Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7s8x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 8.A NH1 ASP 661.A OD1 no hydrogen 3.263 N/A ARG 8.A NH1 ASP 661.A OD2 no hydrogen 3.143 N/A ARG 8.A NH2 ASP 661.A OD1 no hydrogen 3.377 N/A ARG 8.A NH2 ASP 661.A OD2 no hydrogen 3.222 N/A HIS 13.A N LEU 655.A O no hydrogen 2.831 N/A LEU 16.A N SER 12.A O no hydrogen 3.076 N/A GLN 17.A N HIS 13.A O no hydrogen 2.914 N/A GLU 18.A N PRO 14.A O no hydrogen 2.900 N/A ARG 19.A N VAL 15.A O no hydrogen 2.938 N/A SER 27.A OG GLU 28.A O no hydrogen 3.475 N/A SER 29.A OG GLN 36.A OE1 no hydrogen 2.646 N/A LYS 35.A N ASP 32.A O no hydrogen 3.247 N/A THR 39.A OG1 THR 41.A OG1 no hydrogen 2.685 N/A THR 41.A N THR 39.A OG1 no hydrogen 3.196 N/A THR 41.A OG1 THR 39.A OG1 no hydrogen 2.685 N/A ILE 45.A N THR 41.A O no hydrogen 3.016 N/A ARG 46.A N PRO 42.A O no hydrogen 2.918 N/A ASN 47.A N LYS 43.A O no hydrogen 2.904 N/A ILE 48.A N LYS 44.A O no hydrogen 2.896 N/A ILE 49.A N ILE 45.A O no hydrogen 2.937 N/A TYR 50.A N ARG 46.A O no hydrogen 2.882 N/A MET 51.A N ASN 47.A O no hydrogen 2.900 N/A PHE 52.A N ILE 48.A O no hydrogen 2.924 N/A LEU 53.A N ILE 49.A O no hydrogen 2.892 N/A THR 56.A N LEU 53.A O no hydrogen 3.268 N/A THR 56.A OG1 LEU 53.A O no hydrogen 3.346 N/A LYS 57.A N PRO 54.A O no hydrogen 2.890 N/A TRP 58.A N PRO 54.A O no hydrogen 2.919 N/A TRP 58.A NE1 GLY 115.A O no hydrogen 3.101 N/A LEU 59.A N ILE 55.A O no hydrogen 3.334 N/A TYR 62.A OH ASP 71.A OD2 no hydrogen 2.302 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 2.416 N/A TYR 67.A N ARG 63.A O no hydrogen 3.291 N/A VAL 68.A N PHE 64.A O no hydrogen 2.925 N/A GLY 70.A N GLU 66.A O no hydrogen 3.012 N/A ASP 71.A N TYR 67.A O no hydrogen 2.836 N/A ILE 72.A N VAL 68.A O no hydrogen 2.905 N/A VAL 73.A N LEU 69.A O no hydrogen 2.993 N/A SER 74.A N GLY 70.A O no hydrogen 2.944 N/A SER 74.A OG GLN 391.A O no hydrogen 3.319 N/A GLY 75.A N ASP 71.A O no hydrogen 2.785 N/A ILE 76.A N ILE 72.A O no hydrogen 2.989 N/A SER 77.A N VAL 73.A O no hydrogen 3.017 N/A SER 77.A OG VAL 73.A O no hydrogen 3.549 N/A SER 77.A OG PRO 277.A O no hydrogen 3.148 N/A THR 78.A N SER 74.A O no hydrogen 2.850 N/A GLY 79.A N GLY 75.A O no hydrogen 2.902 N/A VAL 80.A N ILE 76.A O no hydrogen 2.989 N/A LEU 81.A N SER 77.A O no hydrogen 2.983 N/A GLN 82.A NE2 SER 104.A OG no hydrogen 2.460 N/A LEU 83.A N GLY 79.A O no hydrogen 3.043 N/A GLN 85.A N LEU 81.A O no hydrogen 3.441 N/A GLN 85.A NE2 SER 386.A OG no hydrogen 2.586 N/A GLY 86.A N GLN 82.A O no hydrogen 2.767 N/A LEU 87.A N LEU 83.A O no hydrogen 3.007 N/A ALA 88.A N PRO 84.A O no hydrogen 2.898 N/A PHE 89.A N GLN 85.A O no hydrogen 2.936 N/A ALA 90.A N GLY 86.A O no hydrogen 2.922 N/A MET 91.A N LEU 87.A O no hydrogen 2.972 N/A LEU 92.A N ALA 88.A O no hydrogen 2.938 N/A ALA 93.A N ALA 90.A O no hydrogen 2.861 N/A PHE 99.A N PRO 96.A O no hydrogen 3.227 N/A GLY 100.A N PRO 97.A O no hydrogen 2.924 N/A TYR 102.A N VAL 98.A O no hydrogen 2.961 N/A TYR 102.A OH GLY 312.A O no hydrogen 3.249 N/A SER 103.A N PHE 99.A O no hydrogen 2.908 N/A SER 104.A