Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6tra_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N ASN 309.A OD1 no hydrogen 2.766 N/A ASP 8.A N ALA 175.A O no hydrogen 2.678 N/A ASP 10.A N LYS 173.A O no hydrogen 2.935 N/A LYS 18.A NZ HIS 24.A ND1 no hydrogen 2.954 N/A TRP 19.A N PHE 16.A O no hydrogen 3.033 N/A ALA 20.A N GLU 17.A O no hydrogen 3.046 N/A THR 28.A N ASP 26.A OD1 no hydrogen 3.184 N/A ALA 30.A N ARG 27.A O no hydrogen 3.000 N/A GLN 34.A N GLY 32.A O no hydrogen 2.816 N/A THR 35.A OG1 THR 37.A OG1 no hydrogen 3.256 N/A THR 36.A OG1 GLN 709.A O no hydrogen 2.959 N/A THR 37.A OG1 THR 35.A OG1 no hydrogen 3.256 N/A TRP 38.A NE1 LEU 29.A O no hydrogen 3.379 N/A ILE 39.A N THR 36.A O no hydrogen 3.323 N/A ASN 41.A N THR 37.A O no hydrogen 2.912 N/A LEU 42.A N TRP 38.A O no hydrogen 2.926 N/A HIS 43.A N TRP 40.A O no hydrogen 2.881 N/A HIS 43.A ND1 ILE 39.A O no hydrogen 2.849 N/A ALA 44.A N TRP 40.A O no hydrogen 2.927 N/A LEU 45.A N ASN 41.A O no hydrogen 2.894 N/A THR 51.A N ASP 48.A O no hydrogen 3.001 N/A THR 51.A OG1 ASP 48.A O no hydrogen 2.425 N/A HIS 52.A N PHE 49.A O no hydrogen 3.197 N/A HIS 52.A NE2 LEU 45.A O no hydrogen 2.973 N/A THR 53.A N PHE 49.A O no hydrogen 3.220 N/A THR 53.A OG1 ASP 55.A O no hydrogen 3.506 N/A ILE 59.A N ASP 55.A O no hydrogen 3.272 N/A SER 60.A N LEU 56.A O no hydrogen 2.911 N/A SER 60.A OG LEU 56.A O no hydrogen 2.648 N/A ARG 61.A N GLU 57.A O no hydrogen 2.946 N/A ARG 61.A NE PRO 176.A O no hydrogen 2.934 N/A LYS 62.A N ASP 58.A O no hydrogen 2.891 N/A LYS 62.A NZ ASP 58.A OD2 no hydrogen 2.664 N/A LYS 62.A NZ TYR 171.A OH no hydrogen 3.258 N/A ILE 63.A N ILE 59.A O no hydrogen 2.966 N/A PHE 64.A N SER 60.A O no hydrogen 2.918 N/A SER 65.A N ARG 61.A O no hydrogen 2.939 N/A SER 65.A OG ARG 61.A O no hydrogen 3.237 N/A SER 65.A OG GLY 167.A O no hydrogen 3.370 N/A ALA 66.A N LYS 62.A O no hydrogen 2.921 N/A ALA 66.A N ILE 63.A O no hydrogen 3.199 N/A HIS 67.A N ILE 63.A O no hydrogen 3.028 N/A HIS 70.A N ALA 66.A O no hydrogen 3.005 N/A LEU 71.A N HIS 67.A O no hydrogen 2.935 N/A ALA 72.A N PHE 68.A O no hydrogen 2.908 N/A VAL 73.A N GLY 69.A O no hydrogen 2.939 N/A VAL 74.A N HIS 70.A O no hydrogen 2.989 N/A PHE 75.A N LEU 71.A O no hydrogen 2.893 N/A ILE 76.A N ALA 72.A O no hydrogen 2.907 N/A TRP 77.A N VAL 73.A O no hydrogen 2.963 N/A LEU 78.A N VAL 74.A O no hydrogen 2.942 N/A SER 79.A N PHE 75.A O no hydrogen 2.855 N/A SER 79.A OG PHE 75.A O no hydrogen 3.242 N/A SER 79.A OG ILE 76.A O no hydrogen 2.531 N/A GLY 80.A N ILE 76.A O no hydrogen 2.901 N/A MET 81.A N TRP 77.A O no hydrogen 2.974 N/A TYR 82.A N LEU 78.A O no hydrogen 2.971 N/A PHE 83.A N SER 79.A O no hydrogen 2.839 N/A HIS 84.A N GLY 80.A O no hydrogen 2.912 N/A GLY 85.A N MET 81.A O no hydrogen 2.945 N/A ALA 86.A N TYR 82.A O no hydrogen 2.884 N/A LYS 87.A N PHE 83.A O no hydrogen 2.925 N/A PHE 88.A N HIS 84.A O no hydrogen 3.255 N/A SER 89.A OG GLY 85.A O no hydrogen 2.020 N/A ASN 90.A N ASN 90.A OD1 no hydrogen 2.633 N/A ASN 90.A N SER 104.A O no hydrogen 3.115 N/A ASN 90.A ND2 LYS 102.A O no hydrogen 2.931 N/A TYR 91.A OH ILE 143.A O no hydrogen 2.726 N/A TRP 94.A N ASN 90.A O no hydrogen 3.171 N/A LEU 95.A N TYR 91.A O no hydrogen 2.915 N/A ALA 96.A N ALA 93.A O no hydrogen 2.988 N/A ASP 97.A N ALA 93.A O no hydrogen 3.426 N/A THR 99.A OG1 ASP 97.A OD2 no hydrogen 3.385 N/A LYS 102.A N VAL 121.A O no hydrogen 2.725 N/A SER 104.A N ASN 90.A OD1 no hydrogen 2.700 N/A SER 104.A OG PRO 103.A O no hydrogen 2.970 N/A VAL 