Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pnq_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A N ASN 4.A OD1 no hydrogen 3.190 N/A THR 6.A OG1 ASN 4.A OD1 no hydrogen 3.467 N/A LEU 7.A N ASN 4.A O no hydrogen 3.049 N/A LEU 8.A N PRO 5.A O no hydrogen 2.901 N/A PHE 9.A N THR 6.A O no hydrogen 2.917 N/A LEU 10.A N LEU 7.A O no hydrogen 2.906 N/A LYS 11.A N LEU 8.A O no hydrogen 3.275 N/A VAL 12.A N LEU 8.A O no hydrogen 3.346 N/A GLN 15.A N GLN 15.A OE1 no hydrogen 3.253 N/A ALA 17.A N PRO 13.A O no hydrogen 3.364 N/A ALA 17.A N VAL 14.A O no hydrogen 3.167 N/A ILE 18.A N GLN 15.A O no hydrogen 2.922 N/A SER 19.A OG SER 506.A OG no hydrogen 2.966 N/A THR 20.A N ALA 17.A O no hydrogen 2.923 N/A THR 20.A OG1 ALA 17.A O no hydrogen 2.958 N/A THR 21.A N ILE 18.A O no hydrogen 2.907 N/A THR 21.A OG1 ILE 18.A O no hydrogen 2.534 N/A TYR 24.A N PHE 22.A O no hydrogen 2.901 N/A SER 31.A N ASP 230.A OD1 no hydrogen 2.734 N/A SER 31.A OG ASP 230.A OD1 no hydrogen 2.533 N/A SER 31.A OG ASP 230.A OD2 no hydrogen 3.403 N/A THR 34.A OG1 THR 36.A OG1 no hydrogen 2.908 N/A THR 34.A OG1 GLY 354.A O no hydrogen 2.774 N/A THR 36.A N THR 34.A OG1 no hydrogen 3.177 N/A THR 36.A OG1 THR 34.A OG1 no hydrogen 2.908 N/A THR 36.A OG1 LEU 351.A O no hydrogen 3.562 N/A THR 36.A OG1 GLY 354.A O no hydrogen 3.015 N/A THR 39.A N GLY 35.A O no hydrogen 3.140 N/A THR 39.A OG1 GLY 35.A O no hydrogen 3.210 N/A THR 39.A OG1 THR 226.A OG1 no hydrogen 2.974 N/A THR 39.A OG1 LEU 351.A O no hydrogen 3.515 N/A MET 40.A N THR 36.A O no hydrogen 2.903 N/A ASP 41.A N GLY 37.A O no hydrogen 2.893 N/A THR 42.A N TYR 38.A O no hydrogen 2.888 N/A THR 42.A OG1 GLU 311.A OE2 no hydrogen 2.425 N/A VAL 43.A N THR 39.A O no hydrogen 2.928 N/A ASN 44.A N MET 40.A O no hydrogen 2.921 N/A ASN 44.A ND2 LYS 388.A O no hydrogen 3.635 N/A ARG 45.A N ASP 41.A O no hydrogen 2.877 N/A ARG 45.A NE GLU 311.A OE1 no hydrogen 2.908 N/A ARG 45.A NH1 ASP 41.A OD2 no hydrogen 2.778 N/A ARG 45.A NH2 GLU 311.A OE2 no hydrogen 3.001 N/A THR 46.A N THR 42.A O no hydrogen 2.889 N/A THR 46.A OG1 THR 42.A O no hydrogen 2.896 N/A HIS 47.A N VAL 43.A O no hydrogen 2.952 N/A HIS 47.A NE2 SER 402.A O no hydrogen 3.039 N/A LYS 48.A N ASN 44.A O no hydrogen 2.886 N/A LYS 48.A N ARG 45.A O no hydrogen 3.239 N/A TYR 49.A N ARG 45.A O no hydrogen 3.170 N/A GLU 51.A N LYS 48.A O no hydrogen 3.504 N/A LYS 52.A N TYR 82.A OH no hydrogen 3.038 N/A GLY 53.A N SER 50.A O no hydrogen 2.833 N/A LYS 54.A N ASN 67.A O no hydrogen 2.914 N/A THR 56.A N GLN 65.A O no hydrogen 2.924 N/A ASN 58.A N ALA 63.A O no hydrogen 3.080 N/A THR 59.A OG1 GLU 60.A OE2 no