N GLY 100.A O no hydrogen 2.875 N/A PHE 105.A N TYR 102.A O no hydrogen 3.157 N/A TYR 106.A N TYR 102.A O no hydrogen 3.030 N/A MET 110.A N TYR 106.A O no hydrogen 3.064 N/A TYR 111.A N PRO 107.A O no hydrogen 2.846 N/A TYR 111.A OH GLU 362.A OE1 no hydrogen 2.237 N/A CYS 112.A N VAL 108.A O no hydrogen 2.907 N/A PHE 113.A N ILE 109.A O no hydrogen 2.981 N/A PHE 114.A N MET 110.A O no hydrogen 2.939 N/A GLY 115.A N TYR 111.A O no hydrogen 2.398 N/A THR 116.A N GLU 362.A OE2 no hydrogen 3.279 N/A THR 116.A OG1 GLU 362.A OE2 no hydrogen 2.264 N/A HIS 119.A N TYR 355.A OH no hydrogen 3.302 N/A GLY 123.A N SER 382.A O no hydrogen 2.986 N/A ILE 128.A N PHE 125.A O no hydrogen 2.748 N/A SER 129.A OG PHE 89.A O no hydrogen 2.327 N/A LEU 130.A N ALA 126.A O no hydrogen 2.802 N/A MET 131.A N VAL 127.A O no hydrogen 2.979 N/A ILE 132.A N ILE 128.A O no hydrogen 2.933 N/A GLY 133.A N SER 129.A O no hydrogen 2.866 N/A GLY 134.A N LEU 130.A O no hydrogen 2.868 N/A VAL 135.A N MET 131.A O no hydrogen 2.958 N/A ALA 136.A N ILE 132.A O no hydrogen 2.920 N/A VAL 137.A N GLY 133.A O no hydrogen 2.875 N/A ARG 138.A N GLY 134.A O no hydrogen 2.914 N/A LEU 139.A N VAL 135.A O no hydrogen 2.939 N/A VAL 140.A N ALA 136.A O no hydrogen 2.736 N/A ILE 144.A N PRO 141.A O no hydrogen 3.308 N/A SER 155.A N THR 153.A O no hydrogen 2.683 N/A SER 155.A OG GLU 157.A OE1 no hydrogen 2.832 N/A ASP 160.A N THR 156.A O no hydrogen 2.701 N/A ALA 161.A N GLU 157.A O no hydrogen 2.871 N/A LEU 162.A N ALA 158.A O no hydrogen 2.950 N/A ARG 163.A N ARG 159.A O no hydrogen 2.921 N/A VAL 164.A N ASP 160.A O no hydrogen 2.862 N/A LYS 165.A N ALA 161.A O no hydrogen 2.917 N/A VAL 166.A N LEU 162.A O no hydrogen 2.969 N/A ALA 167.A N ARG 163.A O no hydrogen 2.908 N/A MET 168.A N VAL 164.A O no hydrogen 2.858 N/A SER 169.A N LYS 165.A O no hydrogen 2.982 N/A SER 169.A OG LYS 165.A O no hydrogen 3.383 N/A SER 169.A OG ASP 320.A O no hydrogen 3.257 N/A VAL 170.A N VAL 166.A O no hydrogen 2.968 N/A THR 171.A N ALA 167.A O no hydrogen 2.909 N/A LEU 172.A N MET 168.A O no hydrogen 2.922 N/A LEU 173.A N SER 169.A O no hydrogen 3.011 N/A THR 174.A N VAL 170.A O no hydrogen 2.917 N/A THR 174.A OG1 THR 171.A O no hydrogen 2.724 N/A GLY 175.A N THR 171.A O no hydrogen 2.906 N/A ILE 176.A N LEU 172.A O no hydrogen 2.963 N/A ILE 177.A N LEU 173.A O no hydrogen 2.918 N/A GLN 178.A N THR 174.A O no hydrogen 2.869 N/A GLN 178.A NE2 ALA 335.A O no hydrogen 3.275 N/A PHE 179.A N GLY 175.A O no hydrogen 2.948 N/A CYS 180.A N ILE 176.A O no hydrogen 2.929 N/A LEU 181.A N ILE 177.A O no hydrogen 2.904 N/A GLY 182.A N GLN 178.A O no hydrogen 2.884 N/A VAL 183.A N PHE 179.A O no hydrogen 2.973 N/A CYS 184.A N CYS 180.A O no hydrogen 3.374 N/A CYS 184.A SG CYS 180.A O no hydrogen 3.159 N/A ARG 185.A N GLY 182.A O no hydrogen 3.439 N/A ARG 185.A NE VAL 183.A O no hydrogen 3.276 N/A ARG 185.A NH2 GLY 182.A O no hydrogen 3.231 N/A PHE 186.A N LEU 181.A O no hydrogen 3.059 N/A GLY 187.A N ASN 360.A OD1 no hydrogen 2.534 N/A VAL 189.A N PHE 186.A O no hydrogen 3.090 N/A ALA 190.A N GLY 187.A O no hydrogen 3.128 