Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n2a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N TYR 22.A O no hydrogen 2.778 N/A ARG 3.A NH1 VAL 16.A O no hydrogen 2.666 N/A VAL 5.A N TRP 24.A O no hydrogen 3.112 N/A ARG 6.A NH1 ASP 26.A OD2 no hydrogen 2.846 N/A LEU 7.A N ASP 26.A O no hydrogen 3.153 N/A GLN 8.A NE2 SER 11.A OG no hydrogen 3.391 N/A SER 11.A N GLN 8.A O no hydrogen 3.130 N/A SER 11.A OG TYR 9.A O no hydrogen 3.078 N/A ARG 12.A NE GLU 14.A OE2 no hydrogen 3.109 N/A VAL 13.A N GLY 108.A O no hydrogen 2.864 N/A ALA 15.A N PHE 110.A O no hydrogen 2.871 N/A TYR 17.A N THR 112.A O no hydrogen 2.852 N/A LEU 19.A N ILE 114.A O no hydrogen 2.939 N/A THR 21.A N VAL 18.A O no hydrogen 3.131 N/A THR 21.A OG1 VAL 18.A O no hydrogen 2.720 N/A TYR 22.A N ARG 1.A O no hydrogen 2.873 N/A LEU 23.A N VAL 77.A O no hydrogen 2.912 N/A TRP 24.A N ARG 3.A O no hydrogen 2.941 N/A TRP 24.A NE1 THR 4.A OG1 no hydrogen 2.439 N/A THR 25.A N LEU 75.A O no hydrogen 2.815 N/A THR 25.A OG1 VAL 5.A O no hydrogen 3.145 N/A TYR 28.A N ASP 26.A OD1 no hydrogen 2.777 N/A SER 29.A N ASP 26.A OD1 no hydrogen 3.074 N/A SER 29.A OG ASP 26.A OD1 no hydrogen 3.511 N/A SER 29.A OG ASP 26.A OD2 no hydrogen 2.587 N/A ALA 31.A N TYR 28.A O no hydrogen 3.174 N/A ALA 35.A N PRO 32.A O no hydrogen 3.197 N/A GLN 36.A N TYR 96.A O no hydrogen 2.680 N/A THR 37.A N TYR 96.A O no hydrogen 3.319 N/A PHE 38.A N TRP 67.A O no hydrogen 2.889 N/A SER 39.A N ASN 94.A O no hydrogen 2.914 N/A SER 39.A OG TYR 96.A OH no hydrogen 2.660 N/A LYS 41.A N THR 92.A O no hydrogen 2.914 N/A HIS 42.A N THR 61.A O no hydrogen 2.914 N/A HIS 42.A ND1 SER 43.A O no hydrogen 2.871 N/A HIS 42.A NE2 VAL 59.A O no hydrogen 2.741 N/A SER 43.A N LYS 90.A O no hydrogen 3.064 N/A SER 43.A OG SER 88.A O no hydrogen 3.323 N/A SER 43.A OG LYS 90.A O no hydrogen 3.497 N/A VAL 46.A N SER 43.A O no hydrogen 3.338 N/A TRP 47.A N THR 78.A O no hydrogen 2.841 N/A GLU 49.A N ARG 76.A O no hydrogen 2.882 N/A VAL 50.A N GLU 57.A O no hydrogen 2.766 N/A VAL 51.A N THR 74.A O no hydrogen 2.827 N/A ARG 52.A N GLU 55.A O no hydrogen 2.789 N/A ASP 53.A N SER 72.A O no hydrogen 2.905 N/A GLU 55.A N ARG 52.A O no hydrogen 3.005 N/A GLU 57.A N VAL 50.A O no hydrogen 2.778 N/A VAL 59.A N VAL 48.A O no hydrogen 2.903 N/A TRP 67.A N PHE 38.A O no hydrogen 2.940 N/A LEU 69.A N GLN 36.A O no hydrogen 2.883 N/A SER 70.A OG SER 72.A OG no hydrogen 3.009 N/A SER 72.A N SER 70.A OG no hydrogen 3.041 N/A SER 72.A OG SER 70.A OG no hydrogen 3.009 N/A THR 73.A N SER 70.A O no hydrogen 3.078 N/A THR 74.A N VAL 51.A O no hydrogen 2.895 N/A LEU 75.A N THR 25.A O no hydrogen 2.915 N/A ARG 76.A N GLU 49.A O no hydrogen 2.886 N/A ARG 76.A NE GLU 49.A OE1 no hydrogen 2.904 N/A ARG 76.A NH2 GLU 49.A OE2 no hydrogen 3.057 N/A VAL 77.A N LEU 23.A O no hydrogen 2.855 N/A THR 78.A N TRP 47.A O no hydrogen 2.938 N/A MET 79.A N TYR 17.A OH no hydrogen 2.916 N/A SER 83.A N ALA 113.A O no hydrogen 2.786 N/A SER 83.A OG ASP 89.A OD2 no hydrogen 2.544 N/A THR 84.A N SER 87.A OG no hydrogen 2.805 N/A ALA 86.A N THR 84.A OG1 no hydrogen 2.999 N/A SER 87.A N THR 84.A O no hydrogen 3.217 N/A SER 87.A OG THR 84.A O no hydrogen 3.391 N/A LYS 90.A N SER 43.A OG no hydrogen 3.040 N/A VAL 91.A N LEU 109.A O no hydrogen 2.909 N/A THR 92.A N LYS 41.A O no hydrogen 2.855 N/A VAL 93.A N ALA 107.A O no hydrogen 2.676 N/A ASN 94.A N SER 