108.A N ASN 118.A OD1 no hydrogen 3.012 N/A GLN 114.A NE2 TRP 109.A O no hydrogen 3.285 N/A ILE 116.A N GLY 113.A O no hydrogen 3.031 N/A LEU 117.A N GLN 114.A O no hydrogen 2.992 N/A ASN 118.A ND2 VAL 108.A O no hydrogen 2.862 N/A VAL 121.A N PHE 125.A O no hydrogen 3.323 N/A GLY 127.A N GLY 119.A O no hydrogen 3.222 N/A ILE 128.A N GLN 106.A O no hydrogen 2.912 N/A ILE 130.A N PRO 103.A O no hydrogen 3.167 N/A THR 131.A OG1 SER 383.A OG no hydrogen 2.942 N/A GLN 136.A NE2 TYR 373.A O no hydrogen 3.486 N/A LEU 137.A N GLY 133.A O no hydrogen 3.316 N/A TRP 138.A N LEU 134.A O no hydrogen 2.903 N/A ARG 139.A N PHE 135.A O no hydrogen 2.889 N/A ALA 140.A N GLN 136.A O no hydrogen 2.905 N/A SER 141.A N TRP 138.A O no hydrogen 3.173 N/A SER 141.A OG TRP 138.A O no hydrogen 2.802 N/A GLY 142.A N ARG 139.A O no hydrogen 3.323 N/A ILE 143.A N TRP 138.A O no hydrogen 3.015 N/A THR 144.A N GLN 148.A OE1 no hydrogen 2.804 N/A ASN 145.A N GLN 148.A OE1 no hydrogen 3.184 N/A GLN 148.A N ASN 145.A OD1 no hydrogen 3.386 N/A TYR 150.A N GLU 146.A O no hydrogen 2.927 N/A CYS 151.A N PHE 147.A O no hydrogen 2.919 N/A CYS 151.A SG PHE 147.A O no hydrogen 3.153 N/A THR 152.A N GLN 148.A O no hydrogen 2.928 N/A THR 152.A OG1 GLN 148.A O no hydrogen 2.475 N/A ALA 153.A N LEU 149.A O no hydrogen 2.903 N/A ILE 154.A N TYR 150.A O no hydrogen 2.977 N/A GLY 155.A N CYS 151.A O no hydrogen 2.909 N/A GLY 156.A N THR 152.A O no hydrogen 2.914 N/A LEU 157.A N ALA 153.A O no hydrogen 2.985 N/A VAL 158.A N ILE 154.A O no hydrogen 2.920 N/A MET 159.A N GLY 155.A O no hydrogen 2.897 N/A ALA 160.A N GLY 156.A O no hydrogen 2.903 N/A GLY 161.A N LEU 157.A O no hydrogen 2.995 N/A LEU 162.A N VAL 158.A O no hydrogen 2.873 N/A MET 163.A N MET 159.A O no hydrogen 2.895 N/A LEU 164.A N ALA 160.A O no hydrogen 2.961 N/A PHE 165.A N GLY 161.A O no hydrogen 2.940 N/A ALA 166.A N LEU 162.A O no hydrogen 2.884 N/A GLY 167.A N MET 163.A O no hydrogen 2.905 N/A TRP 168.A N LEU 164.A O no hydrogen 3.010 N/A PHE 169.A N PHE 165.A O no hydrogen 2.853 N/A HIS 170.A N ALA 166.A O no hydrogen 2.881 N/A TYR 171.A N GLY 167.A O no hydrogen 2.997 N/A HIS 172.A N TRP 168.A O no hydrogen 2.891 N/A HIS 172.A ND1 VAL 12.A O no hydrogen 2.749 N/A LYS 173.A N PHE 169.A O no hydrogen 2.948 N/A LYS 173.A NZ ASP 10.A OD1 no hydrogen 2.685 N/A LYS 173.A NZ ASP 10.A OD2 no hydrogen 3.518 N/A ARG 174.A N PHE 169.A O no hydrogen 2.612 N/A ALA 175.A N ASP 8.A O no hydrogen 3.005 N/A LYS 177.A N VAL 6.A O no hydrogen 3.151 N/A LYS 177.A NZ ASP 8.A OD2 no hydrogen 2.307 N/A TRP 180.A N LYS 177.A O no hydrogen 3.221 N/A PHE 181.A N LEU 178.A O no hydrogen 2.659 N/A GLN 182.A N LEU 178.A O no hydrogen 2.897 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.915 N/A LEU 188.A N VAL 184.A O no hydrogen 2.920 N/A ASN 189.A N GLU 185.A O no hydrogen 2.903 N/A ASN 189.A ND2 GLY 303.A O no hydrogen 2.957 N/A ASN 189.A ND2 TYR 306.A O no hydrogen 3.519 N/A HIS 190.A N SER 186.A O no hydrogen 2.921 N/A HIS 190.A ND1 SER 186.A O no hydrogen 2.640 N/A HIS 191.A N MET 187.A O no hydrogen 2.894 N/A LEU 192.A N LEU 188.A O no hydrogen 2.934 N/A ALA 193.A N ASN 189.A O no hydrogen 3.153 N/A GLY 194.A N HIS 190.A O no hydrogen 2.465 N/A LEU 195.A N HIS 190.A O no hydrogen 2.929 N/A GLY 197.A N LEU 192.A O no hydrogen 3.171 N/A LEU 198.A N ALA 193.A O no hydrogen 3.312 N/A SER 200.A N LEU 196.A O no hydrogen 2.920 N/A SER 200.A OG LEU 196.A O no hydrogen 3.029 N/A SER 200.A OG GLY 197.A O no hydrogen 2.803 N/A SER 200.A OG HIS 292.A O no