Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4n2d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N TYR 22.A O no hydrogen 2.847 N/A ARG 3.A NH1 VAL 16.A O no hydrogen 2.754 N/A VAL 5.A N TRP 24.A O no hydrogen 3.104 N/A ARG 6.A NH1 ASP 26.A OD2 no hydrogen 2.862 N/A LEU 7.A N ASP 26.A O no hydrogen 3.266 N/A VAL 13.A N GLY 108.A O no hydrogen 2.931 N/A ALA 15.A N PHE 110.A O no hydrogen 2.943 N/A TYR 17.A N THR 112.A O no hydrogen 2.777 N/A LEU 19.A N ILE 114.A O no hydrogen 2.908 N/A THR 21.A N VAL 18.A O no hydrogen 3.160 N/A THR 21.A OG1 VAL 18.A O no hydrogen 2.820 N/A TYR 22.A N ARG 1.A O no hydrogen 3.131 N/A LEU 23.A N VAL 77.A O no hydrogen 2.924 N/A TRP 24.A N ARG 3.A O no hydrogen 2.915 N/A TRP 24.A NE1 THR 4.A OG1 no hydrogen 2.461 N/A THR 25.A N LEU 75.A O no hydrogen 2.860 N/A THR 25.A OG1 VAL 5.A O no hydrogen 3.340 N/A TYR 28.A N ASP 26.A OD1 no hydrogen 2.819 N/A SER 29.A N ASP 26.A OD1 no hydrogen 3.056 N/A SER 29.A OG ASP 26.A OD2 no hydrogen 2.623 N/A ALA 31.A N TYR 28.A O no hydrogen 3.329 N/A ALA 35.A N PRO 32.A O no hydrogen 3.232 N/A GLN 36.A N TYR 96.A O no hydrogen 2.717 N/A THR 37.A N TYR 96.A O no hydrogen 3.282 N/A PHE 38.A N TRP 67.A O no hydrogen 2.962 N/A SER 39.A N ASN 94.A O no hydrogen 2.995 N/A SER 39.A OG TYR 96.A OH no hydrogen 2.642 N/A LYS 41.A N THR 92.A O no hydrogen 2.904 N/A HIS 42.A N THR 61.A O no hydrogen 2.930 N/A HIS 42.A ND1 SER 43.A O no hydrogen 2.806 N/A HIS 42.A NE2 VAL 59.A O no hydrogen 2.790 N/A SER 43.A N LYS 90.A O no hydrogen 2.978 N/A SER 43.A OG SER 88.A O no hydrogen 3.362 N/A VAL 46.A N SER 43.A O no hydrogen 3.448 N/A TRP 47.A N THR 78.A O no hydrogen 2.781 N/A GLU 49.A N ARG 76.A O no hydrogen 2.994 N/A VAL 50.A N GLU 57.A O no hydrogen 2.885 N/A VAL 51.A N THR 74.A O no hydrogen 2.885 N/A ARG 52.A N GLU 55.A O no hydrogen 2.886 N/A ASP 53.A N SER 72.A O no hydrogen 3.064 N/A GLU 55.A N ARG 52.A O no hydrogen 3.020 N/A GLU 57.A N VAL 50.A O no hydrogen 2.877 N/A VAL 59.A N VAL 48.A O no hydrogen 2.899 N/A ARG 66.A NH1 SER 101.A OG no hydrogen 3.209 N/A TRP 67.A N PHE 38.A O no hydrogen 2.978 N/A TRP 67.A NE1 GLU 57.A OE1 no hydrogen 3.304 N/A LEU 69.A N GLN 36.A O no hydrogen 2.839 N/A SER 70.A OG SER 72.A OG no hydrogen 3.014 N/A SER 72.A N SER 70.A OG no hydrogen 3.027 N/A SER 72.A OG SER 70.A OG no hydrogen 3.014 N/A THR 73.A N SER 70.A O no hydrogen 3.142 N/A THR 74.A N VAL 51.A O no hydrogen 2.901 N/A LEU 75.A N THR 25.A O no hydrogen 2.967 N/A ARG 76.A N GLU 49.A O no hydrogen 2.880 N/A ARG 76.A NE GLU 49.A OE1 no hydrogen 2.985 N/A ARG 76.A NH2 GLU 49.A OE2 no hydrogen 3.469 N/A VAL 77.A N LEU 23.A O no hydrogen 2.851 N/A THR 78.A N TRP 47.A O no hydrogen 3.045 N/A MET 79.A N TYR 17.A OH no hydrogen 3.041 N/A SER 83.A N ALA 113.A O no hydrogen 2.737 N/A SER 83.A OG ASP 89.A OD2 no hydrogen 2.496 N/A THR 84.A N SER 87.A OG no hydrogen 2.907 N/A ALA 86.A N THR 84.A OG1 no hydrogen 3.010 N/A SER 87.A N THR 84.A O no hydrogen 3.140 N/A SER 87.A OG THR 84.A O no hydrogen 3.358 N/A LYS 90.A N SER 43.A OG no hydrogen 3.078 N/A VAL 91.A N LEU 109.A O no hydrogen 2.874 N/A THR 92.A N LYS 41.A O no hydrogen 2.946 N/A VAL 93.A N ALA 107.A O no hydrogen 2.958 N/A ASN 