39.A O no hydrogen 2.884 N/A TYR 95.A N ASP 105.A O no hydrogen 2.932 N/A TYR 95.A OH VAL 27.A O no hydrogen 2.414 N/A TYR 96.A N THR 37.A O no hydrogen 2.966 N/A TYR 96.A OH SER 39.A OG no hydrogen 2.660 N/A GLU 99.A N GLU 99.A OE1 no hydrogen 3.108 N/A ILE 104.A N TYR 95.A O no hydrogen 2.843 N/A GLN 106.A N ASP 105.A OD1 no hydrogen 2.859 N/A ALA 107.A N VAL 93.A O no hydrogen 2.858 N/A LEU 109.A N VAL 91.A O no hydrogen 2.779 N/A PHE 110.A N VAL 13.A O no hydrogen 2.763 N/A LEU 111.A N ASP 89.A O no hydrogen 2.866 N/A THR 112.A N ALA 15.A O no hydrogen 3.060 N/A ALA 113.A N SER 83.A OG no hydrogen 2.812 N/A ILE 114.A N TYR 17.A O no hydrogen 2.907 N/A GLU 115.A N LYS 187.A O no hydrogen 2.791 N/A SER 117.A N ARG 185.A O no hydrogen 2.950 N/A SER 117.A OG ASP 119.A OD1 no hydrogen 2.596 N/A LEU 118.A N ASP 286.A OD2 no hydrogen 2.879 N/A ASP 119.A N ILE 183.A O no hydrogen 2.831 N/A ALA 122.A N GLU 129.A OE2 no hydrogen 2.952 N/A ASP 123.A N GLU 129.A OE2 no hydrogen 2.966 N/A ARG 124.A NE.A GLY 146.A O no hydrogen 2.719 N/A ARG 124.A NH1.A THR 139.A O no hydrogen 3.164 N/A ARG 124.A NH1.B GLY 146.A O no hydrogen 3.045 N/A ARG 124.A NH2.A THR 139.A O no hydrogen 2.891 N/A ARG 124.A NH2.A GLY 146.A O no hydrogen 3.217 N/A ARG 124.A NH2.B THR 139.A O no hydrogen 3.405 N/A ARG 124.A NH2.B GLY 141.A O no hydrogen 3.393 N/A ASP 125.A N ASP 121.A OD1 no hydrogen 3.105 N/A GLY 126.A N ASP 121.A OD2 no hydrogen 2.725 N/A VAL 127.A N ASP 125.A OD1 no hydrogen 3.071 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.705 N/A ASN 131.A N ASP 119.A OD1 no hydrogen 3.205 N/A ASN 131.A N ASP 119.A OD2 no hydrogen 3.201 N/A ASN 132.A ND2 GLU 129.A OE2 no hydrogen 2.769 N/A ASN 132.A ND2 GLN 145.A OE1 no hydrogen 2.616 N/A LYS 134.A N ASN 132.A OD1 no hydrogen 2.988 N/A LYS 135.A N ASN 132.A O no hydrogen 3.007 N/A LYS 135.A NZ LEU 118.A O no hydrogen 2.837 N/A LYS 135.A NZ ASP 119.A OD1 no hydrogen 3.263 N/A LYS 135.A NZ ASN 131.A OD1 no hydrogen 2.776 N/A LYS 135.A NZ ASP 286.A OD2 no hydrogen 2.717 N/A SER 137.A N LYS 134.A O no hydrogen 3.176 N/A SER 137.A OG LYS 134.A O no hydrogen 3.368 N/A TRP 138.A NE1 ALA 147.A O no hydrogen 3.019 N/A THR 139.A N GLN 145.A O no hydrogen 2.852 N/A THR 139.A OG1 GLN 145.A O no hydrogen 3.442 N/A GLY 141.A N TRP 649.A O no hydrogen 2.921 N/A GLY 144.A N GLY 141.A O no hydrogen 2.927 N/A GLN 145.A N THR 139.A OG1 no hydrogen 2.942 N/A GLY 146.A N ALA 122.A O no hydrogen 2.778 N/A LEU 149.A N ARG 291.A O no hydrogen 2.941 N/A ASN 152.A N GLY 252.A O no hydrogen 2.970 N/A ASN 152.A ND2 ASP 175.A OD1 no hydrogen 2.956 N/A ASN 152.A ND2 ASP 175.A OD2 no hydrogen 3.323 N/A ASN 152.A ND2 GLU 251.A OE1 no hydrogen 2.848 N/A CYS 153.A SG VAL 151.A O no hydrogen 3.667 N/A ARG 155.A N GLY 375.A O no hydrogen 3.037 N/A GLU 156.A N ASP 164.A OD2 no hydrogen 3.122 N/A GLU 163.A N GLU 163.A OE2 no hydrogen 2.880 N/A ASP 164.A N ASP 154.A O no hydrogen 2.852 N/A CYS 165.A SG ASN 152.A O no hydrogen 3.268 N/A ARG 166.A N GLU 163.A O no hydrogen 3.135 N/A ARG 166.A NH1 GLU 163.A OE1 no hydrogen 3.235 N/A ARG 166.A NH2 LEU 253.A O no hydrogen 3.090 N/A LYS 169.A N ASP 167.A OD1 no hydrogen 3.163 N/A LYS 173.A NZ GLN 222.A OE1 no hydrogen 3.152 N/A GLU 174.A N SER 172.A OG no hydrogen 3.314 N/A ASP 175.A N SER 172.A O no hydrogen 2.898 N/A LEU 176.A N LYS 173.A O no hydrogen 3.104 N/A LYS 177.A N GLU 174.A O no