hydrogen 3.405 N/A LEU 201.A N GLY 197.A O no hydrogen 2.907 N/A ALA 202.A N LEU 198.A O no hydrogen 2.889 N/A TRP 203.A N GLY 199.A O no hydrogen 2.915 N/A ALA 204.A N SER 200.A O no hydrogen 2.889 N/A GLY 205.A N LEU 201.A O no hydrogen 2.942 N/A HIS 206.A N ALA 202.A O no hydrogen 2.914 N/A HIS 206.A NE2 SER 141.A O no hydrogen 3.163 N/A GLN 207.A N TRP 203.A O no hydrogen 2.886 N/A ILE 208.A N ALA 204.A O no hydrogen 2.911 N/A HIS 209.A N GLY 205.A O no hydrogen 2.974 N/A VAL 210.A N HIS 206.A O no hydrogen 2.819 N/A VAL 210.A N GLN 207.A O no hydrogen 3.106 N/A SER 211.A N GLN 207.A O no hydrogen 2.898 N/A SER 211.A OG GLN 207.A O no hydrogen 3.278 N/A LEU 212.A N GLN 207.A O no hydrogen 3.087 N/A ASN 215.A N SER 211.A O no hydrogen 3.332 N/A ASN 215.A ND2 ARG 139.A O no hydrogen 3.177 N/A ASN 215.A ND2 SER 211.A O no hydrogen 2.693 N/A LYS 216.A N LEU 212.A O no hydrogen 2.894 N/A LEU 217.A N PRO 213.A O no hydrogen 2.911 N/A LEU 218.A N ILE 214.A O no hydrogen 2.877 N/A ASP 219.A N ASN 215.A O no hydrogen 2.913 N/A ALA 220.A N LYS 216.A O no hydrogen 3.234 N/A ALA 220.A N LEU 217.A O no hydrogen 3.067 N/A VAL 222.A N LEU 217.A O no hydrogen 3.292 N/A LYS 225.A NZ GLU 92.A OE1 no hydrogen 3.115 N/A ASP 226.A N ALA 223.A O no hydrogen 2.969 N/A ILE 227.A N ALA 223.A O no hydrogen 3.170 N/A GLU 232.A N LEU 229.A O no hydrogen 2.836 N/A ILE 234.A N HIS 231.A O no hydrogen 3.131 N/A LEU 235.A N HIS 231.A O no hydrogen 2.928 N/A ASN 236.A N GLU 232.A O no hydrogen 3.371 N/A ALA 241.A N PRO 237.A O no hydrogen 2.894 N/A ALA 241.A N SER 238.A O no hydrogen 3.083 N/A GLU 242.A N SER 238.A O no hydrogen 2.939 N/A TRP 249.A NE1 TYR 244.A O no hydrogen 2.694 N/A PHE 258.A N VAL 255.A O no hydrogen 3.202 N/A PHE 259.A N VAL 255.A O no hydrogen 3.426 N/A THR 260.A OG1 ILE 256.A O no hydrogen 2.876 N/A ASN 262.A N PRO 257.A O no hydrogen 2.877 N/A TRP 263.A NE1 PHE 258.A O no hydrogen 3.085 N/A ALA 265.A N ASN 262.A O no hydrogen 2.904 N/A TYR 266.A N TRP 263.A O no hydrogen 3.427 N/A TYR 266.A OH GLY 254.A O no hydrogen 2.017 N/A SER 267.A OG ALA 264.A O no hydrogen 2.914 N/A THR 271.A OG1 ASP 287.A OD1 no hydrogen 2.704 N/A ASN 273.A N ASP 287.A OD1 no hydrogen 3.207 N/A GLY 274.A N ASP 287.A OD2 no hydrogen 3.323 N/A ASN 277.A N GLY 282.A O no hydrogen 2.536 N/A VAL 279.A N ASN 277.A OD1 no hydrogen 3.095 N/A GLY 281.A N ASN 277.A O no hydrogen 3.018 N/A LEU 283.A N PRO 369.A O no hydrogen 2.869 N/A THR 288.A N TRP 284.A O no hydrogen 3.343 N/A THR 288.A OG1 LEU 285.A O no hydrogen 2.496 N/A ALA 289.A N LEU 285.A O no hydrogen 2.897 N/A HIS 290.A N SER 286.A O no hydrogen 2.970 N/A HIS 291.A N ASP 287.A O no hydrogen 2.862 N/A HIS 292.A N THR 288.A O no hydrogen 2.897 N/A HIS 292.A ND1 THR 288.A O no hydrogen 2.607 N/A LEU 293.A N ALA 289.A O no hydrogen 2.961 N/A ALA 294.A N HIS 290.A O no hydrogen 2.922 N/A ILE 295.A N HIS 291.A O no hydrogen 2.938 N/A ALA 296.A N HIS 292.A O no hydrogen 2.894 N/A VAL 297.A N LEU 293.A O no hydrogen 2.972 N/A LEU 298.A N ALA 294.A O no hydrogen 2.925 N/A PHE 299.A N ILE 295.A O no hydrogen 2.867 N/A ILE 300.A N ALA 296.A O no hydrogen 2.917 N/A ILE 301.A N VAL 297.A O no hydrogen 2.942 N/A ALA 302.A N LEU 298.A O no hydrogen 2.898 N/A GLY 303.A N PHE 299.A O no hydrogen 2.914 N/A HIS 304.A N ILE 301.A O no hydrogen 2.985 N/A HIS 304.A ND1 ILE 300.A O no hydrogen 2.407 N/A ARG 307.A N HIS 314.A O no hydrogen 2.756 N/A ARG 307.A NE GLY 311.A O no hydrogen 2.650 N/A ASN 309.A ND2 VAL 3.A O no hydrogen 2.935 N/A ILE 312.A N TRP 