94.A N SER 39.A O no hydrogen 2.932 N/A TYR 95.A N ASP 105.A O no hydrogen 2.939 N/A TYR 95.A OH VAL 27.A O no hydrogen 2.635 N/A TYR 96.A N THR 37.A O no hydrogen 2.978 N/A TYR 96.A OH SER 39.A OG no hydrogen 2.642 N/A GLY 100.A N ASP 97.A OD2 no hydrogen 3.368 N/A ILE 104.A N TYR 95.A O no hydrogen 2.712 N/A ALA 107.A N VAL 93.A O no hydrogen 2.885 N/A LEU 109.A N VAL 91.A O no hydrogen 2.776 N/A PHE 110.A N VAL 13.A O no hydrogen 2.875 N/A LEU 111.A N ASP 89.A O no hydrogen 2.833 N/A THR 112.A N ALA 15.A O no hydrogen 3.017 N/A ALA 113.A N SER 83.A OG no hydrogen 2.767 N/A ILE 114.A N TYR 17.A O no hydrogen 2.865 N/A GLU 115.A N LYS 172.A O no hydrogen 2.878 N/A SER 117.A N ARG 170.A O no hydrogen 3.006 N/A SER 117.A OG ASP 119.A OD1 no hydrogen 2.676 N/A LEU 118.A N ASP 271.A OD2 no hydrogen 2.880 N/A ASP 119.A N ILE 168.A O no hydrogen 2.901 N/A ALA 122.A N GLU 129.A OE2 no hydrogen 2.911 N/A ASP 123.A N GLU 129.A OE2 no hydrogen 2.990 N/A ARG 124.A NE GLY 146.A O no hydrogen 2.735 N/A ARG 124.A NH1 THR 139.A O no hydrogen 3.313 N/A ARG 124.A NH2 THR 139.A O no hydrogen 2.940 N/A ARG 124.A NH2 GLY 146.A O no hydrogen 3.131 N/A ASP 125.A N ASN 121.A OD1 no hydrogen 3.210 N/A VAL 127.A N ASP 125.A OD1 no hydrogen 3.063 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.737 N/A ASN 131.A N ASP 119.A OD1 no hydrogen 2.978 N/A ASN 132.A ND2 GLU 129.A OE2 no hydrogen 2.875 N/A ASN 132.A ND2 GLN 145.A OE1 no hydrogen 2.656 N/A LYS 134.A N ASN 132.A OD1 no hydrogen 2.878 N/A LYS 135.A N ASN 132.A O no hydrogen 3.023 N/A LYS 135.A NZ LEU 118.A O no hydrogen 2.598 N/A LYS 135.A NZ ASP 119.A OD1 no hydrogen 3.510 N/A LYS 135.A NZ ASN 131.A OD1 no hydrogen 3.021 N/A LYS 135.A NZ ASP 271.A OD2 no hydrogen 2.605 N/A SER 137.A N.A LYS 134.A O no hydrogen 3.073 N/A SER 137.A N.B LYS 134.A O no hydrogen 3.071 N/A SER 137.A OG.B LYS 134.A O no hydrogen 3.280 N/A TRP 138.A NE1 ALA 147.A O no hydrogen 2.927 N/A THR 139.A N GLN 145.A O no hydrogen 2.941 N/A THR 139.A OG1 GLN 145.A O no hydrogen 3.412 N/A GLY 141.A N TRP 629.A O no hydrogen 3.017 N/A GLY 144.A N GLY 141.A O no hydrogen 2.832 N/A GLN 145.A N THR 139.A OG1 no hydrogen 2.906 N/A GLY 146.A N ALA 122.A O no hydrogen 2.655 N/A LEU 149.A N ARG 276.A O no hydrogen 2.914 N/A ASN 152.A N GLY 237.A O no hydrogen 2.958 N/A ASN 152.A ND2 GLU 236.A OE1 no hydrogen 2.831 N/A CYS 153.A SG VAL 151.A O no hydrogen 3.717 N/A ASP 154.A N ASN 152.A OD1 no hydrogen 2.963 N/A TYR 156.A N TYR 209.A O no hydrogen 2.808 N/A ASP 160.A N SER 157.A OG no hydrogen 3.351 N/A LEU 161.A N LYS 158.A O no hydrogen 3.483 N/A LYS 162.A N GLU 159.A O no hydrogen 3.245 N/A MET 164.A N LEU 161.A O no hydrogen 2.930 N/A SER 165.A N VAL 235.A O no hydrogen 2.994 N/A SER 165.A OG ILE 148.A O no hydrogen 2.802 N/A SER 165.A OG HIS 345.A NE2 no hydrogen 3.309 N/A MET 167.A N PHE 233.A O no hydrogen 2.945 N/A ILE 168.A N ASP 119.A O no hydrogen 2.978 N/A LEU 169.A N LEU 231.A O no hydrogen 2.857 N/A ARG 170.A N SER 117.A O no hydrogen 2.947 N/A ARG 170.A NE GLU 230.A OE2 no hydrogen 2.752 N/A ARG 170.A NH1 ASP 119.A OD2 no hydrogen 2.499 N/A ARG 170.A NH1 VAL 128.A O no hydrogen 3.541 N/A ARG 170.A NH1 GLU 129.A O no hydrogen 3.353 N/A