hydrogen 2.896 N/A THR 295.P N ARG 278.P O no hydrogen 2.969 N/A LEU 297.P N GLY 233.P O no hydrogen 3.219 N/A ARG 298.P N ASP 301.P OD2 no hydrogen 3.425 N/A ASP 301.P N ARG 298.P O no hydrogen 3.109 N/A TYR 305.P N TRP 324.P O no hydrogen 2.932 N/A TYR 305.P OH ASP 301.P O no hydrogen 2.410 N/A LEU 306.P N CYS 253.P O no hydrogen 2.935 N/A CYS 307.P N GLN 322.P O no hydrogen 2.885 N/A GLY 308.P N PHE 251.P O no hydrogen 3.044 N/A GLY 313.P N HIS 310.P O no hydrogen 2.963 N/A SER 319.P OG GLN 316.P O no hydrogen 3.263 N/A TRP 324.P N TYR 305.P O no hydrogen 2.964 N/A GLN 325.P N GLU 225.P O no hydrogen 2.842 N/A LEU 326.P N GLY 303.P O no hydrogen 2.965 N/A PHE 327.P N VAL 227.P O no hydrogen 2.913 N/A ASN 329.P N GLU 229.P O no hydrogen 2.876 N/A ASN 329.P ND2 ASP 230.P OD1 no hydrogen 3.160 N/A ASN 329.P ND2 GLU 331.P O no hydrogen 3.129 N/A GLU 331.P N ASN 329.P OD1 no hydrogen 3.106 N/A SER 332.P OG LEU 231.P O no hydrogen 3.351 N/A SER 332.P OG ASN 329.P O no hydrogen 2.878 N/A VAL 341.P N GLU 436.P O no hydrogen 2.880 N/A GLY 343.P N LYS 438.P O no hydrogen 2.983 N/A GLY 346.P N LEU 413.P O no hydrogen 3.212 N/A GLY 347.P N VAL 344.P O no hydrogen 2.717 N/A SER 348.P OG LEU 410.P O no hydrogen 3.410 N/A SER 348.P OG THR 537.P OG1 no hydrogen 3.155 N/A VAL 349.P N LEU 410.P O no hydrogen 2.911 N/A VAL 351.P N VAL 408.P O no hydrogen 2.919 N/A CYS 353.P N PHE 406.P O no hydrogen 2.901 N/A TYR 355.P N GLY 404.P O no hydrogen 3.355 N/A ASN 356.P ND2 THR 429.P OG1 no hydrogen 2.557 N/A SER 360.P OG ARG 357.P O no hydrogen 2.511 N/A SER 362.P OG GLU 359.P O no hydrogen 2.950 N/A SER 362.P OG GLU 359.P OE1 no hydrogen 2.437 N/A LYS 364.P NZ SER 360.P O no hydrogen 3.350 N/A TYR 365.P N LEU 424.P O no hydrogen 3.077 N/A TRP 366.P N VAL 381.P O no hydrogen 3.089 N/A CYS 367.P SG PRO 378.P O no hydrogen 3.754 N/A TRP 369.P NE1 GLU 276.P OE1 no hydrogen 3.153 N/A GLU 370.P N ARG 376.P O no hydrogen 2.964 N/A CYS 377.P SG LEU 368.P O no hydrogen 3.138 N/A LEU 380.P N TRP 366.P O no hydrogen 2.999 N/A ASP 382.P N TRP 386.P O no hydrogen 3.222 N/A TRP 386.P N ASP 382.P OD1 no hydrogen 2.961 N/A LYS 388.P N LEU 380.P O no hydrogen 3.009 N/A ARG 394.P NE ASN 411.P O no hydrogen 3.089 N/A ARG 394.P NH2 ASN 411.P O no hydrogen 3.438 N/A ARG 394.P NH2 ASP 417.P OD2 no hydrogen 2.325 N/A SER 396.P N ILE 409.P O no hydrogen 2.948 N/A LEU 398.P N THR 407.P O no hydrogen 2.728 N/A PHE 406.P N CYS 353.P O no hydrogen 2.905 N/A THR 407.P OG1 GLU 400.P O no hydrogen 2.393 N/A VAL 408.P N VAL 351.P O no hydrogen 2.855 N/A ILE 409.P N SER 396.P O no hydrogen 2.906 N/A LEU 410.P N VAL 349.P O no hydrogen 2.939 N/A ASN 411.P N ARG 394.P O no hydrogen 3.181 N/A ASN 411.P ND2 THR 537.P OG1 no hydrogen 3.260 N/A TYR 421.P N VAL 435.P O no hydrogen 2.869 N/A TYR 421.P OH ASP 417.P O no hydrogen 2.923 N/A TRP 422.P NE1 GLY 277.P O no hydrogen 2.986 N/A CYS 423.P N THR 433.P O no hydrogen 3.011 N/A CYS 423.P SG THR 