310.A O no hydrogen 2.632 N/A HIS 314.A N MET 305.A O no hydrogen 2.673 N/A LYS 317.A NZ GLU 337.A OE2 no hydrogen 3.219 N/A HIS 323.A N LEU 320.A O no hydrogen 3.391 N/A HIS 323.A ND1 ILE 319.A O no hydrogen 2.542 N/A LYS 324.A N ALA 322.A O no hydrogen 3.239 N/A THR 328.A N GLY 325.A O no hydrogen 3.449 N/A GLY 329.A N GLY 325.A O no hydrogen 2.994 N/A ALA 330.A N ASN 418.A O no hydrogen 3.159 N/A LYS 333.A N ALA 330.A O no hydrogen 3.383 N/A LYS 333.A NZ GLU 321.A OE2 no hydrogen 2.997 N/A TYR 336.A OH GLU 185.A OE1 no hydrogen 3.412 N/A TYR 336.A OH GLU 185.A OE2 no hydrogen 2.692 N/A GLU 337.A N GLU 337.A OE1 no hydrogen 2.388 N/A VAL 338.A N GLY 334.A O no hydrogen 3.352 N/A LEU 339.A N LEU 335.A O no hydrogen 2.900 N/A THR 340.A N TYR 336.A O no hydrogen 2.890 N/A THR 340.A N GLU 337.A O no hydrogen 3.146 N/A THR 340.A OG1 TYR 336.A O no hydrogen 2.486 N/A THR 340.A OG1 GLU 337.A O no hydrogen 3.337 N/A THR 341.A OG1 GLU 337.A O no hydrogen 2.806 N/A SER 342.A OG VAL 338.A O no hydrogen 2.606 N/A TRP 343.A NE1 SER 60.A OG no hydrogen 3.089 N/A LEU 347.A N TRP 343.A O no hydrogen 2.892 N/A ALA 348.A N HIS 344.A O no hydrogen 2.862 N/A ILE 349.A N ALA 345.A O no hydrogen 2.987 N/A ASN 350.A N GLN 346.A O no hydrogen 2.912 N/A LEU 351.A N LEU 347.A O no hydrogen 2.812 N/A ALA 352.A N ALA 348.A O no hydrogen 2.975 N/A MET 353.A N ILE 349.A O no hydrogen 2.951 N/A MET 354.A N ASN 350.A O no hydrogen 2.858 N/A GLY 355.A N LEU 351.A O no hydrogen 2.938 N/A SER 356.A N ALA 352.A O no hydrogen 2.973 N/A SER 356.A OG ALA 352.A O no hydrogen 2.819 N/A LEU 357.A N MET 353.A O no hydrogen 2.872 N/A SER 358.A N MET 354.A O no hydrogen 2.899 N/A SER 358.A OG HIS 388.A O no hydrogen 3.105 N/A ILE 359.A N GLY 355.A O no hydrogen 2.994 N/A ILE 360.A N SER 356.A O no hydrogen 2.889 N/A VAL 361.A N LEU 357.A O no hydrogen 2.853 N/A ALA 362.A N SER 358.A O no hydrogen 2.963 N/A GLN 363.A N ILE 359.A O no hydrogen 2.937 N/A GLN 363.A NE2 TYR 366.A OH no hydrogen 3.246 N/A HIS 364.A N ILE 360.A O no hydrogen 2.874 N/A MET 365.A N VAL 361.A O no hydrogen 2.960 N/A MET 368.A N HIS 364.A O no hydrogen 3.238 N/A TYR 373.A N THR 280.A O no hydrogen 2.860 N/A ASP 377.A N LEU 374.A O no hydrogen 3.148 N/A TYR 378.A OH VAL 515.A O no hydrogen 3.293 N/A TYR 378.A OH GLY 614.A O no hydrogen 3.275 N/A THR 380.A OG1 ASP 377.A OD2 no hydrogen 2.130 N/A GLN 381.A N ASP 377.A O no hydrogen 3.232 N/A GLN 381.A NE2 TYR 366.A O no hydrogen 3.563 N/A LEU 382.A N TYR 378.A O no hydrogen 2.964 N/A SER 383.A N PRO 379.A O no hydrogen 2.905 N/A SER 383.A OG THR 131.A OG1 no hydrogen 2.942 N/A SER 383.A OG PRO 379.A O no hydrogen 2.887 N/A LEU 384.A N THR 380.A O no hydrogen 2.909 N/A PHE 385.A N GLN 381.A O no hydrogen 2.984 N/A THR 386.A N LEU 382.A O no hydrogen 2.984 N/A THR 386.A OG1 LEU 382.A O no hydrogen 2.663 N/A HIS 387.A N SER 383.A O no hydrogen 2.865 N/A HIS 388.A N LEU 384.A O no hydrogen 2.991 N/A MET 389.A N PHE 385.A O no hydrogen 2.970 N/A TRP 390.A N THR 386.A O no hydrogen 3.004 N/A ILE 391.A N HIS 387.A O no hydrogen 2.984 N/A GLY 392.A N HIS 388.A O no hydrogen 2.930 N/A GLY 393.A N MET 389.A O no hydrogen 2.978 N/A PHE 394.A N TRP 390.A O no hydrogen 3.009 N/A LEU 395.A N ILE 391.A O no hydrogen 2.992 N/A VAL 396.A N GLY 392.A O no hydrogen 2.929 N/A VAL 397.A N GLY 393.A O no hydrogen 3.043 N/A GLY 398.A N PHE 394.A O no hydrogen 2.953 N/A GLY 399.A N LEU 395.A O no hydrogen 2.900 N/A ALA 400.A N VAL 396.A O no hydrogen 3.027 N/A ALA 401.A N VAL 397.A O no hydrogen 2.939 