ARG 170.A NH2 VAL 128.A O no hydrogen 3.036 N/A THR 171.A N ALA 229.A O no hydrogen 2.788 N/A LYS 172.A N GLU 115.A O no hydrogen 3.108 N/A ASP 175.A N GLU 85.A OE2 no hydrogen 2.632 N/A GLU 182.A N LEU 256.A O no hydrogen 3.044 N/A VAL 184.A N SER 254.A O no hydrogen 2.874 N/A LEU 185.A N HIS 220.A O no hydrogen 2.945 N/A TYR 186.A N HIS 252.A O no hydrogen 2.854 N/A TYR 186.A OH SER 254.A OG no hydrogen 3.388 N/A ILE 187.A N LEU 218.A O no hydrogen 2.942 N/A ASP 191.A N SER 188.A OG no hydrogen 3.067 N/A SER 192.A N MET 189.A O no hydrogen 3.115 N/A SER 192.A OG MET 189.A O no hydrogen 2.772 N/A LYS 194.A N ASP 191.A O no hydrogen 2.820 N/A LYS 194.A NZ SER 190.A O no hydrogen 2.932 N/A LYS 194.A NZ ASP 193.A OD1 no hydrogen 2.757 N/A GLY 196.A N GLU 236.A O no hydrogen 2.937 N/A VAL 197.A N LEU 213.A O no hydrogen 3.007 N/A PHE 198.A N PHE 234.A O no hydrogen 2.839 N/A TYR 199.A N ILE 210.A O no hydrogen 3.004 N/A TYR 199.A OH GLU 201.A OE1 no hydrogen 2.976 N/A PHE 205.A N ASN 202.A O no hydrogen 3.090 N/A GLY 206.A N PRO 203.A O no hydrogen 3.344 N/A TYR 209.A N TYR 156.A O no hydrogen 2.877 N/A ILE 210.A N TYR 199.A O no hydrogen 2.740 N/A ILE 212.A N VAL 197.A O no hydrogen 2.903 N/A GLY 214.A N LYS 217.A O no hydrogen 2.875 N/A LYS 217.A N GLY 214.A O no hydrogen 2.891 N/A LYS 217.A NZ HIS 211.A ND1 no hydrogen 3.529 N/A LYS 217.A NZ HIS 211.A O no hydrogen 2.941 N/A HIS 220.A N LEU 185.A O no hydrogen 2.786 N/A VAL 222.A N ILE 183.A O no hydrogen 2.957 N/A TYR 224.A OH PRO 174.A O no hydrogen 2.560 N/A GLY 227.A N GLY 173.A O no hydrogen 2.895 N/A ALA 229.A N THR 171.A O no hydrogen 2.898 N/A LEU 231.A N LEU 169.A O no hydrogen 2.860 N/A PHE 233.A N MET 167.A O no hydrogen 2.735 N/A PHE 234.A N PHE 198.A O no hydrogen 3.016 N/A VAL 235.A N SER 165.A O no hydrogen 2.806 N/A GLU 236.A N GLY 196.A O no hydrogen 2.847 N/A GLY 237.A N LEU 150.A O no hydrogen 2.951 N/A LEU 238.A N LYS 194.A O no hydrogen 2.774 N/A CYS 239.A SG PHE 240.A O no hydrogen 3.917 N/A ASP 242.A N PHE 245.A O no hydrogen 2.988 N/A GLU 243.A N ASP 242.A OD1 no hydrogen 2.664 N/A PHE 245.A N ASP 242.A O no hydrogen 3.039 N/A LEU 248.A N SER 246.A OG no hydrogen 3.162 N/A VAL 249.A N PHE 275.A O no hydrogen 2.895 N/A SER 250.A N ASP 191.A OD2 no hydrogen 3.212 N/A ILE 251.A N VAL 273.A O no hydrogen 2.975 N/A HIS 252.A N TYR 186.A O no hydrogen 2.981 N/A HIS 252.A ND1 THR 272.A OG1 no hydrogen 2.766 N/A VAL 253.A N ASP 271.A O no hydrogen 2.941 N/A SER 254.A N VAL 184.A O no hydrogen 2.868 N/A SER 254.A OG TYR 186.A OH no hydrogen 3.388 N/A SER 254.A OG THR 270.A OG1 no hydrogen 2.645 N/A LEU 255.A N PHE 269.A O no hydrogen 2.905 N/A LEU 256.A N GLU 182.A O no hydrogen 2.803 N/A GLU 257.A N THR 266.A O no hydrogen 2.783 N/A TYR 258.A N GLY 180.A O no hydrogen 2.670 N/A ILE 263.A N ALA 260.A O no hydrogen 3.223 N/A THR 266.A N GLU 257.A O no hydrogen 2.963 N/A ILE 268.A N THR 266.A O no hydrogen 2.955 N/A THR 270.A OG1 SER 254.A OG no hydrogen 2.645 N/A ASP 271.A N VAL 253.A O no hydrogen 2.871 N/A THR 272.A OG1 HIS 252.A ND1 no hydrogen 2.766 N/A VAL 273.A N ILE 251.A O no hydrogen 3.058 N/A ILE 274.A N LYS 135.A O no hydrogen 3.155 N/A PHE 275.A N VAL 249.A O no