N/A ILE 191.A N PHE 188.A O no hydrogen 3.028 N/A TYR 192.A N VAL 189.A O no hydrogen 3.051 N/A VAL 198.A N THR 194.A O no hydrogen 3.076 N/A ARG 199.A N GLU 195.A O no hydrogen 2.916 N/A GLY 200.A N PRO 196.A O no hydrogen 2.912 N/A PHE 201.A N LEU 197.A O no hydrogen 2.921 N/A THR 202.A N VAL 198.A O no hydrogen 2.915 N/A THR 202.A OG1 VAL 198.A O no hydrogen 2.983 N/A THR 202.A OG1 ARG 199.A O no hydrogen 2.979 N/A THR 202.A OG1 GLN 442.A OE1 no hydrogen 2.865 N/A THR 203.A N ARG 199.A O no hydrogen 2.962 N/A THR 203.A OG1 ARG 199.A O no hydrogen 3.003 N/A THR 203.A OG1 GLN 442.A OE1 no hydrogen 3.025 N/A ALA 204.A N GLY 200.A O no hydrogen 2.933 N/A ALA 205.A N PHE 201.A O no hydrogen 2.922 N/A ALA 206.A N THR 202.A O no hydrogen 2.913 N/A VAL 207.A N THR 203.A O no hydrogen 2.974 N/A HIS 208.A N ALA 204.A O no hydrogen 2.931 N/A HIS 208.A NE2 SER 467.A O no hydrogen 3.205 N/A VAL 209.A N ALA 205.A O no hydrogen 2.934 N/A PHE 210.A N ALA 206.A O no hydrogen 2.930 N/A THR 211.A N VAL 207.A O no hydrogen 2.976 N/A THR 211.A OG1 VAL 207.A O no hydrogen 3.266 N/A THR 211.A OG1 HIS 208.A O no hydrogen 2.985 N/A SER 212.A N HIS 208.A O no hydrogen 2.929 N/A SER 212.A OG HIS 208.A O no hydrogen 2.762 N/A MET 213.A N VAL 209.A O no hydrogen 2.927 N/A LEU 214.A N PHE 210.A O no hydrogen 3.012 N/A LEU 217.A N MET 213.A O no hydrogen 2.951 N/A PHE 218.A N LEU 214.A O no hydrogen 2.924 N/A GLY 219.A N TYR 216.A O no hydrogen 3.370 N/A VAL 220.A N LYS 215.A O no hydrogen 3.181 N/A LYS 223.A NZ TYR 225.A OH no hydrogen 3.065 N/A PHE 229.A N PHE 469.A O no hydrogen 2.801 N/A SER 230.A OG TYR 225.A O no hydrogen 3.433 N/A TYR 233.A N PHE 229.A O no hydrogen 3.097 N/A SER 234.A N SER 230.A O no hydrogen 2.927 N/A SER 234.A OG SER 230.A O no hydrogen 3.483 N/A THR 235.A N VAL 231.A O no hydrogen 2.925 N/A THR 235.A OG1 VAL 231.A O no hydrogen 3.010 N/A VAL 236.A N VAL 232.A O no hydrogen 2.898 N/A ALA 237.A N TYR 233.A O no hydrogen 2.883 N/A VAL 238.A N SER 234.A O no hydrogen 2.955 N/A LEU 239.A N THR 235.A O no hydrogen 2.925 N/A GLN 240.A N VAL 236.A O no hydrogen 2.822 N/A ASN 241.A N ALA 237.A O no hydrogen 2.928 N/A VAL 242.A N LEU 239.A O no hydrogen 3.316 N/A SER 249.A OG PHE 218.A O no hydrogen 3.541 N/A SER 249.A OG ASN 246.A O no hydrogen 2.567 N/A LEU 250.A N ASN 246.A O no hydrogen 3.154 N/A GLY 251.A N VAL 247.A O no hydrogen 2.875 N/A VAL 252.A N CYS 248.A O no hydrogen 2.936 N/A GLY 253.A N SER 249.A O no hydrogen 2.895 N/A LEU 254.A N LEU 250.A O no hydrogen 2.851 N/A MET 255.A N GLY 251.A O no hydrogen 2.907 N/A VAL 256.A N VAL 252.A O no hydrogen 2.958 N/A PHE 257.A N GLY 253.A O no hydrogen 2.848 N/A GLY 258.A N LEU 254.A O no hydrogen 2.871 N/A LEU 259.A N MET 255.A O no hydrogen 2.972 N/A LEU 260.A N VAL 256.A O no hydrogen 2.826 N/A LEU 261.A N PHE 257.A O no hydrogen 2.920 N/A GLY 262.A N GLY 258.A O no hydrogen 2.945 N/A GLY 263.A N LEU 259.A O no hydrogen 2.876 N/A LYS 264.A N LEU 260.A O no hydrogen 2.875 N/A GLU 265.A N LEU 261.A O no hydrogen 2.948 N/A PHE 266.A N GLY 262.A O no hydrogen 2.895 N/A ASN 267.A N GLY 263.A O no