N/A HIS 402.A N GLY 398.A O no hydrogen 2.950 N/A GLY 403.A N GLY 399.A O no hydrogen 2.921 N/A ALA 404.A N ALA 400.A O no hydrogen 3.002 N/A ILE 405.A N ALA 401.A O no hydrogen 2.944 N/A PHE 406.A N HIS 402.A O no hydrogen 2.893 N/A MET 407.A N GLY 403.A O no hydrogen 2.962 N/A VAL 408.A N ALA 404.A O no hydrogen 2.955 N/A ARG 409.A N ILE 405.A O no hydrogen 2.881 N/A ARG 409.A NH1 ASP 48.A OD1 no hydrogen 3.112 N/A ARG 409.A NH1 ASP 50.A OD2 no hydrogen 2.623 N/A ASP 410.A N PHE 406.A O no hydrogen 2.841 N/A TYR 411.A N PHE 406.A O no hydrogen 2.892 N/A ASN 416.A ND2 ASP 412.A O no hydrogen 3.123 N/A ASN 419.A ND2 LYS 333.A O no hydrogen 3.047 N/A ASN 419.A ND2 ASN 416.A OD1 no hydrogen 2.918 N/A VAL 420.A N GLY 331.A O no hydrogen 3.201 N/A ASP 422.A N ASN 419.A OD1 no hydrogen 2.870 N/A ARG 423.A N ASN 419.A O no hydrogen 2.797 N/A ARG 423.A NE PHE 327.A O no hydrogen 3.347 N/A ARG 423.A NH2 PHE 327.A O no hydrogen 3.149 N/A VAL 424.A N VAL 420.A O no hydrogen 2.907 N/A LEU 425.A N LEU 421.A O no hydrogen 2.956 N/A ARG 426.A NE ASP 422.A OD2 no hydrogen 3.018 N/A HIS 427.A ND1 ARG 423.A O no hydrogen 2.425 N/A ARG 428.A NH1 LEU 549.A O no hydrogen 2.974 N/A ARG 428.A NH1 SER 553.A O no hydrogen 3.082 N/A ILE 431.A N HIS 427.A O no hydrogen 3.036 N/A ILE 432.A N ARG 428.A O no hydrogen 2.904 N/A SER 433.A N ASP 429.A O no hydrogen 2.880 N/A SER 433.A OG ASP 429.A O no hydrogen 2.547 N/A HIS 434.A N ALA 430.A O no hydrogen 3.014 N/A HIS 434.A ND1 ALA 430.A O no hydrogen 2.667 N/A LEU 435.A N ILE 431.A O no hydrogen 2.948 N/A ASN 436.A N ILE 432.A O no hydrogen 2.826 N/A TRP 437.A N SER 433.A O no hydrogen 2.945 N/A VAL 438.A N HIS 434.A O no hydrogen 2.976 N/A CYS 439.A N LEU 435.A O no hydrogen 2.899 N/A CYS 439.A SG LEU 435.A O no hydrogen 3.119 N/A ILE 440.A N ASN 436.A O no hydrogen 2.948 N/A PHE 441.A N TRP 437.A O no hydrogen 2.914 N/A LEU 442.A N VAL 438.A O no hydrogen 2.880 N/A GLY 443.A N CYS 439.A O no hydrogen 2.875 N/A PHE 444.A N ILE 440.A O no hydrogen 2.963 N/A HIS 445.A N PHE 441.A O no hydrogen 2.952 N/A HIS 445.A ND1 PHE 441.A O no hydrogen 2.778 N/A SER 446.A OG LEU 442.A O no hydrogen 2.318 N/A SER 446.A OG HIS 531.A O no hydrogen 3.426 N/A PHE 447.A N GLY 443.A O no hydrogen 2.944 N/A GLY 448.A N PHE 444.A O no hydrogen 2.854 N/A TYR 450.A OH ALA 634.A O no hydrogen 3.204 N/A VAL 451.A N PHE 447.A O no hydrogen 2.974 N/A HIS 452.A N GLY 448.A O no hydrogen 2.806 N/A HIS 452.A NE2 ASP 464.A O no hydrogen 2.702 N/A ASN 453.A N LEU 449.A O no hydrogen 2.913 N/A ASN 453.A ND2 PHE 466.A O no hydrogen 2.705 N/A ASP 454.A N TYR 450.A O no hydrogen 2.896 N/A THR 455.A N VAL 451.A O no hydrogen 2.922 N/A THR 455.A OG1 VAL 451.A O no hydrogen 2.942 N/A MET 456.A N HIS 452.A O no hydrogen 2.902 N/A ARG 457.A N ASN 453.A O no hydrogen 2.876 N/A ARG 457.A NH2 GLN 632.A O no hydrogen 2.935 N/A ALA 458.A N ASP 454.A O no hydrogen 2.933 N/A PHE 459.A N THR 455.A O no hydrogen 2.909 N/A ARG 461.A N MET 456.A O no hydrogen 2.767 N/A ARG 461.A NE ASP 464.A OD2 no hydrogen 2.982 N/A ARG 461.A NH2 ASP 464.A OD2 no hydrogen 3.483 N/A ASP 464.A N ARG 461.A O no hydrogen 3.243 N/A PHE 466.A N ASN 453.A OD1 no hydrogen 3.391 N/A SER 467.A N ILE 471.A O no hydrogen 3.212 N/A ILE 471.A N MET 465.A O no hydrogen 2.755 N/A LEU 473.A N THR 524.A OG1 no hydrogen 3.375 N/A GLN 474.A NE2 GLN 472.A OE1 no hydrogen 2.864 N/A ALA 478.A N PRO 475.A O no hydrogen 3.094 N/A GLN 479.A N PRO 475.A O no hydrogen 3.215 N/A GLN 479.A NE2 GLN 474.A OE1 no hydrogen 3.693 N/A