hydrogen 2.865 N/A ARG 276.A N ALA 147.A O no hydrogen 2.952 N/A ARG 276.A NH1 SER 246.A O no hydrogen 3.074 N/A ILE 277.A N GLY 247.A O no hydrogen 2.787 N/A ALA 278.A N LEU 149.A O no hydrogen 2.770 N/A TRP 280.A N GLN 422.A OE1 no hydrogen 2.901 N/A TRP 280.A NE1 VAL 350.A O no hydrogen 3.114 N/A ILE 281.A N TYR 340.A O no hydrogen 3.012 N/A MET 282.A N GLN 425.A OE1 no hydrogen 2.842 N/A ASN 285.A ND2 PHE 446.A O no hydrogen 3.139 N/A LEU 287.A N PRO 284.A O no hydrogen 3.161 N/A VAL 290.A N ARG 620.A O.A no hydrogen 2.712 N/A VAL 290.A N ARG 620.A O.B no hydrogen 2.703 N/A SER 291.A N ARG 620.A O.A no hydrogen 3.321 N/A SER 291.A N ARG 620.A O.B no hydrogen 3.308 N/A SER 291.A OG GLU 317.A OE1 no hydrogen 3.359 N/A VAL 292.A N GLU 317.A O no hydrogen 2.877 N/A PHE 293.A N ASN 618.A O no hydrogen 2.680 N/A VAL 294.A N LYS 319.A O no hydrogen 3.059 N/A CYS 295.A N GLY 616.A O no hydrogen 2.951 N/A CYS 295.A SG ASP 329.A O no hydrogen 3.339 N/A CYS 296.A SG MET 297.A O no hydrogen 3.600 N/A ASN 300.A N MET 297.A O no hydrogen 3.062 N/A ASN 300.A ND2 ASP 602.A O no hydrogen 3.350 N/A LEU 304.A N ASN 300.A O no hydrogen 3.403 N/A LYS 305.A N TYR 301.A O no hydrogen 2.939 N/A GLU 306.A N LEU 302.A O no hydrogen 2.904 N/A VAL 307.A N PHE 303.A O no hydrogen 2.952 N/A LYS 308.A N LEU 304.A O no hydrogen 2.915 N/A ASN 309.A N LYS 305.A O no hydrogen 2.834 N/A LEU 310.A N GLU 306.A O no hydrogen 2.964 N/A VAL 311.A N VAL 307.A O no hydrogen 2.977 N/A GLU 312.A N LYS 308.A O no hydrogen 2.969 N/A LYS 313.A N LEU 310.A O no hydrogen 2.897 N/A LYS 313.A NZ ASP 565.A OD1 no hydrogen 3.193 N/A LYS 313.A NZ GLU 596.A OE2 no hydrogen 3.113 N/A THR 314.A N VAL 311.A O no hydrogen 2.835 N/A THR 314.A OG1 VAL 311.A O no hydrogen 2.535 N/A CYS 316.A N THR 314.A OG1 no hydrogen 3.069 N/A CYS 316.A SG THR 314.A OG1 no hydrogen 3.555 N/A GLU 317.A N VAL 290.A O no hydrogen 3.252 N/A LYS 319.A N VAL 292.A O no hydrogen 2.877 N/A LYS 319.A NZ GLU 317.A OE1 no hydrogen 3.465 N/A CYS 321.A N VAL 294.A O no hydrogen 2.792 N/A CYS 321.A SG VAL 294.A O no hydrogen 3.592 N/A GLN 323.A NE2 ASP 329.A O no hydrogen 3.098 N/A GLN 323.A NE2 HIS 614.A O no hydrogen 3.293 N/A ASN 326.A ND2 GLY 358.A O no hydrogen 2.675 N/A ARG 327.A N TYR 324.A O no hydrogen 3.348 N/A ARG 327.A NH1 GLU 335.A OE1 no hydrogen 3.171 N/A ARG 327.A NH1 ASP 353.A OD1 no hydrogen 3.130 N/A ARG 327.A NH2 ASP 353.A OD1 no hydrogen 3.470 N/A ARG 327.A NH2 ASP 353.A OD2 no hydrogen 2.911 N/A GLY 328.A N GLU 335.A OE2 no hydrogen 2.830 N/A ARG 330.A NE CYS 615.A O no hydrogen 3.048 N/A ARG 330.A NH2 ASN 558.A OD1 no hydrogen 3.033 N/A TRP 331.A N GLY 328.A O no hydrogen 3.265 N/A GLN 333.A N ARG 330.A O no hydrogen 2.744 N/A GLN 333.A NE2 ASP 441.A OD2 no hydrogen 2.935 N/A GLN 333.A NE2 ASN 558.A OD1 no hydrogen 3.003 N/A ASP 334.A N ARG 330.A O no hydrogen 2.945 N/A GLU 335.A N TRP 331.A O no hydrogen 2.702 N/A GLU 337.A N LEU 352.A O no hydrogen 2.992 N/A GLY 339.A N VAL 350.A O no hydrogen 3.036 N/A TYR 340.A N ILE 281.A O no hydrogen 2.813 N/A ILE 341.A N PHE 348.A O no hydrogen 3.101 N/A ALA 343.A N LYS 346.A O no hydrogen 2.670 N/A PHE 348.A N ILE 341.A O no hydrogen 3.121 N/A VAL 350.A N GLY 339.A