hydrogen 3.178 N/A LYS 177.A NZ GLU 174.A OE1 no hydrogen 2.919 N/A LYS 177.A NZ GLU 174.A OE2 no hydrogen 3.443 N/A ASP 178.A N ASP 175.A O no hydrogen 2.991 N/A MET 179.A N LEU 176.A O no hydrogen 3.081 N/A SER 180.A N VAL 250.A O no hydrogen 2.902 N/A SER 180.A OG ILE 148.A O no hydrogen 2.733 N/A MET 182.A N PHE 248.A O no hydrogen 3.000 N/A ILE 183.A N ASP 119.A O no hydrogen 2.943 N/A LEU 184.A N LEU 246.A O no hydrogen 2.889 N/A ARG 185.A N SER 117.A O no hydrogen 2.837 N/A ARG 185.A NE GLU 245.A OE2 no hydrogen 2.780 N/A ARG 185.A NH1 ASP 119.A OD2 no hydrogen 2.759 N/A ARG 185.A NH1 GLU 129.A O no hydrogen 3.188 N/A ARG 185.A NH2 VAL 128.A O no hydrogen 3.074 N/A THR 186.A N ALA 244.A O no hydrogen 2.903 N/A LYS 187.A N GLU 115.A O no hydrogen 3.102 N/A GLY 188.A N GLY 242.A O no hydrogen 3.176 N/A ASP 190.A N GLU 85.A OE2 no hydrogen 2.814 N/A GLU 197.A N LEU 271.A O no hydrogen 3.063 N/A VAL 199.A N SER 269.A O no hydrogen 2.897 N/A LEU 200.A N HIS 235.A O no hydrogen 2.871 N/A TYR 201.A N HIS 267.A O no hydrogen 2.877 N/A TYR 201.A OH SER 269.A OG no hydrogen 3.201 N/A ILE 202.A N LEU 233.A O no hydrogen 2.950 N/A ASP 206.A N SER 203.A OG no hydrogen 3.085 N/A SER 207.A N MET 204.A O no hydrogen 3.084 N/A SER 207.A OG MET 204.A O no hydrogen 2.674 N/A LYS 209.A N ASP 206.A O no hydrogen 2.895 N/A LYS 209.A NZ SER 205.A O no hydrogen 3.113 N/A LYS 209.A NZ ASP 208.A OD1 no hydrogen 2.790 N/A GLY 211.A N GLU 251.A O no hydrogen 2.923 N/A VAL 212.A N LEU 228.A O no hydrogen 2.954 N/A PHE 213.A N PHE 249.A O no hydrogen 2.793 N/A TYR 214.A N ILE 225.A O no hydrogen 2.866 N/A GLU 216.A N ARG 223.A O no hydrogen 2.988 N/A GLN 222.A NE2 ASN 217.A OD1 no hydrogen 2.931 N/A ARG 223.A N GLU 216.A O no hydrogen 2.968 N/A TYR 224.A OH GLN 222.A OE1 no hydrogen 2.704 N/A ILE 225.A N TYR 214.A O no hydrogen 2.806 N/A ILE 227.A N VAL 212.A O no hydrogen 2.846 N/A GLY 229.A N LYS 232.A O no hydrogen 2.922 N/A ARG 230.A NH1 CYS 165.A O no hydrogen 3.077 N/A ARG 230.A NH1 ASP 167.A O no hydrogen 3.154 N/A ARG 230.A NH1 GLU 168.A OE2 no hydrogen 2.974 N/A ARG 230.A NH2 CYS 165.A O no hydrogen 2.873 N/A LYS 232.A N GLY 229.A O no hydrogen 2.917 N/A LYS 232.A NZ ILE 227.A O no hydrogen 2.859 N/A LYS 232.A NZ TYR 234.A O no hydrogen 3.117 N/A LYS 232.A NZ HIS 235.A ND1 no hydrogen 3.159 N/A HIS 235.A N LEU 200.A O no hydrogen 2.755 N/A VAL 237.A N ILE 198.A O no hydrogen 2.871 N/A TYR 239.A OH PRO 189.A O no hydrogen 2.722 N/A GLY 242.A N GLY 188.A O no hydrogen 2.830 N/A ALA 244.A N THR 186.A O no hydrogen 2.937 N/A LEU 246.A N LEU 184.A O no hydrogen 2.949 N/A PHE 248.A N MET 182.A O no hydrogen 2.753 N/A PHE 249.A N PHE 213.A O no hydrogen 2.860 N/A VAL 250.A N SER 180.A O no hydrogen 2.817 N/A GLU 251.A N GLY 211.A O no hydrogen 2.775 N/A GLY 252.A N LEU 150.A O no hydrogen 2.934 N/A LEU 253.A N LYS 209.A O no hydrogen 2.801 N/A CYS 254.A SG PHE 255.A O no hydrogen 3.242 N/A ASP 257.A N PHE 260.A O no hydrogen 3.021 N/A GLU 258.A N ASP 257.A OD1 no hydrogen 2.694 N/A PHE 260.A N ASP 257.A O no hydrogen 2.913 N/A LEU 263.A N SER 261.A OG no hydrogen 3.130 N/A VAL 264.A N PHE 290.A O no hydrogen 2.919 N/A SER 265.A N.A ASP 206.A OD2 no hydrogen 3.211 N/A SER 265.A N.B ASP 206.A OD2 no hydrogen 3.232 N/A SER 265.A OG.B HIS 267.A NE2 no hydrogen 3.395 N/A ILE 266.A N VAL 288.A O no hydrogen 2.987 N/A HIS 267.A N TYR 201.A O no hydrogen 