hydrogen 2.844 N/A GLU 268.A N LYS 264.A O no hydrogen 2.915 N/A ARG 269.A N GLU 265.A O no hydrogen 2.890 N/A PHE 270.A N PHE 266.A O no hydrogen 3.139 N/A GLU 281.A N GLU 281.A OE1 no hydrogen 2.763 N/A ALA 284.A N LEU 280.A O no hydrogen 2.921 N/A VAL 285.A N GLU 281.A O no hydrogen 2.890 N/A VAL 286.A N PHE 282.A O no hydrogen 2.911 N/A MET 287.A N PHE 283.A O no hydrogen 2.930 N/A GLY 288.A N ALA 284.A O no hydrogen 2.917 N/A THR 289.A N VAL 285.A O no hydrogen 2.934 N/A THR 289.A OG1 LEU 419.A O no hydrogen 3.463 N/A THR 289.A OG1 SER 422.A O no hydrogen 2.738 N/A GLY 290.A N VAL 286.A O no hydrogen 2.904 N/A ILE 291.A N MET 287.A O no hydrogen 2.911 N/A SER 292.A N GLY 288.A O no hydrogen 2.928 N/A SER 292.A OG GLY 288.A O no hydrogen 3.519 N/A SER 292.A OG THR 289.A O no hydrogen 2.830 N/A SER 292.A OG SER 422.A O no hydrogen 2.265 N/A ALA 293.A N THR 289.A O no hydrogen 2.906 N/A GLY 294.A N GLY 290.A O no hydrogen 2.892 N/A PHE 295.A N ILE 291.A O no hydrogen 3.235 N/A SER 296.A N ALA 293.A O no hydrogen 3.256 N/A SER 296.A OG PHE 295.A O no hydrogen 2.675 N/A LEU 297.A N SER 292.A O no hydrogen 2.904 N/A HIS 298.A ND1 VAL 303.A O no hydrogen 2.898 N/A GLU 299.A N SER 296.A O no hydrogen 3.167 N/A SER 300.A N SER 296.A O no hydrogen 2.714 N/A TYR 301.A N LEU 297.A O no hydrogen 3.355 N/A VAL 306.A N LEU 423.A O no hydrogen 2.735 N/A GLY 307.A N GLU 421.A O no hydrogen 3.244 N/A GLY 312.A N ILE 413.A O no hydrogen 3.233 N/A ALA 317.A N PRO 315.A O no hydrogen 2.705 N/A SER 322.A N ASP 320.A OD2 no hydrogen 2.469 N/A SER 322.A OG ASP 320.A OD2 no hydrogen 2.509 N/A LEU 326.A N LEU 323.A O no hydrogen 3.058 N/A VAL 327.A N LEU 323.A O no hydrogen 2.946 N/A VAL 327.A N PHE 324.A O no hydrogen 3.116 N/A ALA 331.A N VAL 327.A O no hydrogen 2.919 N/A ILE 332.A N TYR 328.A O no hydrogen 2.944 N/A ALA 333.A N VAL 329.A O no hydrogen 2.982 N/A ILE 334.A N ASP 330.A O no hydrogen 2.883 N/A ALA 335.A N ALA 331.A O no hydrogen 2.913 N/A ILE 336.A N ILE 332.A O no hydrogen 2.952 N/A VAL 337.A N ALA 333.A O no hydrogen 2.969 N/A GLY 338.A N ILE 334.A O no hydrogen 2.875 N/A PHE 339.A N ALA 335.A O no hydrogen 2.953 N/A SER 340.A N ILE 336.A O no hydrogen 2.922 N/A SER 340.A OG ILE 336.A O no hydrogen 3.297 N/A SER 340.A OG VAL 337.A O no hydrogen 2.605 N/A VAL 341.A N VAL 337.A O no hydrogen 2.934 N/A THR 342.A N GLY 338.A O no hydrogen 2.930 N/A THR 342.A OG1 GLY 338.A O no hydrogen 2.557 N/A THR 342.A OG1 SER 382.A OG no hydrogen 3.227 N/A ILE 343.A N PHE 339.A O no hydrogen 2.889 N/A SER 344.A N SER 340.A O no hydrogen 2.877 N/A SER 344.A OG SER 340.A O no hydrogen 3.036 N/A SER 344.A OG VAL 341.A O no hydrogen 2.690 N/A MET 345.A N VAL 341.A O no hydrogen 2.959 N/A ALA 346.A N THR 342.A O no hydrogen 2.896 N/A LYS 347.A N ILE 343.A O no hydrogen 2.857 N/A LYS 347.A NZ ALA 190.A O no hydrogen 2.735 N/A LYS 347.A NZ LEU 193.A O no hydrogen 2.836 N/A THR 348.A N SER 344.A O no hydrogen 2.911 N/A LEU 349.A N MET 345.A O no hydrogen 2.938 N/A ALA 350.A N ALA 346.A O no hydrogen 2.887 N/A ASN 351.A N LYS 347.A O no hydrogen 2.935 N/A HIS 353.A N