O no hydrogen 2.740 N/A VAL 351.A N GLY 365.A O no hydrogen 2.833 N/A LEU 352.A N GLU 337.A O no hydrogen 2.945 N/A ASP 353.A N VAL 367.A O no hydrogen 2.801 N/A SER 354.A N GLU 335.A O no hydrogen 2.875 N/A ARG 356.A N GLU 335.A OE1 no hydrogen 3.234 N/A ARG 356.A NH2 LEU 325.A O no hydrogen 3.358 N/A ASP 357.A N ASN 326.A O no hydrogen 3.079 N/A ASN 359.A ND2 ASP 353.A OD2 no hydrogen 3.220 N/A GLY 365.A N PRO 349.A O no hydrogen 2.863 N/A TYR 366.A N CYS 153.A O no hydrogen 3.166 N/A TYR 366.A OH ASP 353.A OD2 no hydrogen 2.355 N/A VAL 367.A N VAL 351.A O no hydrogen 2.779 N/A ARG 369.A N ASP 353.A O no hydrogen 3.173 N/A THR 371.A N ASP 374.A OD2 no hydrogen 2.961 N/A SER 372.A OG.A VAL 437.A O no hydrogen 2.291 N/A SER 372.A OG.B VAL 437.A O no hydrogen 2.552 N/A SER 372.A OG.B HIS 439.A NE2 no hydrogen 3.301 N/A LEU 373.A N THR 371.A OG1 no hydrogen 3.227 N/A ASP 374.A N THR 371.A O no hydrogen 3.028 N/A SER 375.A N SER 372.A O.A no hydrogen 3.176 N/A SER 375.A OG ASP 334.A O no hydrogen 3.542 N/A PHE 376.A N ASP 334.A O no hydrogen 2.754 N/A GLY 377.A N SER 375.A OG no hydrogen 3.046 N/A ASN 378.A N SER 375.A O no hydrogen 2.945 N/A ASN 378.A ND2 LEU 373.A O no hydrogen 2.897 N/A ASN 378.A ND2 GLY 400.A O no hydrogen 3.099 N/A LEU 379.A N PHE 376.A O no hydrogen 3.108 N/A GLU 380.A N LEU 398.A O no hydrogen 2.876 N/A SER 382.A N ARG 396.A O no hydrogen 2.912 N/A SER 382.A OG PRO 383.A O no hydrogen 2.891 N/A SER 382.A OG ARG 396.A O no hydrogen 3.480 N/A VAL 385.A N TYR 392.A O no hydrogen 3.346 N/A THR 386.A OG1 THR 391.A OG1 no hydrogen 3.388 N/A VAL 387.A N LYS 390.A O no hydrogen 2.898 N/A LYS 390.A N VAL 387.A O no hydrogen 2.988 N/A THR 391.A OG1 THR 386.A OG1 no hydrogen 3.388 N/A TYR 392.A N VAL 385.A O no hydrogen 2.821 N/A GLY 395.A N TYR 392.A O no hydrogen 2.916 N/A ARG 396.A N SER 382.A OG no hydrogen 2.829 N/A ARG 396.A NE ALA 426.A O no hydrogen 2.878 N/A ARG 396.A NH1 GLU 526.A O no hydrogen 3.050 N/A ARG 396.A NH1 GLU 526.A OE1 no hydrogen 3.058 N/A ARG 396.A NH2 ALA 426.A O no hydrogen 3.128 N/A ILE 397.A N GLN 425.A O no hydrogen 2.935 N/A LEU 398.A N GLU 380.A O no hydrogen 2.647 N/A ILE 399.A N VAL 428.A O no hydrogen 3.005 N/A SER 401.A N LEU 430.A O no hydrogen 2.869 N/A SER 401.A OG SER 402.A O no hydrogen 3.451 N/A SER 401.A OG GLU 429.A OE2 no hydrogen 3.389 N/A SER 402.A N SER 401.A OG no hydrogen 2.674 N/A SER 402.A OG SER 406.A OG no hydrogen 3.398 N/A SER 402.A OG ARG 409.A O no hydrogen 2.653 N/A SER 406.A N PHE 403.A O no hydrogen 3.060 N/A SER 406.A OG PHE 403.A O no hydrogen 2.530 N/A GLY 408.A N SER 406.A OG no hydrogen 3.083 N/A ARG 409.A N ASP 433.A OD1 no hydrogen 3.006 N/A ARG 409.A NE ASP 433.A OD2 no hydrogen 2.776 N/A ARG 409.A NH1 THR 436.A O no hydrogen 3.134 N/A ARG 409.A NH2 ASP 433.A OD2 no hydrogen 2.927 N/A ARG 409.A NH2 LEU 435.A O no hydrogen 2.910 N/A ARG 409.A NH2 THR 436.A O no hydrogen 3.177 N/A ARG 410.A NE GLU 429.A OE2 no hydrogen 3.017 N/A ARG 410.A NH2 GLU 429.A OE1 no hydrogen 2.941 N/A ARG 410.A NH2 GLU 429.A OE2 no hydrogen 3.513 N/A THR 412.A N ASP 374.A OD1 no hydrogen 2.668 N/A THR 412.A OG1 ASP 374.A OD1 no hydrogen 3.002 N/A LYS 413.A NZ ASP 417.A OD1 no hydrogen 3.550 