433.P O no hydrogen 3.232 N/A ASP 428.P N ASP 428.P OD2 no hydrogen 2.482 N/A THR 429.P OG1 THR 429.P O no hydrogen 2.268 N/A ARG 432.P NH2 THR 236.P OG1 no hydrogen 2.761 N/A THR 433.P OG1 TRP 431.P O no hydrogen 2.955 N/A THR 434.P OG1 GLY 277.P O no hydrogen 3.533 N/A VAL 435.P N TYR 421.P O no hydrogen 2.935 N/A GLU 436.P N THR 339.P O no hydrogen 3.239 N/A ILE 437.P N GLY 419.P O no hydrogen 2.995 N/A LYS 438.P N VAL 341.P O no hydrogen 2.784 N/A LEU 446.P N GLU 536.P OE1 no hydrogen 3.341 N/A LYS 447.P N HIS 465.P O no hydrogen 3.175 N/A LYS 447.P NZ ASN 445.P O no hydrogen 3.011 N/A ALA 454.P N ALA 543.P O no hydrogen 2.860 N/A GLY 457.P N VAL 516.P O no hydrogen 3.248 N/A GLU 458.P N LEU 456.P O no hydrogen 2.934 N/A THR 459.P N GLU 458.P OE2 no hydrogen 2.724 N/A THR 459.P OG1 GLU 458.P OE2 no hydrogen 3.331 N/A LEU 460.P N LEU 513.P O no hydrogen 3.281 N/A LYS 461.P NZ THR 512.P OG1 no hydrogen 2.980 N/A VAL 462.P N LEU 511.P O no hydrogen 2.778 N/A LYS 469.P NZ ASN 445.P OD1 no hydrogen 3.460 N/A TYR 473.P N PHE 470.P O no hydrogen 3.046 N/A GLU 474.P N LYS 529.P O no hydrogen 2.767 N/A LYS 475.P NZ PHE 470.P O no hydrogen 3.526 N/A LYS 475.P NZ TYR 473.P O no hydrogen 2.513 N/A LYS 475.P NZ GLU 504.P OE2 no hydrogen 2.736 N/A TYR 476.P N GLY 527.P O no hydrogen 3.222 N/A TRP 477.P NE1 VAL 509.P O no hydrogen 2.989 N/A CYS 478.P N TRP 525.P O no hydrogen 3.011 N/A LYS 479.P NZ GLU 521.P O no hydrogen 2.393 N/A TRP 480.P N TRP 523.P O no hydrogen 2.909 N/A TRP 480.P NE1 LEU 395.P O no hydrogen 2.881 N/A PHE 499.P N THR 512.P O no hydrogen 3.346 N/A ASN 501.P N SER 510.P O no hydrogen 3.209 N/A CYS 502.P SG GLU 504.P OE2 no hydrogen 3.694 N/A SER 506.P N ASP 503.P OD1 no hydrogen 2.916 N/A ARG 507.P NH1 PHE 466.P O no hydrogen 3.144 N/A LEU 508.P N ASP 503.P O no hydrogen 3.113 N/A VAL 509.P N CYS 464.P O no hydrogen 3.096 N/A SER 510.P N ASN 501.P O no hydrogen 2.769 N/A LEU 511.P N VAL 462.P O no hydrogen 2.616 N/A THR 512.P N PHE 499.P O no hydrogen 3.286 N/A LEU 513.P N LEU 460.P O no hydrogen 3.132 N/A ALA 519.P N THR 517.P OG1 no hydrogen 2.767 N/A ASP 520.P N THR 517.P OG1 no hydrogen 3.418 N/A TYR 524.P N VAL 540.P O no hydrogen 2.817 N/A TRP 525.P N CYS 478.P O no hydrogen 2.983 N/A TRP 525.P NE1 GLY 393.P O no hydrogen 3.136 N/A CYS 526.P N ALA 538.P O no hydrogen 3.068 N/A GLY 527.P N TYR 476.P O no hydrogen 3.328 N/A VAL 528.P N GLU 536.P O no hydrogen 3.213 N/A LYS 529.P NZ GLU 474.P OE2 no hydrogen 3.517 N/A GLN 530.P N PHE 533.P O no hydrogen 2.970 N/A GLY 531.P N GLU 474.P OE1 no hydrogen 2.984 N/A HIS 532.P N GLN 530.P O no hydrogen 3.009 N/A GLY 535.P N VAL 528.P O no hydrogen 2.965 N/A THR 537.P OG1 SER 348.P OG no hydrogen 3.155 N/A ALA 538.P N CYS 526.P O no hydrogen 2.940 N/A VAL 540.P N TYR 524.P O no hydrogen 2.915 N/A TYR 541.P N ASN 451.P OD1 no hydrogen 3.210 N/A VAL 542.P N GLY 522.P O no hydrogen 3.138 N/A ALA 543.P N VAL 452.P O no hydrogen 3.333 N/A