3.002 N/A HIS 267.A ND1 THR 287.A OG1 no hydrogen 2.712 N/A VAL 268.A N ASP 286.A O no hydrogen 2.897 N/A SER 269.A N VAL 199.A O no hydrogen 2.854 N/A SER 269.A OG TYR 201.A OH no hydrogen 3.201 N/A SER 269.A OG THR 285.A OG1 no hydrogen 2.745 N/A LEU 270.A N PHE 284.A O no hydrogen 2.898 N/A LEU 271.A N GLU 197.A O no hydrogen 2.792 N/A GLU 272.A N THR 281.A O no hydrogen 2.795 N/A TYR 273.A N GLY 195.A O no hydrogen 2.717 N/A THR 281.A N GLU 272.A O no hydrogen 2.918 N/A THR 285.A OG1 SER 269.A OG no hydrogen 2.745 N/A ASP 286.A N VAL 268.A O no hydrogen 2.859 N/A THR 287.A OG1 HIS 267.A ND1 no hydrogen 2.712 N/A VAL 288.A N ILE 266.A O no hydrogen 2.963 N/A ILE 289.A N LYS 135.A O no hydrogen 3.073 N/A PHE 290.A N VAL 264.A O no hydrogen 2.866 N/A ARG 291.A N ALA 147.A O no hydrogen 2.993 N/A ARG 291.A NH1 SER 261.A O no hydrogen 3.064 N/A ILE 292.A N GLY 262.A O no hydrogen 2.809 N/A ALA 293.A N LEU 149.A O no hydrogen 2.819 N/A TRP 295.A N GLN 442.A OE1 no hydrogen 2.835 N/A TRP 295.A NE1 VAL 359.A O no hydrogen 2.973 N/A ILE 296.A N TYR 349.A O no hydrogen 2.989 N/A MET 297.A N GLN 445.A OE1 no hydrogen 2.851 N/A ASN 300.A ND2 PHE 466.A O no hydrogen 3.558 N/A LEU 302.A N PRO 299.A O no hydrogen 3.144 N/A VAL 305.A N ARG 640.A O no hydrogen 2.848 N/A SER 306.A N ARG 640.A O no hydrogen 3.253 N/A VAL 307.A N GLU 332.A O no hydrogen 2.744 N/A PHE 308.A N ASN 638.A O no hydrogen 2.833 N/A VAL 309.A N LYS 334.A O no hydrogen 2.738 N/A CYS 310.A N.A GLY 636.A O no hydrogen 3.036 N/A CYS 310.A N.B GLY 636.A O no hydrogen 3.026 N/A CYS 310.A SG.A ASP 338.A O no hydrogen 2.820 N/A CYS 310.A SG.A GLY 636.A O no hydrogen 3.930 N/A CYS 310.A SG.B CYS 336.A O no hydrogen 3.345 N/A CYS 310.A SG.B ASP 338.A OD1 no hydrogen 3.476 N/A CYS 311.A N CYS 336.A O no hydrogen 3.351 N/A CYS 311.A SG MET 312.A O no hydrogen 3.524 N/A ASN 315.A N MET 312.A O no hydrogen 3.072 N/A ASN 315.A ND2 ASP 622.A O no hydrogen 3.155 N/A LEU 319.A N ASN 315.A O no hydrogen 3.364 N/A LYS 320.A N TYR 316.A O no hydrogen 2.858 N/A GLU 321.A N LEU 317.A O no hydrogen 2.973 N/A VAL 322.A N PHE 318.A O no hydrogen 2.866 N/A LYS 323.A N LEU 319.A O no hydrogen 2.929 N/A LYS 323.A NZ GLU 327.A OE2 no hydrogen 2.713 N/A ASN 324.A N LYS 320.A O no hydrogen 2.838 N/A LEU 325.A N GLU 321.A O no hydrogen 2.917 N/A VAL 326.A N VAL 322.A O no hydrogen 2.925 N/A GLU 327.A N LYS 323.A O no hydrogen 2.916 N/A LYS 328.A N LEU 325.A O no hydrogen 3.107 N/A LYS 328.A NZ ASP 585.A OD1 no hydrogen 2.666 N/A LYS 328.A NZ GLU 616.A OE1 no hydrogen 2.629 N/A THR 329.A N VAL 326.A O no hydrogen 2.907 N/A THR 329.A OG1 VAL 326.A O no hydrogen 2.707 N/A CYS 331.A N THR 329.A OG1 no hydrogen 3.184 N/A CYS 331.A SG PRO 304.A O no hydrogen 3.692 N/A CYS 331.A SG THR 329.A OG1 no hydrogen 3.274 N/A GLU 332.A N VAL 305.A O no hydrogen 3.074 N/A LYS 334.A N VAL 307.A O no hydrogen 2.872 N/A CYS 336.A N VAL 309.A O no hydrogen 2.872 N/A ARG 339.A NE CYS 635.A O no hydrogen 2.948 N/A GLN 342.A N ARG 339.A O no hydrogen 3.127 N/A GLN 342.A NE2.A THR 637.A O no hydrogen 3.285 N/A ASP 343.A N ARG 339.A O no hydrogen 3.085 N/A GLU 344.A N TRP 340.A O no hydrogen 2.646 N/A GLU 346.A N LEU 361.A O no hydrogen 3.040 N/A GLY 348.A N VAL 359.A O no hydrogen 2.856 N/A TYR 349.A N ILE 296.A O no hydrogen 2.783 N/A ILE 350.A N PHE 357.A O no hydrogen 3.044 N/A ALA 352.A N LYS 355.A O no hydrogen 2.697 