N/A LYS 413.A NZ ASP 417.A OD2 no hydrogen 2.716 N/A ARG 416.A N THR 412.A O no hydrogen 3.087 N/A ARG 416.A NE MET 411.A O no hydrogen 2.895 N/A ASP 417.A N LYS 413.A O no hydrogen 2.791 N/A PHE 418.A N VAL 414.A O no hydrogen 3.039 N/A LEU 419.A N VAL 415.A O no hydrogen 3.010 N/A LYS 420.A N ARG 416.A O no hydrogen 3.082 N/A ALA 421.A N ASP 417.A O no hydrogen 2.943 N/A GLN 422.A N LEU 419.A O no hydrogen 3.382 N/A GLN 422.A NE2 PRO 241.A O no hydrogen 3.159 N/A GLN 422.A NE2 PHE 418.A O no hydrogen 2.774 N/A GLN 423.A N LYS 420.A O no hydrogen 3.022 N/A VAL 424.A N GLN 422.A O no hydrogen 2.708 N/A GLN 425.A NE2 MET 282.A O no hydrogen 2.727 N/A GLN 425.A NE2 LEU 394.A O no hydrogen 2.927 N/A ALA 426.A N GLN 423.A O no hydrogen 3.292 N/A VAL 428.A N ILE 397.A O no hydrogen 2.811 N/A LEU 430.A N ILE 399.A O no hydrogen 2.773 N/A TYR 431.A N ASN 519.A OD1 no hydrogen 2.750 N/A SER 432.A N SER 401.A O no hydrogen 2.960 N/A SER 432.A OG ASN 378.A OD1 no hydrogen 3.341 N/A SER 432.A OG GLY 438.A O no hydrogen 2.797 N/A ASP 433.A N SER 401.A O no hydrogen 3.179 N/A TRP 434.A NE1 TYR 431.A O no hydrogen 3.040 N/A LEU 435.A N SER 432.A O no hydrogen 3.104 N/A THR 436.A N ALA 549.A O no hydrogen 2.803 N/A THR 436.A OG1 ASP 544.A OD1 no hydrogen 2.544 N/A THR 436.A OG1 ALA 549.A O no hydrogen 3.341 N/A HIS 439.A N GLU 442.A OE2 no hydrogen 2.954 N/A HIS 439.A NE2 SER 372.A O.A no hydrogen 2.861 N/A HIS 439.A NE2 SER 372.A O.B no hydrogen 2.695 N/A VAL 440.A N ASN 378.A OD1 no hydrogen 3.002 N/A ASP 441.A N GLY 377.A O no hydrogen 3.122 N/A GLU 442.A N HIS 439.A O no hydrogen 3.050 N/A PHE 443.A N VAL 440.A O no hydrogen 3.216 N/A MET 444.A N VAL 440.A O no hydrogen 3.300 N/A SER 445.A N LEU 458.A O no hydrogen 3.092 N/A SER 445.A OG.A VAL 557.A O no hydrogen 3.144 N/A SER 445.A OG.B PHE 446.A O no hydrogen 3.441 N/A VAL 447.A N LEU 456.A O no hydrogen 3.089 N/A ILE 449.A N LYS 454.A O no hydrogen 2.819 N/A THR 452.A N ILE 449.A O no hydrogen 3.082 N/A THR 452.A OG1 ILE 449.A O no hydrogen 2.616 N/A LYS 454.A N THR 452.A OG1 no hydrogen 2.966 N/A LEU 456.A N VAL 447.A O no hydrogen 2.823 N/A LEU 457.A N ASP 533.A O no hydrogen 2.808 N/A LEU 458.A N SER 445.A O no hydrogen 2.828 N/A MET 459.A N ILE 535.A O no hydrogen 2.912 N/A ALA 460.A N PHE 443.A O no hydrogen 2.912 N/A SER 461.A N LEU 537.A O no hydrogen 2.747 N/A SER 461.A OG GLN 513.A OE1 no hydrogen 3.410 N/A THR 462.A OG1 ASN 509.A O no hydrogen 2.914 N/A THR 462.A OG1 GLN 513.A OE1 no hydrogen 3.412 N/A SER 463.A N GLN 513.A OE1 no hydrogen 2.996 N/A SER 463.A OG.B SER 461.A OG no hydrogen 3.164 N/A ALA 464.A N SER 461.A OG no hydrogen 2.931 N/A TYR 466.A N THR 462.A O no hydrogen 2.975 N/A LYS 467.A N SER 463.A O no hydrogen 2.992 N/A LEU 468.A N ALA 464.A O no hydrogen 3.152 N/A PHE 469.A N CYS 465.A O no hydrogen 2.938 N/A ARG 470.A N TYR 466.A O no hydrogen 2.925 N/A GLU 471.A N LYS 467.A O no hydrogen 3.036 N/A LYS 472.A N LEU 468.A O no hydrogen 3.017 N/A GLN 473.A N PHE 469.A O no hydrogen 2.957 N/A GLN 473.A NE2 ASN 497.A OD1 no hydrogen 2.680 N/A LYS 474.A N ARG 470.A O no hydrogen 2.955 N/A ASP 475.A N GLU 471.A O no hydrogen 2.799 N/A GLY 476.A N GLN 473.A O no hydrogen 2.898 