GLN 479.A NE2 LEU 522.A O no hydrogen 3.681 N/A TRP 480.A N VAL 476.A O no hydrogen 2.916 N/A GLN 482.A N ALA 478.A O no hydrogen 2.905 N/A GLN 482.A NE2 ILE 520.A O no hydrogen 3.012 N/A ASN 483.A N GLN 479.A O no hydrogen 2.917 N/A LEU 484.A N TRP 480.A O no hydrogen 2.926 N/A HIS 485.A N VAL 481.A O no hydrogen 2.886 N/A THR 486.A N GLN 482.A O no hydrogen 2.893 N/A THR 486.A OG1 GLN 482.A O no hydrogen 2.566 N/A LEU 487.A N ASN 483.A O no hydrogen 2.909 N/A LEU 487.A N LEU 484.A O no hydrogen 3.003 N/A GLY 491.A N ALA 488.A O no hydrogen 2.618 N/A ALA 493.A N ALA 488.A O no hydrogen 3.143 N/A ALA 496.A N ALA 493.A O no hydrogen 3.222 N/A ALA 497.A N ASN 273.A O no hydrogen 3.031 N/A ALA 498.A N ASN 273.A O no hydrogen 2.934 N/A THR 499.A OG1 SER 501.A O no hydrogen 3.105 N/A SER 501.A OG ALA 367.A O no hydrogen 2.967 N/A ALA 503.A N SER 501.A OG no hydrogen 3.003 N/A VAL 508.A N ASP 507.A OD1 no hydrogen 2.482 N/A VAL 509.A N MET 517.A O no hydrogen 3.205 N/A VAL 511.A N LYS 514.A O no hydrogen 3.073 N/A LYS 514.A N VAL 511.A O no hydrogen 3.498 N/A LYS 514.A NZ THR 376.A O no hydrogen 2.433 N/A LYS 514.A NZ GLY 746.A O no hydrogen 2.912 N/A VAL 515.A N GLY 614.A O no hydrogen 2.873 N/A ALA 516.A N VAL 509.A O no hydrogen 2.710 N/A ILE 520.A N ALA 503.A O no hydrogen 3.039 N/A GLY 523.A N ASP 526.A OD2 no hydrogen 2.717 N/A THR 524.A OG1 ASP 468.A OD1 no hydrogen 3.012 N/A PHE 527.A N GLY 523.A O no hydrogen 3.100 N/A MET 528.A N THR 524.A O no hydrogen 2.930 N/A VAL 529.A N ALA 525.A O no hydrogen 2.945 N/A HIS 530.A N ASP 526.A O no hydrogen 2.873 N/A HIS 530.A ND1 ASP 526.A O no hydrogen 2.555 N/A HIS 531.A N PHE 527.A O no hydrogen 3.005 N/A HIS 531.A ND1 PHE 527.A O no hydrogen 2.855 N/A ILE 532.A N MET 528.A O no hydrogen 2.943 N/A HIS 533.A N VAL 529.A O no hydrogen 2.911 N/A HIS 533.A NE2 HIS 603.A ND1 no hydrogen 3.234 N/A ALA 534.A N HIS 530.A O no hydrogen 2.970 N/A PHE 535.A N HIS 531.A O no hydrogen 2.912 N/A THR 536.A N ILE 532.A O no hydrogen 2.940 N/A THR 536.A OG1 ILE 532.A O no hydrogen 3.106 N/A THR 536.A OG1 HIS 533.A O no hydrogen 2.671 N/A ILE 537.A N HIS 533.A O no hydrogen 2.948 N/A HIS 538.A N ALA 534.A O no hydrogen 2.918 N/A HIS 538.A ND1 ALA 534.A O no hydrogen 2.736 N/A VAL 539.A N PHE 535.A O no hydrogen 2.984 N/A THR 540.A N THR 536.A O no hydrogen 2.990 N/A THR 540.A OG1 THR 536.A O no hydrogen 2.821 N/A VAL 541.A N ILE 537.A O no hydrogen 2.922 N/A LEU 542.A N HIS 538.A O no hydrogen 2.862 N/A ILE 543.A N VAL 539.A O no hydrogen 3.003 N/A LEU 544.A N THR 540.A O no hydrogen 2.971 N/A LEU 545.A N VAL 541.A O no hydrogen 2.824 N/A LYS 546.A N LEU 542.A O no hydrogen 2.894 N/A LYS 546.A NZ HIS 585.A NE2 no hydrogen 3.232 N/A GLY 547.A N ILE 543.A O no hydrogen 2.970 N/A VAL 548.A N LEU 544.A O no hydrogen 2.948 N/A LEU 549.A N LEU 545.A O no hydrogen 2.896 N/A PHE 550.A N LYS 546.A O no hydrogen 3.150 N/A ARG 552.A NH1 MET 407.A O no hydrogen 2.668 N/A SER 554.A N ILE 557.A O no hydrogen 3.096 N/A SER 554.A OG ILE 557.A O no hydrogen 3.351 N/A ARG 555.A NH1 ASP 429.A OD1 no hydrogen 2.513 N/A ILE 557.A N SER 554.A OG no hydrogen 3.229 N/A LYS 560.A NZ VAL 580.A O no hydrogen 3.450 N/A ASP 570.A N THR 577.A OG1 no hydrogen 2.839 N/A GLY 571.A N THR 577.A OG1 no hydrogen 2.893 N/A ARG 574.A NH1 ASP 570.A OD2 no hydrogen 2.450 N/A ARG 574.A NH2 ASP 570.A OD2 no hydrogen 2.855 N/A GLY 576.A N GLY 573.A O no hydrogen 2.754 N/A THR 577.A N GLY 571.A O no hydrogen 2.951 N/A THR 577.A OG1 GLY 571.A O no hydrogen 3.051 N/A SER 