N/A LYS 355.A N ALA 352.A O no hydrogen 3.170 N/A LYS 355.A NZ ASP 178.A OD1 no hydrogen 3.124 N/A LYS 355.A NZ ASP 377.A OD1 no hydrogen 2.967 N/A LYS 355.A NZ ASP 377.A OD2 no hydrogen 2.780 N/A PHE 357.A N ILE 350.A O no hydrogen 3.134 N/A VAL 359.A N GLY 348.A O no hydrogen 2.931 N/A VAL 360.A N GLY 379.A O no hydrogen 2.799 N/A LEU 361.A N GLU 346.A O no hydrogen 2.913 N/A ASP 362.A N VAL 381.A O no hydrogen 2.937 N/A SER 363.A N GLU 344.A O no hydrogen 2.847 N/A SER 363.A OG.B ASP 394.A O no hydrogen 2.720 N/A ARG 365.A N GLU 384.A OE2 no hydrogen 2.953 N/A ARG 365.A NE ASP 367.A O no hydrogen 3.115 N/A LYS 366.A NZ ASP 362.A OD2 no hydrogen 2.375 N/A LYS 366.A NZ SER 363.A O no hydrogen 2.366 N/A LYS 366.A NZ SER 363.A OG.A no hydrogen 3.377 N/A LYS 371.A NZ GLU 163.A OE2 no hydrogen 2.838 N/A LEU 374.A N LYS 371.A O no hydrogen 3.042 N/A GLY 375.A N PHE 378.A O no hydrogen 3.078 N/A ASP 377.A N ASP 154.A OD2 no hydrogen 2.908 N/A PHE 378.A N GLY 375.A O no hydrogen 3.027 N/A GLY 379.A N PRO 358.A O no hydrogen 2.860 N/A TYR 380.A N CYS 153.A O no hydrogen 3.052 N/A TYR 380.A OH ASP 362.A OD1 no hydrogen 2.616 N/A VAL 381.A N VAL 360.A O no hydrogen 2.904 N/A THR 382.A OG1 ASP 362.A O no hydrogen 2.737 N/A ARG 383.A NE ASP 257.A OD2 no hydrogen 2.533 N/A ARG 383.A NH1 THR 382.A O no hydrogen 3.104 N/A ARG 383.A NH2 ASP 257.A OD2 no hydrogen 2.660 N/A THR 391.A N ASP 394.A OD1 no hydrogen 2.872 N/A SER 392.A OG VAL 457.A O no hydrogen 2.600 N/A SER 392.A OG HIS 459.A NE2 no hydrogen 3.188 N/A LEU 393.A N THR 391.A OG1 no hydrogen 3.113 N/A ASP 394.A N THR 391.A O no hydrogen 2.984 N/A SER 395.A N SER 392.A O no hydrogen 3.084 N/A SER 395.A OG.B ASP 343.A OD1 no hydrogen 2.454 N/A PHE 396.A N ASP 343.A O no hydrogen 2.780 N/A GLY 397.A N SER 395.A OG.B no hydrogen 3.140 N/A ASN 398.A N SER 395.A O no hydrogen 2.932 N/A ASN 398.A ND2 LEU 393.A O no hydrogen 3.014 N/A ASN 398.A ND2 GLY 420.A O no hydrogen 3.028 N/A LEU 399.A N PHE 396.A O no hydrogen 3.144 N/A GLU 400.A N LEU 418.A O no hydrogen 3.033 N/A SER 402.A N ARG 416.A O no hydrogen 2.860 N/A SER 402.A OG PRO 403.A O no hydrogen 2.785 N/A VAL 405.A N TYR 412.A O no hydrogen 3.258 N/A VAL 407.A N LYS 410.A O no hydrogen 2.811 N/A LYS 410.A N VAL 407.A O no hydrogen 2.877 N/A TYR 412.A N VAL 405.A O no hydrogen 2.791 N/A GLY 415.A N TYR 412.A O no hydrogen 2.973 N/A ARG 416.A N SER 402.A OG no hydrogen 2.894 N/A ARG 416.A NE ALA 446.A O no hydrogen 2.861 N/A ARG 416.A NH1 GLU 546.A O no hydrogen 2.983 N/A ARG 416.A NH1 GLU 546.A OE1 no hydrogen 2.964 N/A ARG 416.A NH2 ALA 446.A O no hydrogen 3.153 N/A ILE 417.A N GLN 445.A O no hydrogen 2.856 N/A LEU 418.A N GLU 400.A O no hydrogen 2.766 N/A ILE 419.A N VAL 448.A O no hydrogen 3.039 N/A GLY 420.A N ASN 398.A OD1 no hydrogen 2.960 N/A SER 421.A N LEU 450.A O no hydrogen 2.794 N/A SER 421.A OG SER 422.A O no hydrogen 3.343 N/A SER 421.A OG GLU 449.A OE2 no hydrogen 3.382 N/A SER 422.A N SER 421.A OG no hydrogen 2.616 N/A SER 422.A OG ARG 429.A O no hydrogen 2.700 N/A SER 426.A N PHE 423.A O no hydrogen 3.021 N/A SER 426.A OG PHE 423.A O no hydrogen 2.615 N/A GLY 428.A N SER 426.A OG no hydrogen 2.943 N/A ARG 429.A N ASP 453.A OD1 no hydrogen 2.972 N/A ARG 429.A NE ASP 453.A OD2 no hydrogen 2.678 N/A ARG 429.A NH1 THR 456.A O no hydrogen 3.118 N/A ARG 429.A NH2 ASP 453.A OD2 no hydrogen 2.962 N/A ARG 429.A NH2 LEU 