N/A HIS 477.A N LYS 472.A O no hydrogen 2.840 N/A ALA 480.A N HIS 477.A O no hydrogen 2.953 N/A MET 482.A N ILE 494.A O no hydrogen 2.914 N/A PHE 483.A N PHE 572.A O no hydrogen 2.901 N/A LEU 486.A N PHE 483.A O no hydrogen 3.017 N/A GLY 488.A N HIS 607.A O no hydrogen 2.747 N/A MET 489.A N.A LEU 486.A O no hydrogen 2.968 N/A MET 489.A N.B LEU 486.A O no hydrogen 2.976 N/A SER 490.A N GLY 487.A O no hydrogen 3.340 N/A SER 490.A OG LEU 486.A O no hydrogen 3.494 N/A SER 490.A OG GLY 487.A O no hydrogen 3.332 N/A LYS 492.A N MET 489.A O.A no hydrogen 2.961 N/A LYS 492.A N MET 489.A O.B no hydrogen 3.281 N/A ARG 493.A N SER 490.A O no hydrogen 2.902 N/A ILE 496.A N ALA 480.A O no hydrogen 3.185 N/A ASN 497.A N GLY 478.A O no hydrogen 2.843 N/A ASN 497.A ND2 GLU 479.A OE2 no hydrogen 3.030 N/A LYS 498.A N THR 495.A OG1 no hydrogen 3.101 N/A LYS 498.A NZ ARG 493.A O no hydrogen 2.880 N/A ILE 499.A N THR 495.A O no hydrogen 3.069 N/A LEU 500.A N ILE 496.A O no hydrogen 2.917 N/A SER 501.A N ASN 497.A O no hydrogen 2.939 N/A SER 501.A OG.A ASN 497.A O no hydrogen 3.052 N/A SER 501.A OG.B ASN 497.A O no hydrogen 3.209 N/A SER 501.A OG.B LYS 498.A O no hydrogen 3.379 N/A ASN 502.A N ILE 499.A O no hydrogen 3.217 N/A SER 504.A OG ASN 502.A OD1 no hydrogen 3.238 N/A LEU 505.A N ASN 502.A OD1 no hydrogen 3.198 N/A VAL 506.A N ASN 502.A O no hydrogen 3.111 N/A GLN 507.A N GLU 503.A O.A no hydrogen 3.145 N/A GLN 507.A N GLU 503.A O.B no hydrogen 3.122 N/A GLU 508.A N SER 504.A O no hydrogen 2.913 N/A ASN 509.A N LEU 505.A O no hydrogen 2.949 N/A ASN 509.A ND2 LEU 505.A O no hydrogen 2.976 N/A ASN 509.A ND2 PHE 541.A O no hydrogen 2.938 N/A LEU 510.A N VAL 506.A O no hydrogen 2.940 N/A TYR 511.A N GLN 507.A O no hydrogen 3.115 N/A PHE 512.A N GLU 508.A O no hydrogen 2.999 N/A GLN 513.A N ASN 509.A O no hydrogen 2.961 N/A GLN 513.A NE2 ASP 517.A OD1 no hydrogen 2.975 N/A ARG 514.A N LEU 510.A O no hydrogen 3.144 N/A CYS 515.A N TYR 511.A O no hydrogen 3.151 N/A CYS 515.A SG TYR 511.A O no hydrogen 3.555 N/A LEU 516.A N PHE 512.A O no hydrogen 2.894 N/A ASP 517.A N GLN 513.A O no hydrogen 2.869 N/A TRP 518.A N ARG 514.A O no hydrogen 2.981 N/A ASN 519.A N CYS 515.A O no hydrogen 3.353 N/A ASN 519.A ND2 TYR 431.A O no hydrogen 2.871 N/A ASN 519.A ND2 CYS 515.A O no hydrogen 2.920 N/A ARG 520.A N LEU 516.A O no hydrogen 2.898 N/A ARG 520.A NE GLU 531.A OE2 no hydrogen 2.916 N/A ARG 520.A NH1 ASP 536.A OD1 no hydrogen 3.436 N/A ARG 520.A NH1 ASP 536.A OD2 no hydrogen 2.814 N/A ARG 520.A NH2 GLU 531.A OE1 no hydrogen 2.853 N/A ARG 520.A NH2 ASP 536.A OD1 no hydrogen 2.852 N/A ASP 521.A N ASP 517.A O no hydrogen 3.035 N/A ILE 522.A N TRP 518.A O no hydrogen 3.253 N/A LEU 523.A N ASN 519.A O no hydrogen 2.812 N/A LYS 524.A N ARG 520.A O no hydrogen 2.927 N/A LYS 524.A NZ GLU 531.A OE2 no hydrogen 2.906 N/A LYS 525.A N ASP 521.A O no hydrogen 2.998 N/A GLU 526.A N ILE 522.A O no hydrogen 2.779 N/A LEU 527.A N LEU 523.A O no hydrogen 2.807 N/A LEU 529.A N LYS 524.A O no hydrogen 3.038 N/A THR 530.A N ASP 533.A OD2 no hydrogen 2.931 N/A THR 530.A OG1 ASP 533.A OD2 no hydrogen 3.513 N/A GLN 532.A N THR 530.A OG1 no hydrogen 3.181 N/A ASP 533.A N THR 530.A O no hydrogen 