hydrogen 2.684 N/A GLU 60.A N ASN 58.A OD1 no hydrogen 2.997 N/A THR 61.A N ASN 58.A OD1 no hydrogen 2.956 N/A GLN 65.A N THR 56.A O no hydrogen 2.874 N/A GLN 65.A NE2 ASN 346.A OD1 no hydrogen 2.923 N/A ASN 67.A N LYS 54.A O no hydrogen 2.882 N/A ILE 69.A N ASN 67.A OD1 no hydrogen 3.136 N/A ASP 70.A N ALA 83.A O no hydrogen 2.926 N/A GLY 71.A N PRO 68.A O no hydrogen 3.007 N/A SER 80.A N ASN 476.A OD1 no hydrogen 2.794 N/A GLY 81.A N TYR 49.A O no hydrogen 3.424 N/A ALA 83.A N GLY 81.A O no hydrogen 2.924 N/A GLN 84.A N LEU 472.A O no hydrogen 3.401 N/A GLN 84.A NE2 GLY 71.A O no hydrogen 3.308 N/A GLN 84.A NE2 TYR 82.A O no hydrogen 2.995 N/A THR 85.A N ASP 70.A OD1 no hydrogen 3.375 N/A CYS 87.A SG ASP 86.A OD1 no hydrogen 3.446 N/A VAL 88.A N GLN 84.A O no hydrogen 3.094 N/A LEU 89.A N THR 85.A O no hydrogen 2.924 N/A GLU 90.A N ASP 86.A O no hydrogen 2.874 N/A ALA 91.A N CYS 87.A O no hydrogen 2.902 N/A MET 92.A N VAL 88.A O no hydrogen 2.939 N/A ALA 93.A N LEU 89.A O no hydrogen 2.880 N/A PHE 94.A N GLU 90.A O no hydrogen 2.906 N/A LEU 95.A N ALA 91.A O no hydrogen 2.909 N/A GLU 96.A N MET 92.A O no hydrogen 2.910 N/A GLU 97.A N ALA 93.A O no hydrogen 2.883 N/A SER 98.A N PHE 94.A O no hydrogen 2.899 N/A SER 98.A OG ASN 425.A OD1 no hydrogen 2.872 N/A SER 98.A OG GLN 428.A OE1 no hydrogen 2.891 N/A SER 98.A OG TYR 431.A OH no hydrogen 3.255 N/A HIS 99.A N LEU 95.A O no hydrogen 3.171 N/A HIS 99.A N GLU 96.A O no hydrogen 3.263 N/A ILE 102.A N HIS 99.A O no hydrogen 3.146 N/A ASN 105.A N GLY 101.A O no hydrogen 3.131 N/A SER 106.A N ILE 102.A O no hydrogen 2.925 N/A SER 106.A OG ILE 102.A O no hydrogen 3.262 N/A CYS 107.A N PHE 103.A O no hydrogen 2.868 N/A CYS 107.A SG PHE 103.A O no hydrogen 3.381 N/A CYS 107.A SG ILE 325.A O no hydrogen 3.643 N/A LEU 108.A N GLU 104.A O no hydrogen 2.935 N/A GLU 109.A N ASN 105.A O no hydrogen 2.964 N/A THR 110.A N SER 106.A O no hydrogen 2.887 N/A THR 110.A OG1 SER 106.A O no hydrogen 2.641 N/A MET 111.A N CYS 107.A O no hydrogen 2.856 N/A GLU 112.A N LEU 108.A O no hydrogen 2.992 N/A ILE 113.A N GLU 109.A O no hydrogen 2.921 N/A VAL 114.A N THR 110.A O no hydrogen 2.825 N/A GLN 115.A N MET 111.A O no hydrogen 2.969 N/A GLN 116.A N GLU 112.A O no hydrogen 3.397 N/A THR 117.A N VAL 114.A O no hydrogen 3.521 N/A THR 117.A OG1 ILE 113.A O no hydrogen 2.419 N/A VAL 119.A N GLY 161.A O no hydrogen 2.697 N/A LYS 121.A N ARG 118.A O no hydrogen 3.288 N/A LEU 122.A N VAL 119.A O no hydrogen 2.924 N/A THR 123.A N ASP 120.A O no hydrogen 2.903 N/A THR 123.A OG1 ASP 120.A O no hydrogen 2.234 N/A GLN 124.A N LYS 121.A O no hydrogen 2.911 N/A GLY 