455.A O no hydrogen 2.864 N/A ARG 429.A NH2 THR 456.A O no hydrogen 3.097 N/A ARG 430.A NE GLU 449.A OE2 no hydrogen 2.967 N/A ARG 430.A NH2 GLU 449.A OE1 no hydrogen 2.939 N/A THR 432.A N ASP 394.A OD2 no hydrogen 2.727 N/A THR 432.A OG1 ASP 394.A OD2 no hydrogen 2.779 N/A LYS 433.A N GLU 388.A OE1 no hydrogen 2.962 N/A LYS 433.A NZ ASP 437.A OD1 no hydrogen 3.542 N/A LYS 433.A NZ ASP 437.A OD2 no hydrogen 2.987 N/A VAL 435.A N THR 432.A O no hydrogen 3.210 N/A ARG 436.A N THR 432.A O no hydrogen 3.038 N/A ARG 436.A NE MET 431.A O no hydrogen 2.797 N/A ASP 437.A N LYS 433.A O no hydrogen 2.689 N/A PHE 438.A N VAL 434.A O no hydrogen 3.232 N/A LEU 439.A N VAL 435.A O no hydrogen 2.964 N/A LYS 440.A N ARG 436.A O no hydrogen 2.966 N/A ALA 441.A N ASP 437.A O no hydrogen 2.926 N/A GLN 442.A N LEU 439.A O no hydrogen 3.294 N/A GLN 442.A NE2 PRO 256.A O no hydrogen 2.901 N/A GLN 442.A NE2 PHE 438.A O no hydrogen 2.870 N/A GLN 443.A N LYS 440.A O no hydrogen 3.080 N/A VAL 444.A N GLN 442.A O no hydrogen 2.746 N/A GLN 445.A NE2 MET 297.A O no hydrogen 2.925 N/A GLN 445.A NE2 LEU 414.A O no hydrogen 2.862 N/A ALA 446.A N GLN 443.A O no hydrogen 3.255 N/A VAL 448.A N ILE 417.A O no hydrogen 2.810 N/A LEU 450.A N ILE 419.A O no hydrogen 2.793 N/A TYR 451.A N ASN 539.A OD1 no hydrogen 2.746 N/A SER 452.A N SER 421.A O no hydrogen 2.925 N/A SER 452.A OG GLY 458.A O no hydrogen 2.777 N/A ASP 453.A N SER 421.A O no hydrogen 3.199 N/A TRP 454.A NE1 TYR 451.A O no hydrogen 2.947 N/A LEU 455.A N SER 452.A O no hydrogen 3.049 N/A THR 456.A N ALA 569.A O no hydrogen 2.836 N/A THR 456.A OG1 ASP 564.A OD2 no hydrogen 2.716 N/A THR 456.A OG1 ALA 569.A O no hydrogen 3.320 N/A HIS 459.A N GLU 462.A OE2 no hydrogen 2.972 N/A HIS 459.A NE2 SER 392.A O no hydrogen 2.804 N/A VAL 460.A N ASN 398.A OD1 no hydrogen 3.088 N/A ASP 461.A N GLY 397.A O no hydrogen 3.179 N/A GLU 462.A N HIS 459.A O no hydrogen 3.060 N/A PHE 463.A N VAL 460.A O no hydrogen 3.173 N/A MET 464.A N VAL 460.A O no hydrogen 3.282 N/A SER 465.A N LEU 478.A O no hydrogen 3.049 N/A SER 465.A OG.A VAL 577.A O no hydrogen 2.989 N/A VAL 467.A N LEU 476.A O no hydrogen 3.018 N/A ILE 469.A N LYS 474.A O no hydrogen 2.997 N/A THR 472.A N ILE 469.A O no hydrogen 3.125 N/A THR 472.A OG1 ILE 469.A O no hydrogen 2.770 N/A LYS 474.A N THR 472.A OG1 no hydrogen 2.930 N/A LEU 476.A N VAL 467.A O no hydrogen 2.802 N/A LEU 477.A N ASP 553.A O no hydrogen 2.796 N/A LEU 478.A N SER 465.A O no hydrogen 2.834 N/A MET 479.A N ILE 555.A O no hydrogen 2.963 N/A ALA 480.A N PHE 463.A O no hydrogen 2.967 N/A SER 481.A N LEU 557.A O no hydrogen 2.748 N/A SER 481.A OG GLN 533.A OE1 no hydrogen 3.286 N/A THR 482.A OG1 ASN 529.A O no hydrogen 2.849 N/A THR 482.A OG1 GLN 533.A OE1 no hydrogen 3.398 N/A SER 483.A N GLN 533.A OE1 no hydrogen 2.998 N/A SER 483.A OG.A SER 481.A OG no hydrogen 3.085 N/A SER 483.A OG.A GLN 533.A OE1 no hydrogen 3.475 N/A ALA 484.A N SER 481.A OG no hydrogen 2.992 N/A TYR 486.A N THR 482.A O no hydrogen 2.961 N/A LYS 487.A N SER 483.A O no hydrogen 3.001 N/A LYS 487.A NZ GLU 491.A OE2 no hydrogen 3.361 N/A LEU 488.A N ALA 484.A O no hydrogen 3.101 N/A PHE 489.A N CYS 485.A O no hydrogen 2.933 N/A ARG 490.A N TYR 486.A O no hydrogen 2.899 N/A GLU 491.A N LYS 487.A O no hydrogen 2.977 N/A LYS 492.A N LEU 488.A O no hydrogen 2.950 N/A GLN 493.A N PHE 489.A O no hydrogen 2.885 N/A GLN 493.A