2.929 N/A ILE 534.A N GLU 531.A O no hydrogen 3.287 N/A ILE 535.A N LEU 457.A O no hydrogen 2.929 N/A LEU 537.A N MET 459.A O no hydrogen 2.891 N/A ALA 539.A N SER 461.A O no hydrogen 3.016 N/A PHE 541.A N ASN 509.A OD1 no hydrogen 2.988 N/A LYS 542.A N ARG 550.A O no hydrogen 2.887 N/A MET 543.A N GLU 508.A OE1 no hydrogen 3.362 N/A ASP 544.A N ARG 548.A O no hydrogen 2.806 N/A ASP 546.A N ASP 544.A OD2 no hydrogen 2.739 N/A HIS 547.A N ASP 544.A O no hydrogen 3.028 N/A ARG 548.A N ASP 544.A OD2 no hydrogen 2.964 N/A ARG 548.A NE ASP 433.A O no hydrogen 2.807 N/A ARG 548.A NH2 ASP 433.A OD1 no hydrogen 3.239 N/A ALA 549.A N TRP 434.A O no hydrogen 2.787 N/A ARG 550.A N LYS 542.A O no hydrogen 2.965 N/A PHE 552.A N LEU 540.A O no hydrogen 2.832 N/A ASN 558.A N ASN 555.A O no hydrogen 3.417 N/A ILE 560.A N GLY 567.A O no hydrogen 2.871 N/A LEU 562.A N ASP 565.A O no hydrogen 2.817 N/A LYS 564.A NZ ASP 565.A OD2 no hydrogen 2.885 N/A ASP 565.A N LEU 562.A O no hydrogen 2.952 N/A LEU 566.A N GLU 596.A O no hydrogen 2.936 N/A GLY 567.A N ILE 560.A O no hydrogen 2.872 N/A ILE 568.A N THR 598.A O no hydrogen 2.843 N/A LYS 570.A N ILE 600.A O no hydrogen 2.945 N/A VAL 576.A N GLU 579.A O no hydrogen 2.846 N/A GLU 579.A N VAL 576.A O no hydrogen 3.161 N/A CYS 581.A N PRO 574.A O no hydrogen 2.919 N/A CYS 581.A SG PRO 574.A O no hydrogen 3.473 N/A MET 584.A N CYS 580.A O no hydrogen 2.984 N/A HIS 585.A N CYS 581.A O no hydrogen 3.077 N/A VAL 586.A N LEU 582.A O no hydrogen 3.003 N/A ARG 587.A N GLU 583.A O no hydrogen 3.008 N/A ARG 587.A NH1 GLU 591.A OE2 no hydrogen 2.905 N/A ARG 587.A NH1 CYS 597.A O no hydrogen 2.856 N/A ARG 587.A NH2 CYS 597.A O no hydrogen 3.327 N/A GLY 588.A N MET 584.A O no hydrogen 3.164 N/A LEU 589.A N HIS 585.A O no hydrogen 3.177 N/A LEU 589.A N VAL 586.A O no hydrogen 3.081 N/A LEU 590.A N VAL 586.A O no hydrogen 3.020 N/A GLU 591.A N ARG 587.A O no hydrogen 2.801 N/A LEU 593.A N LEU 590.A O no hydrogen 2.993 N/A GLY 594.A N GLU 591.A O no hydrogen 2.993 N/A GLU 596.A N LYS 564.A O no hydrogen 2.845 N/A THR 598.A N LEU 566.A O no hydrogen 2.939 N/A ILE 600.A N ILE 568.A O no hydrogen 2.713 N/A ASP 601.A N GLU 306.A OE1 no hydrogen 2.861 N/A SER 604.A N ASP 601.A OD2 no hydrogen 2.901 N/A SER 604.A OG ASP 601.A OD1 no hydrogen 2.484 N/A SER 604.A OG ASP 601.A OD2 no hydrogen 3.269 N/A TYR 606.A N ILE 603.A O no hydrogen 2.910 N/A HIS 607.A N SER 604.A O no hydrogen 2.906 N/A HIS 614.A ND1 ASP 329.A OD2 no hydrogen 3.066 N/A GLY 616.A N CYS 295.A O no hydrogen 3.086 N/A THR 617.A N GLN 333.A OE1 no hydrogen 3.277 N/A ASN 618.A N PHE 293.A O no hydrogen 2.711 N/A ASN 618.A ND2 ILE 332.A O no hydrogen 3.054 N/A ARG 620.A N.A SER 291.A O no hydrogen 2.795 N/A ARG 620.A N.B SER 291.A O no hydrogen 2.790 N/A ARG 621.A NH1 LEU 287.A O no hydrogen 2.967 N/A ARG 621.A NH1 VAL 561.A O no hydrogen 3.208 N/A ARG 621.A NH2 VAL 561.A O no hydrogen 2.760 N/A LYS 622.A N PRO 288.A O no hydrogen 2.935 N/A LYS 627.A NZ GLU 342.A OE1 no hydrogen 2.615 N/A TRP 628.A NE1 GLU 342.A O no hydrogen 2.802 N/A HIS 630.A N LYS 627.A O no hydrogen 2.847 N/A MET 631.A N.A TRP 628.A O no hydrogen 3.014 N/A MET 631.A N.B TRP 628.A O no hydrogen 3.004 N/A