581.A N ASP 584.A OD2 no hydrogen 3.092 N/A SER 581.A OG PHE 567.A O no hydrogen 3.113 N/A SER 581.A OG ASP 584.A OD2 no hydrogen 2.406 N/A TRP 583.A N PHE 565.A O no hydrogen 3.324 N/A HIS 585.A ND1 SER 581.A O no hydrogen 2.687 N/A VAL 586.A N GLY 582.A O no hydrogen 2.943 N/A PHE 587.A N TRP 583.A O no hydrogen 2.898 N/A LEU 588.A N ASP 584.A O no hydrogen 2.918 N/A GLY 589.A N HIS 585.A O no hydrogen 2.863 N/A LEU 590.A N VAL 586.A O no hydrogen 2.962 N/A MET 593.A N GLY 589.A O no hydrogen 2.902 N/A TYR 594.A N LEU 590.A O no hydrogen 2.911 N/A ASN 595.A N PHE 591.A O no hydrogen 2.937 N/A CYS 596.A N TRP 592.A O no hydrogen 2.898 N/A CYS 596.A SG THR 536.A OG1 no hydrogen 3.301 N/A ILE 597.A N MET 593.A O no hydrogen 2.919 N/A SER 598.A N TYR 594.A O no hydrogen 2.919 N/A SER 598.A OG TYR 594.A O no hydrogen 2.489 N/A VAL 599.A N ASN 595.A O no hydrogen 3.011 N/A VAL 600.A N CYS 596.A O no hydrogen 2.921 N/A ILE 601.A N ILE 597.A O no hydrogen 2.905 N/A PHE 602.A N SER 598.A O no hydrogen 2.950 N/A HIS 603.A N VAL 599.A O no hydrogen 2.928 N/A HIS 603.A ND1 HIS 533.A NE2 no hydrogen 3.234 N/A PHE 604.A N VAL 600.A O no hydrogen 2.916 N/A SER 605.A N ILE 601.A O no hydrogen 2.892 N/A SER 605.A OG GLN 609.A OE1 no hydrogen 2.329 N/A TRP 606.A N PHE 602.A O no hydrogen 2.953 N/A TRP 606.A NE1 ASN 629.A OD1 no hydrogen 2.873 N/A LYS 607.A N HIS 603.A O no hydrogen 2.904 N/A LYS 607.A NZ VAL 521.A O no hydrogen 2.669 N/A LYS 607.A NZ ASP 526.A OD1 no hydrogen 3.265 N/A LYS 607.A NZ ASP 526.A OD2 no hydrogen 3.393 N/A LYS 607.A NZ ASP 611.A OD2 no hydrogen 3.221 N/A MET 608.A N PHE 604.A O no hydrogen 2.942 N/A GLN 609.A N SER 605.A O no hydrogen 2.930 N/A SER 610.A N TRP 606.A O no hydrogen 2.950 N/A SER 610.A N LYS 607.A O no hydrogen 3.323 N/A SER 610.A OG TRP 606.A O no hydrogen 2.830 N/A SER 610.A OG THR 626.A OG1 no hydrogen 2.581 N/A SER 610.A OG ASN 629.A OD1 no hydrogen 2.985 N/A ASP 611.A N LYS 607.A O no hydrogen 2.879 N/A VAL 612.A N MET 608.A O no hydrogen 2.943 N/A TRP 613.A N MET 608.A O no hydrogen 2.672 N/A GLY 614.A N TYR 378.A OH no hydrogen 3.331 N/A THR 615.A N SER 623.A O no hydrogen 3.292 N/A VAL 616.A N GLY 513.A O no hydrogen 2.603 N/A ALA 617.A N THR 621.A O no hydrogen 3.502 N/A GLY 620.A N ALA 617.A O no hydrogen 2.825 N/A SER 623.A N THR 615.A O no hydrogen 3.121 N/A ILE 625.A N GLN 609.A O no hydrogen 3.278 N/A THR 626.A OG1 SER 610.A OG no hydrogen 2.581 N/A THR 626.A OG1 ASN 629.A OD1 no hydrogen 2.969 N/A SER 633.A OG ASN 629.A O no hydrogen 3.236 N/A SER 633.A OG ASP 643.A OD2 no hydrogen 3.429 N/A THR 636.A OG1 SER 633.A O no hydrogen 3.425 N/A ILE 637.A N ASP 454.A OD1 no hydrogen 2.869 N/A ASN 638.A N ASP 454.A OD2 no hydrogen 3.436 N/A GLY 639.A N THR 636.A O no hydrogen 3.200 N/A GLY 639.A N THR 636.A OG1 no hydrogen 3.181 N/A TRP 640.A N THR 636.A O no hydrogen 3.246 N/A TRP 640.A NE1 ALA 634.A O no hydrogen 3.012 N/A LEU 641.A N ILE 637.A O no hydrogen 2.963 N/A ARG 642.A NE ASP 643.A OD2 no hydrogen 3.452 N/A ARG 642.A NH2 ASP 643.A OD2 no hydrogen 3.357 N/A ASP 643.A N GLY 639.A O no hydrogen 3.020 N/A LEU 645.A N TRP 640.A O no hydrogen 3.310 N/A GLN 648.A N PHE 644.A O no hydrogen 3.265 N/A SER 650.A N ALA 647.A O no hydrogen 3.047 N/A SER 650.A OG ALA 647.A O no hydrogen 2.877 N/A SER 655.A OG GLN 651.A O no hydrogen 2.599 N/A SER 655.A OG LEU 660.A O no hydrogen 3.258 N/A SER 658.A OG SER 655.A O no hydrogen 3.266 N/A LEU 660.A N SER 658.A OG no hydrogen 3.195 N/A SER 661.A OG SER 658.A O no hydrogen 3.438 N/A