ALA 350.A O no hydrogen 3.291 N/A GLY 354.A N ALA 350.A O no hydrogen 2.789 N/A TYR 355.A N ALA 350.A O no hydrogen 3.452 N/A ASN 360.A ND2 ASP 358.A OD1 no hydrogen 3.180 N/A GLN 361.A N ASP 358.A OD1 no hydrogen 3.105 N/A GLN 361.A NE2 PHE 114.A O no hydrogen 2.783 N/A GLU 362.A N ASP 358.A O no hydrogen 2.827 N/A LEU 363.A N GLY 359.A O no hydrogen 2.934 N/A ILE 364.A N ASN 360.A O no hydrogen 2.905 N/A ALA 365.A N GLN 361.A O no hydrogen 2.889 N/A LEU 366.A N GLU 362.A O no hydrogen 2.893 N/A GLY 367.A N LEU 363.A O no hydrogen 2.911 N/A LEU 368.A N ILE 364.A O no hydrogen 2.931 N/A CYS 369.A N ALA 365.A O no hydrogen 2.897 N/A CYS 369.A SG PRO 107.A O no hydrogen 3.333 N/A CYS 369.A SG ALA 365.A O no hydrogen 3.024 N/A ASN 370.A N LEU 366.A O no hydrogen 2.929 N/A ASN 370.A ND2 GLN 178.A OE1 no hydrogen 3.098 N/A ASN 370.A ND2 LEU 366.A O no hydrogen 3.407 N/A SER 371.A N GLY 367.A O no hydrogen 2.915 N/A THR 372.A N LEU 368.A O no hydrogen 2.943 N/A THR 372.A OG1 LEU 368.A O no hydrogen 2.984 N/A THR 372.A OG1 CYS 369.A O no hydrogen 3.167 N/A GLY 373.A N CYS 369.A O no hydrogen 2.890 N/A SER 374.A N ASN 370.A O no hydrogen 2.899 N/A SER 374.A OG ASN 370.A O no hydrogen 3.470 N/A SER 374.A OG SER 371.A O no hydrogen 2.327 N/A LEU 375.A N SER 371.A O no hydrogen 2.968 N/A PHE 376.A N GLY 373.A O no hydrogen 2.736 N/A THR 378.A OG1 GLY 373.A O no hydrogen 3.300 N/A THR 378.A OG1 PHE 376.A O no hydrogen 3.504 N/A ILE 381.A N ASN 370.A OD1 no hydrogen 3.016 N/A SER 382.A N GLY 123.A O no hydrogen 2.897 N/A SER 382.A OG GLY 338.A O no hydrogen 3.198 N/A SER 382.A OG THR 342.A OG1 no hydrogen 3.227 N/A CYS 383.A N SER 382.A OG no hydrogen 2.751 N/A CYS 383.A SG SER 121.A O no hydrogen 3.788 N/A CYS 383.A SG SER 384.A O no hydrogen 3.474 N/A CYS 383.A SG SER 388.A OG no hydrogen 2.614 N/A SER 384.A N SER 121.A O no hydrogen 3.302 N/A ARG 387.A NE GLN 85.A OE1 no hydrogen 3.387 N/A SER 388.A N SER 384.A O no hydrogen 2.930 N/A SER 388.A OG SER 384.A O no hydrogen 2.328 N/A LEU 389.A N LEU 385.A O no hydrogen 2.977 N/A VAL 390.A N SER 386.A O no hydrogen 2.909 N/A GLN 391.A N ARG 387.A O no hydrogen 2.864 N/A GLU 392.A N SER 388.A O no hydrogen 2.919 N/A GLY 393.A N LEU 389.A O no hydrogen 2.874 N/A THR 394.A N VAL 390.A O no hydrogen 3.028 N/A THR 394.A OG1 VAL 390.A O no hydrogen 2.896 N/A GLY 395.A N GLU 392.A O no hydrogen 3.034 N/A GLY 396.A N GLN 391.A O no hydrogen 2.911 N/A LYS 397.A N ASP 71.A OD1 no hydrogen 2.953 N/A THR 398.A N ASP 71.A OD1 no hydrogen 2.982 N/A THR 398.A OG1 ASP 71.A OD1 no hydrogen 3.164 N/A THR 398.A OG1 ASP 71.A OD2 no hydrogen 2.793 N/A GLN 399.A N GLN 399.A OE1 no hydrogen 2.687 N/A CYS 403.A N GLN 399.A O no hydrogen 2.991 N/A LEU 404.A N LEU 400.A O no hydrogen 2.842 N/A ALA 405.A N ALA 401.A O no hydrogen 2.960 N/A SER 406.A N GLY 402.A O no hydrogen 2.897 N/A SER 406.A OG CYS 403.A O no hydrogen 2.582 N/A LEU 407.A N CYS 403.A O no hydrogen 2.899 N/A MET 408.A N LEU 404.A O no hydrogen 2.921 N/A ILE 409.A N ALA 405.A O no hydrogen 2.938 N/A LEU 410.A N SER 406.A O no hydrogen 2.862 N/A LEU 411.A N LEU 