NE2 ASN 517.A OD1 no hydrogen 2.821 N/A LYS 494.A N ARG 490.A O no hydrogen 2.973 N/A ASP 495.A N GLU 491.A O no hydrogen 2.931 N/A GLY 496.A N GLN 493.A O no hydrogen 2.976 N/A HIS 497.A N LYS 492.A O no hydrogen 2.936 N/A ALA 500.A N HIS 497.A O no hydrogen 2.901 N/A MET 502.A N ILE 514.A O no hydrogen 2.822 N/A PHE 503.A N PHE 592.A O no hydrogen 2.881 N/A LEU 506.A N PHE 503.A O no hydrogen 2.994 N/A GLY 508.A N HIS 627.A O no hydrogen 2.844 N/A MET 509.A N LEU 506.A O no hydrogen 2.921 N/A SER 510.A N GLY 507.A O no hydrogen 3.347 N/A SER 510.A OG LEU 506.A O no hydrogen 3.557 N/A SER 510.A OG GLY 507.A O no hydrogen 3.552 N/A LYS 512.A N MET 509.A O no hydrogen 3.138 N/A ARG 513.A N SER 510.A O no hydrogen 3.020 N/A ILE 516.A N ALA 500.A O no hydrogen 3.184 N/A ASN 517.A N GLY 498.A O no hydrogen 2.840 N/A ASN 517.A ND2 GLU 499.A OE2 no hydrogen 2.971 N/A LYS 518.A N THR 515.A OG1 no hydrogen 2.989 N/A LYS 518.A NZ LYS 512.A O no hydrogen 3.381 N/A ILE 519.A N THR 515.A O no hydrogen 3.011 N/A LEU 520.A N ILE 516.A O no hydrogen 2.891 N/A SER 521.A N.A ASN 517.A O no hydrogen 3.008 N/A SER 521.A N.B ASN 517.A O no hydrogen 3.000 N/A SER 521.A OG.A ASN 517.A O no hydrogen 3.115 N/A SER 521.A OG.A LYS 518.A O no hydrogen 3.345 N/A SER 521.A OG.B ASN 517.A O no hydrogen 2.982 N/A ASN 522.A N ILE 519.A O no hydrogen 3.194 N/A SER 524.A OG ASN 522.A OD1 no hydrogen 3.125 N/A LEU 525.A N ASN 522.A OD1 no hydrogen 3.125 N/A VAL 526.A N ASN 522.A O no hydrogen 3.184 N/A GLN 527.A N GLU 523.A O no hydrogen 3.190 N/A GLU 528.A N SER 524.A O no hydrogen 2.929 N/A ASN 529.A N LEU 525.A O no hydrogen 2.999 N/A ASN 529.A ND2 LEU 525.A O no hydrogen 2.996 N/A ASN 529.A ND2 PHE 561.A O no hydrogen 2.892 N/A LEU 530.A N VAL 526.A O no hydrogen 2.928 N/A TYR 531.A N GLN 527.A O no hydrogen 3.171 N/A PHE 532.A N GLU 528.A O no hydrogen 2.942 N/A GLN 533.A N ASN 529.A O no hydrogen 2.938 N/A GLN 533.A NE2 ASP 537.A OD1 no hydrogen 2.932 N/A ARG 534.A N LEU 530.A O no hydrogen 3.138 N/A CYS 535.A N TYR 531.A O no hydrogen 3.099 N/A CYS 535.A SG TYR 531.A O no hydrogen 3.567 N/A LEU 536.A N PHE 532.A O no hydrogen 2.895 N/A ASP 537.A N GLN 533.A O no hydrogen 2.821 N/A TRP 538.A N ARG 534.A O no hydrogen 2.980 N/A ASN 539.A N CYS 535.A O no hydrogen 3.292 N/A ASN 539.A ND2 TYR 451.A O no hydrogen 2.793 N/A ASN 539.A ND2 CYS 535.A O no hydrogen 2.991 N/A ARG 540.A N LEU 536.A O no hydrogen 2.858 N/A ARG 540.A NE GLU 551.A OE2 no hydrogen 2.826 N/A ARG 540.A NH1 ASP 556.A OD1 no hydrogen 3.406 N/A ARG 540.A NH1 ASP 556.A OD2 no hydrogen 2.861 N/A ARG 540.A NH2 GLU 551.A OE1 no hydrogen 2.785 N/A ARG 540.A NH2 ASP 556.A OD1 no hydrogen 2.987 N/A ASP 541.A N ASP 537.A O no hydrogen 3.021 N/A ILE 542.A N TRP 538.A O no hydrogen 3.188 N/A LEU 543.A N ASN 539.A O no hydrogen 2.893 N/A LYS 544.A N ARG 540.A O no hydrogen 2.915 N/A LYS 544.A NZ GLU 551.A OE2 no hydrogen 2.880 N/A LYS 545.A N ASP 541.A O no hydrogen 2.999 N/A GLU 546.A N ILE 542.A O no hydrogen 2.799 N/A LEU 547.A N LEU 543.A O no hydrogen 2.877 N/A LEU 549.A N LYS 544.A O no hydrogen 3.032 N/A THR 550.A N ASP 553.A OD2 no hydrogen 2.858 N/A THR 550.A OG1 ASP 553.A OD2 no hydrogen 3.496 N/A GLN 552.A N THR 550.A OG1 no hydrogen 3.065 N/A ASP 553.A N THR 550.A O no hydrogen 2.906 N/A ILE 554.A N GLU 551.A O no hydrogen 3.299 N/A ILE 555.A N LEU 477.A O no hydrogen 2.960 N/A LEU 557.A