TYR 663.A N LEU 660.A O no hydrogen 3.143 N/A LEU 665.A N SER 661.A O no hydrogen 2.950 N/A LEU 666.A N ALA 662.A O no hydrogen 2.911 N/A PHE 667.A N TYR 663.A O no hydrogen 2.829 N/A LEU 668.A N GLY 664.A O no hydrogen 3.024 N/A GLY 669.A N LEU 665.A O no hydrogen 2.899 N/A ALA 670.A N LEU 666.A O no hydrogen 2.829 N/A HIS 671.A N PHE 667.A O no hydrogen 2.996 N/A HIS 671.A ND1 PHE 667.A O no hydrogen 3.095 N/A PHE 672.A N LEU 668.A O no hydrogen 2.921 N/A ILE 673.A N GLY 669.A O no hydrogen 2.923 N/A TRP 674.A N ALA 670.A O no hydrogen 2.879 N/A ALA 675.A N HIS 671.A O no hydrogen 2.979 N/A PHE 676.A N PHE 672.A O no hydrogen 2.864 N/A SER 677.A N ILE 673.A O no hydrogen 2.981 N/A SER 677.A N TRP 674.A O no hydrogen 3.093 N/A SER 677.A OG TRP 674.A O no hydrogen 2.450 N/A LEU 678.A N ALA 675.A O no hydrogen 3.348 N/A MET 679.A N PHE 676.A O no hydrogen 3.212 N/A PHE 680.A N SER 677.A O no hydrogen 3.011 N/A LEU 681.A N SER 677.A O no hydrogen 2.984 N/A PHE 682.A N LEU 678.A O no hydrogen 3.203 N/A SER 683.A OG MET 679.A O no hydrogen 2.600 N/A ARG 685.A NE ALA 712.A O no hydrogen 3.359 N/A GLN 689.A N ARG 685.A O no hydrogen 2.922 N/A GLU 690.A N GLY 686.A O no hydrogen 2.942 N/A LEU 691.A N TYR 687.A O no hydrogen 2.956 N/A ILE 692.A N TRP 688.A O no hydrogen 2.861 N/A GLU 693.A N GLN 689.A O no hydrogen 2.951 N/A ILE 695.A N LEU 691.A O no hydrogen 3.025 N/A VAL 696.A N ILE 692.A O no hydrogen 2.832 N/A TRP 697.A N GLU 693.A O no hydrogen 2.931 N/A ALA 698.A N SER 694.A O no hydrogen 2.946 N/A HIS 699.A N ILE 695.A O no hydrogen 2.948 N/A HIS 699.A ND1 ILE 695.A O no hydrogen 2.980 N/A ASN 700.A N VAL 696.A O no hydrogen 2.858 N/A ASN 700.A ND2 VAL 696.A O no hydrogen 3.186 N/A LYS 701.A N TRP 697.A O no hydrogen 2.924 N/A LEU 702.A N HIS 699.A O no hydrogen 3.068 N/A LYS 703.A N ASN 700.A O no hydrogen 3.222 N/A VAL 704.A N HIS 699.A O no hydrogen 2.934 N/A ALA 712.A N GLN 689.A OE1 no hydrogen 2.541 N/A GLN 717.A N SER 714.A OG no hydrogen 3.162 N/A GLY 718.A N SER 714.A O no hydrogen 3.177 N/A ALA 720.A N ILE 716.A O no hydrogen 2.947 N/A VAL 721.A N GLN 717.A O no hydrogen 2.878 N/A GLY 722.A N GLY 718.A O no hydrogen 2.923 N/A VAL 723.A N ARG 719.A O no hydrogen 2.929 N/A ALA 724.A N ALA 720.A O no hydrogen 2.932 N/A HIS 725.A N VAL 721.A O no hydrogen 2.959 N/A HIS 725.A ND1 VAL 721.A O no hydrogen 2.865 N/A TYR 726.A N GLY 722.A O no hydrogen 2.882 N/A LEU 727.A N VAL 723.A O no hydrogen 2.929 N/A LEU 728.A N ALA 724.A O no hydrogen 2.944 N/A GLY 729.A N HIS 725.A O no hydrogen 2.883 N/A GLY 730.A N TYR 726.A O no hydrogen 2.989 N/A ILE 731.A N LEU 727.A O no hydrogen 2.914 N/A ALA 732.A N LEU 728.A O no hydrogen 2.894 N/A THR 733.A N GLY 729.A O no hydrogen 2.911 N/A THR 733.A OG1 GLY 729.A O no hydrogen 2.379 N/A THR 734.A N GLY 730.A O no hydrogen 3.004 N/A THR 734.A OG1 GLY 730.A O no hydrogen 3.077 N/A TRP 735.A N ILE 731.A O no hydrogen 2.852 N/A ALA 736.A N ALA 732.A O no hydrogen 2.952 N/A PHE 737.A N THR 733.A O no hydrogen 2.945 N/A PHE 738.A N THR 734.A O no hydrogen 2.874 N/A LEU 739.A N TRP 735.A O no hydrogen 2.979 N/A ALA 740.A N ALA 736.A O no hydrogen 2.904 N/A ARG 741.A N PHE 737.A O no hydrogen 2.977 N/A ARG 741.A NH1 GLN 651.A OE1 no hydrogen 2.690 N/A ILE 742.A N PHE 738.A O no hydrogen 2.908 N/A ILE 743.A N LEU 739.A O no hydrogen 2.899 N/A SER 744.A N ARG 741.A O no hydrogen 3.321 N/A SER 744.A OG ALA 740.A O no hydrogen 2.883 N/A VAL 745.A N ARG 741.A O no hydrogen 2.957 N/A GLY 746.A N ILE 742.A O no hydrogen 2.591 N/A