407.A O no hydrogen 2.867 N/A VAL 412.A N MET 408.A O no hydrogen 2.947 N/A ILE 413.A N ILE 409.A O no hydrogen 2.888 N/A LEU 414.A N LEU 410.A O no hydrogen 2.881 N/A ALA 415.A N LEU 411.A O no hydrogen 2.995 N/A THR 416.A N LEU 411.A O no hydrogen 3.366 N/A THR 416.A OG1 VAL 412.A O no hydrogen 3.075 N/A GLN 425.A N ASP 304.A O no hydrogen 3.203 N/A GLN 425.A NE2 VAL 305.A O no hydrogen 3.335 N/A VAL 427.A N PRO 424.A O no hydrogen 3.227 N/A SER 429.A N GLN 425.A O no hydrogen 2.948 N/A SER 429.A OG MET 213.A O no hydrogen 2.343 N/A ALA 430.A N ALA 426.A O no hydrogen 2.882 N/A ILE 431.A N VAL 427.A O no hydrogen 2.918 N/A VAL 432.A N LEU 428.A O no hydrogen 2.967 N/A ILE 433.A N SER 429.A O no hydrogen 2.931 N/A VAL 434.A N ALA 430.A O no hydrogen 2.891 N/A ASN 435.A N ILE 431.A O no hydrogen 2.957 N/A ASN 435.A ND2 GLU 281.A OE2 no hydrogen 2.922 N/A LEU 436.A N VAL 432.A O no hydrogen 2.992 N/A LEU 436.A N ILE 433.A O no hydrogen 3.216 N/A LYS 437.A N VAL 434.A O no hydrogen 3.099 N/A PHE 440.A N LEU 436.A O no hydrogen 2.950 N/A MET 441.A N LYS 437.A O no hydrogen 2.916 N/A GLN 442.A N MET 439.A O no hydrogen 3.135 N/A PHE 443.A N PHE 440.A O no hydrogen 3.279 N/A SER 444.A N MET 441.A O no hydrogen 3.371 N/A SER 444.A OG MET 441.A O no hydrogen 3.563 N/A ASP 445.A N GLN 442.A O no hydrogen 3.133 N/A LEU 446.A N PHE 443.A O no hydrogen 3.377 N/A PHE 449.A N ASP 445.A O no hydrogen 2.981 N/A TRP 450.A N LEU 446.A O no hydrogen 2.880 N/A ARG 451.A N PRO 447.A O no hydrogen 2.954 N/A THR 452.A N PHE 448.A O no hydrogen 2.889 N/A THR 452.A OG1 PHE 448.A O no hydrogen 3.192 N/A SER 453.A N PHE 449.A O no hydrogen 3.365 N/A LYS 454.A NZ TRP 450.A O no hydrogen 2.998 N/A LEU 457.A N SER 453.A O no hydrogen 3.326 N/A THR 458.A N LYS 454.A O no hydrogen 2.887 N/A THR 458.A OG1 LYS 454.A O no hydrogen 2.901 N/A ILE 459.A N ILE 455.A O no hydrogen 2.918 N/A TRP 460.A N GLU 456.A O no hydrogen 2.880 N/A LEU 461.A N LEU 457.A O no hydrogen 2.904 N/A THR 462.A N THR 458.A O no hydrogen 2.885 N/A THR 462.A OG1 THR 458.A O no hydrogen 2.762 N/A THR 463.A N ILE 459.A O no hydrogen 2.904 N/A THR 463.A OG1 ILE 459.A O no hydrogen 2.829 N/A PHE 464.A N TRP 460.A O no hydrogen 2.911 N/A VAL 465.A N LEU 461.A O no hydrogen 2.908 N/A SER 466.A N THR 462.A O no hydrogen 2.896 N/A SER 466.A OG GLY 475.A O no hydrogen 3.399 N/A SER 466.A OG THR 478.A OG1 no hydrogen 2.332 N/A SER 467.A N THR 463.A O no hydrogen 2.866 N/A LEU 468.A N PHE 464.A O no hydrogen 2.871 N/A PHE 469.A N VAL 465.A O no hydrogen 2.933 N/A LEU 470.A N SER 466.A O no hydrogen 3.123 N/A TYR 474.A N ASP 473.A OD1 no hydrogen 2.513 N/A GLY 475.A N GLY 471.A O no hydrogen 2.766 N/A LEU 476.A N LEU 472.A O no hydrogen 2.877 N/A ILE 477.A N ASP 473.A O no hydrogen 2.972 N/A THR 478.A N TYR 474.A O no hydrogen 2.944 N/A THR 478.A OG1 SER 466.A OG no hydrogen 2.332 N/A THR 478.A OG1 TYR 474.A O no hydrogen 3.235 N/A THR 478.A OG1 GLY 475.A O no hydrogen 3.076 N/A ALA 479.A N GLY 475.A O no hydrogen 2.872 N/A VAL 480.A N LEU 476.A O no hydrogen 2.925 N/A ILE 481.A N ILE 477.A O no hydrogen 2.986 N/A