N MET 479.A O no hydrogen 2.842 N/A ALA 559.A N SER 481.A O no hydrogen 2.959 N/A PHE 561.A N ASN 529.A OD1 no hydrogen 2.998 N/A LYS 562.A N ARG 570.A O no hydrogen 2.816 N/A LYS 562.A NZ GLU 528.A OE1 no hydrogen 3.240 N/A LYS 562.A NZ GLU 528.A OE2 no hydrogen 3.138 N/A LYS 562.A NZ MET 563.A O no hydrogen 2.763 N/A MET 563.A N GLU 528.A OE1 no hydrogen 3.003 N/A ASP 564.A N ARG 568.A O no hydrogen 2.785 N/A ASP 566.A N ASP 564.A OD1 no hydrogen 2.807 N/A HIS 567.A N ASP 564.A O no hydrogen 3.128 N/A ARG 568.A N ASP 564.A OD1 no hydrogen 2.915 N/A ARG 568.A NE ASP 453.A O no hydrogen 2.755 N/A ARG 568.A NH2 ASP 453.A OD1 no hydrogen 2.997 N/A ALA 569.A N TRP 454.A O no hydrogen 2.747 N/A ARG 570.A N LYS 562.A O no hydrogen 2.928 N/A PHE 572.A N LEU 560.A O no hydrogen 2.830 N/A ASN 578.A N ASN 575.A O no hydrogen 3.414 N/A ASN 578.A ND2 GLN 342.A OE1.B no hydrogen 3.305 N/A ILE 580.A N GLY 587.A O no hydrogen 2.823 N/A LEU 582.A N ASP 585.A O no hydrogen 2.826 N/A LYS 584.A NZ ASP 585.A OD2 no hydrogen 2.789 N/A LYS 584.A NZ GLU 616.A OE2 no hydrogen 3.139 N/A ASP 585.A N LEU 582.A O no hydrogen 2.949 N/A LEU 586.A N GLU 616.A O no hydrogen 2.843 N/A GLY 587.A N ILE 580.A O no hydrogen 2.858 N/A ILE 588.A N THR 618.A O no hydrogen 2.750 N/A LYS 590.A N ILE 620.A O no hydrogen 2.920 N/A LYS 590.A NZ GLU 603.A OE2 no hydrogen 2.784 N/A VAL 596.A N GLU 599.A O no hydrogen 2.905 N/A GLU 599.A N VAL 596.A O no hydrogen 3.229 N/A CYS 601.A N PRO 594.A O no hydrogen 3.014 N/A CYS 601.A SG PRO 594.A O no hydrogen 3.483 N/A MET 604.A N CYS 600.A O no hydrogen 2.985 N/A HIS 605.A N CYS 601.A O no hydrogen 2.997 N/A VAL 606.A N LEU 602.A O no hydrogen 2.934 N/A ARG 607.A N GLU 603.A O no hydrogen 2.965 N/A ARG 607.A NH1 GLU 611.A OE2 no hydrogen 2.834 N/A ARG 607.A NH1 CYS 617.A O no hydrogen 2.942 N/A ARG 607.A NH2 CYS 617.A O no hydrogen 3.325 N/A GLY 608.A N MET 604.A O no hydrogen 3.027 N/A LEU 609.A N HIS 605.A O no hydrogen 3.088 N/A LEU 609.A N VAL 606.A O no hydrogen 3.104 N/A LEU 610.A N VAL 606.A O no hydrogen 3.000 N/A GLU 611.A N ARG 607.A O no hydrogen 2.823 N/A LEU 613.A N LEU 610.A O no hydrogen 2.994 N/A GLY 614.A N GLU 611.A O no hydrogen 2.937 N/A GLU 616.A N LYS 584.A O no hydrogen 2.835 N/A THR 618.A N LEU 586.A O no hydrogen 2.886 N/A ILE 620.A N ILE 588.A O no hydrogen 2.762 N/A ASP 621.A N GLU 321.A OE1 no hydrogen 2.875 N/A SER 624.A N ASP 621.A OD2 no hydrogen 2.868 N/A SER 624.A OG ASP 621.A OD1 no hydrogen 2.585 N/A SER 624.A OG ASP 621.A OD2 no hydrogen 3.449 N/A TYR 626.A N ILE 623.A O no hydrogen 2.803 N/A HIS 627.A N SER 624.A O no hydrogen 3.082 N/A GLY 636.A N CYS 310.A O.A no hydrogen 3.128 N/A GLY 636.A N CYS 310.A O.B no hydrogen 3.133 N/A ASN 638.A N PHE 308.A O no hydrogen 2.863 N/A ASN 638.A ND2 ILE 341.A O no hydrogen 2.810 N/A ASN 638.A ND2 ILE 345.A O no hydrogen 3.001 N/A ARG 640.A N SER 306.A O no hydrogen 2.835 N/A ARG 641.A NH1 LEU 302.A O no hydrogen 2.973 N/A ARG 641.A NH1 VAL 581.A O no hydrogen 3.150 N/A ARG 641.A NH2 ASN 300.A OD1 no hydrogen 3.472 N/A ARG 641.A NH2 VAL 581.A O no hydrogen 2.817 N/A LYS 642.A N PRO 303.A O no hydrogen 2.858 N/A LYS 647.A NZ GLU 351.A OE2 no hydrogen 2.724 N/A TRP 648.A NE1 GLU 351.A O no hydrogen 2.810 N/A HIS 650.A N LYS 647.A O no hydrogen 2.875 N/A MET 651.A N.A TRP 648.A O no hydrogen 3.054 N/A MET 651.A N.B TRP 648.A O no hydrogen 3.058 N/A