ILE 482.A N THR 478.A O no hydrogen 2.896 N/A ALA 483.A N ALA 479.A O no hydrogen 2.878 N/A LEU 484.A N VAL 480.A O no hydrogen 2.969 N/A MET 485.A N ILE 481.A O no hydrogen 2.870 N/A THR 486.A N ILE 482.A O no hydrogen 2.971 N/A THR 486.A OG1 ALA 483.A O no hydrogen 2.345 N/A VAL 487.A N LEU 484.A O no hydrogen 3.182 N/A TYR 489.A N MET 485.A O no hydrogen 2.936 N/A ARG 490.A N THR 486.A O no hydrogen 2.870 N/A THR 491.A N VAL 487.A O no hydrogen 2.959 N/A THR 491.A OG1 ILE 488.A O no hydrogen 2.955 N/A THR 491.A OG1 TYR 533.A OH no hydrogen 2.262 N/A GLN 492.A N TYR 489.A O no hydrogen 2.897 N/A GLN 492.A NE2 ALA 535.A O no hydrogen 2.771 N/A SER 493.A N TYR 489.A O no hydrogen 2.989 N/A SER 493.A OG SER 493.A O no hydrogen 2.314 N/A SER 495.A N ASN 529.A OD1 no hydrogen 3.099 N/A ILE 497.A N GLN 527.A O no hydrogen 3.125 N/A LEU 499.A N ILE 525.A O no hydrogen 3.053 N/A GLY 500.A N ILE 509.A O no hydrogen 2.702 N/A LEU 502.A N VAL 507.A O no hydrogen 2.796 N/A THR 505.A N LEU 502.A O no hydrogen 3.303 N/A THR 505.A OG1 LEU 502.A O no hydrogen 2.656 N/A THR 505.A OG1 PRO 503.A O no hydrogen 3.076 N/A TYR 508.A OH HIS 660.A ND1 no hydrogen 2.808 N/A ILE 509.A N GLY 500.A O no hydrogen 3.166 N/A ILE 511.A N VAL 498.A O no hydrogen 3.097 N/A LYS 524.A N THR 594.A O no hydrogen 3.218 N/A LYS 524.A NZ THR 548.A O no hydrogen 2.559 N/A PHE 526.A N ILE 596.A O no hydrogen 2.852 N/A ILE 532.A N PHE 604.A O no hydrogen 3.248 N/A TYR 533.A OH THR 491.A OG1 no hydrogen 2.262 N/A ASN 536.A N TYR 533.A O no hydrogen 2.970 N/A ASN 536.A ND2 PRO 531.A O no hydrogen 2.473 N/A TYR 540.A N ASN 536.A O no hydrogen 3.082 N/A SER 541.A N SER 537.A O no hydrogen 2.917 N/A SER 542.A N ASP 538.A O no hydrogen 2.955 N/A SER 542.A OG ASP 538.A O no hydrogen 2.832 N/A ALA 543.A N LEU 539.A O no hydrogen 2.855 N/A LEU 544.A N TYR 540.A O no hydrogen 2.883 N/A LYS 545.A N SER 541.A O no hydrogen 3.016 N/A LYS 545.A NZ GLU 619.A OE2 no hydrogen 3.217 N/A ARG 546.A N SER 542.A O no hydrogen 2.904 N/A LYS 547.A N ALA 543.A O no hydrogen 2.829 N/A THR 548.A N LEU 544.A O no hydrogen 2.976 N/A THR 548.A OG1 LEU 544.A O no hydrogen 2.272 N/A GLY 549.A N ARG 546.A O no hydrogen 3.289 N/A ALA 553.A N ASN 551.A OD1 no hydrogen 3.051 N/A ILE 555.A N ASN 551.A O no hydrogen 3.045 N/A LEU 556.A N PRO 552.A O no hydrogen 2.915 N/A GLY 557.A N ALA 553.A O no hydrogen 2.932 N/A ALA 558.A N PHE 554.A O no hydrogen 2.878 N/A ARG 559.A N ILE 555.A O no hydrogen 2.930 N/A ARG 559.A NH1 VAL 623.A O no hydrogen 3.436 N/A ARG 560.A N LEU 556.A O no hydrogen 2.921 N/A LYS 561.A N GLY 557.A O no hydrogen 2.918 N/A ALA 562.A N ALA 558.A O no hydrogen 2.878 N/A MET 563.A N ARG 559.A O no hydrogen 2.920 N/A LYS 564.A N ARG 560.A O no hydrogen 2.888 N/A LYS 565.A N LYS 561.A O no hydrogen 2.898 N/A TYR 566.A N ALA 562.A O no hydrogen 2.894 N/A ALA 567.A N LYS 564.A O no hydrogen 3.252 N/A ILE 572.A N PRO 570.A O no hydrogen 3.037 N/A SER 576.A N GLY 621.A O no hydrogen 3.158 N/A GLN 583.A NE2 GLU 581.A O no hydrogen 3.206 N/A GLY 589.A N PRO 587.A O no hydrogen 2.696 N/A HIS 593.A N GLY 522.A O no hydrogen 3.102 N/A THR 594.A OG1 TYR 626.A O no hydrogen 3.295 N/A ILE 595.A N TYR 626.A O no hydrogen 2.777 N/A ILE 596.A N LYS 524.A O no hydrogen 2.851 N/A LEU 597.A N TYR 628.A O no hydrogen 2.725 N/A ASP 598.A N PHE 526.A O no hydrogen 2.745 N/A PHE 599.A N ALA 630.A O no hydrogen 2.793 N/A THR 600.A N ASP 598.A OD1 no hydrogen 2.966 N/A THR 600.A OG1 ASP 598.A OD1 no hydrogen 2.752 N/A THR 600.A OG1 ASP 598.A OD2 no hydrogen 3.297 N/A MET 605.A N ASP 639.A OD2 no hydrogen 3.279 N/A GLY 609.A N ASP 606.A OD1 no hydrogen 3.349 N/A VAL 610.A N ASP 606.A O no hydrogen 2.984 N/A LYS 611.A N SER 607.A O no hydrogen 2.910 N/A THR 612.A N VAL 608.A O no hydrogen 2.945 N/A LEU 613.A N GLY 609.A O no hydrogen 2.935 N/A ALA 614.A N VAL 610.A O no hydrogen 2.914 N/A GLY 615.A N LYS 611.A O no hydrogen 2.935 N/A ILE 616.A N THR 612.A O no hydrogen 2.881 N/A VAL 617.A N LEU 613.A O no hydrogen 2.916 N/A LYS 618.A N ALA 614.A O no hydrogen 2.916 N/A GLU 619.A N GLY 615.A O no hydrogen 2.887 N/A TYR 620.A N ILE 616.A O no hydrogen 2.990 N/A TYR 620.A OH VAL 550.A O no hydrogen 2.743 N/A GLY 621.A N VAL 617.A O no hydrogen 2.884 N/A ASP 622.A N LYS 618.A O no hydrogen 2.882 N/A VAL 623.A N GLU 619.A O no hydrogen 3.000 N/A GLY 624.A N TYR 620.A O no hydrogen 3.010 N/A ILE 625.A N TYR 620.A O no hydrogen 2.630 N/A TYR 626.A N HIS 593.A O no hydrogen 3.040 N/A TYR 628.A N ILE 595.A O no hydrogen 2.884 N/A LEU 629.A N LEU 654.A O no hydrogen 3.143 N/A ALA 630.A N LEU 597.A O no hydrogen 2.932 N/A GLY 631.A N PHE 656.A O no hydrogen 2.930 N/A VAL 636.A N SER 633.A OG no hydrogen 3.421 N/A VAL 637.A N SER 633.A O no hydrogen 2.733 N/A SER 638.A N ALA 634.A O no hydrogen 2.891 N/A ASP 639.A N GLN 635.A O no hydrogen 2.913 N/A LEU 640.A N VAL 636.A O no hydrogen 2.886 N/A THR 641.A N VAL 637.A O no hydrogen 2.891 N/A THR 641.A OG1 VAL 637.A O no hydrogen 3.133 N/A GLN 642.A N SER 638.A O no hydrogen 2.887 N/A ASN 643.A ND2 ASP 639.A O no hydrogen 2.580 N/A GLN 644.A NE2 GLU 647.A OE2 no hydrogen 2.600 N/A PHE 645.A N ASN 643.A O no hydrogen 2.748 N/A LEU 654.A N LEU 651.A O no hydrogen 3.039 N/A PHE 656.A N LEU 629.A O no hydrogen 2.822 N/A HIS 657.A N PHE 11.A O no hydrogen 3.066 N/A SER 658.A OG ASP 661.A OD2 no hydrogen 3.305 N/A HIS 660.A ND1 TYR 508.A OH no hydrogen 2.808 N/A ALA 662.A N SER 658.A O no hydrogen 3.119 N/A VAL 663.A N ILE 659.A O no hydrogen 2.904 N/A LEU 664.A N HIS 660.A O no hydrogen 2.890 N/A GLY 665.A N ASP 661.A O no hydrogen 2.877 N/A SER 666.A N ALA 662.A O no hydrogen 2.934 N/A SER 666.A OG ALA 662.A O no hydrogen 3.332 N/A SER 666.A OG VAL 663.A O no hydrogen 2.627 N/A GLN 667.A N VAL 663.A O no hydrogen 2.932 N/A VAL 668.A N LEU 664.A O no hydrogen 2.837 N/A ARG 669.A N GLY 665.A O no hydrogen 2.955 N/A ARG 669.A NH2 HIS 593.A O no hydrogen 3.432 N/A GLU 670.A N SER 666.A O no hydrogen 2.924 N/A ALA 671.A N GLN 667.A O no hydrogen 2.908 N/A LEU 672.A N VAL 668.A O no hydrogen 2.900 N/A ALA 673.A N ARG 669.A O no hydrogen 2.880 N/A GLU 674.A N GLU 670.A O no hydrogen 3.337 N/A GLN 675.A N LEU 672.A O no hydrogen 3.131 N/A