125.A N LEU 122.A O no hydrogen 3.460 N/A THR 128.A N GLN 137.A O no hydrogen 2.865 N/A THR 128.A OG1 TYR 129.A O no hydrogen 3.383 N/A ASP 130.A N ARG 135.A O no hydrogen 2.835 N/A TRP 131.A NE1 THR 146.A OG1 no hydrogen 3.189 N/A THR 132.A N ASP 130.A OD1 no hydrogen 3.292 N/A THR 132.A OG1 ASP 130.A OD1 no hydrogen 2.780 N/A ASN 134.A ND2 ASN 134.A O no hydrogen 2.518 N/A ARG 135.A N ASP 130.A O no hydrogen 2.978 N/A GLN 137.A N THR 128.A O no hydrogen 2.909 N/A ALA 142.A N PRO 138.A O no hydrogen 2.853 N/A LEU 143.A N ALA 139.A O no hydrogen 2.906 N/A ALA 144.A N ALA 140.A O no hydrogen 2.912 N/A ASN 145.A N THR 141.A O no hydrogen 2.913 N/A ASN 145.A ND2 ASP 130.A OD2 no hydrogen 2.948 N/A THR 146.A N ALA 142.A O no hydrogen 2.914 N/A THR 146.A OG1 ALA 142.A O no hydrogen 3.344 N/A ILE 147.A N LEU 143.A O no hydrogen 2.906 N/A GLU 148.A N ALA 144.A O no hydrogen 2.908 N/A VAL 149.A N ASN 145.A O no hydrogen 2.928 N/A PHE 150.A N THR 146.A O no hydrogen 2.908 N/A ARG 151.A N ILE 147.A O no hydrogen 2.894 N/A SER 152.A N GLU 148.A O no hydrogen 2.925 N/A ASN 153.A N VAL 149.A O no hydrogen 3.128 N/A ASN 153.A N PHE 150.A O no hydrogen 3.166 N/A ASN 153.A ND2 VAL 149.A O no hydrogen 3.065 N/A ASN 153.A ND2 GLU 180.A O no hydrogen 2.843 N/A GLY 154.A N ARG 151.A O no hydrogen 3.264 N/A LEU 155.A N PHE 150.A O no hydrogen 2.888 N/A ALA 157.A N ASP 169.A OD1 no hydrogen 3.126 N/A ASN 158.A N ASP 169.A OD2 no hydrogen 2.361 N/A ASN 158.A ND2 LEU 155.A O no hydrogen 3.426 N/A GLU 159.A N THR 156.A O no hydrogen 3.004 N/A SER 160.A OG ASP 165.A OD2 no hydrogen 3.067 N/A ARG 162.A NH1 ASP 165.A OD2 no hydrogen 2.634 N/A LEU 163.A N THR 117.A O no hydrogen 2.899 N/A LEU 167.A N LEU 163.A O no hydrogen 2.927 N/A LYS 168.A N ILE 164.A O no hydrogen 2.908 N/A LYS 168.A NZ ASP 165.A OD1 no hydrogen 3.399 N/A ASP 169.A N ASP 165.A O no hydrogen 2.909 N/A VAL 170.A N PHE 166.A O no hydrogen 2.895 N/A MET 171.A N LEU 167.A O no hydrogen 2.931 N/A ASP 172.A N LYS 168.A O no hydrogen 2.913 N/A SER 173.A N ASP 169.A O no hydrogen 2.864 N/A SER 173.A OG ASP 169.A O no hydrogen 3.191 N/A SER 173.A OG VAL 170.A O no hydrogen 2.386 N/A SER 173.A OG TYR 217.A OH no hydrogen 2.806 N/A MET 174.A N VAL 170.A O no hydrogen 2.956 N/A ASP 175.A N ASP 172.A O no hydrogen 2.979 N/A LYS 176.A N SER 173.A O no hydrogen 3.192 N/A MET 179.A N LEU 212.A O no hydrogen 2.911 N/A GLU 180.A N ASN 153.A OD1 no hydrogen 3.105 N/A ILE 181.A N GLN 210.A O no hydrogen 2.901 N/A THR 182.A OG1 LYS 208.A O no hydrogen 3.032 N/A THR 183.A OG1 THR 132.A O no hydrogen 2.845 N/A PHE 185.A N GLY 206.A O no hydrogen 2.879 N/A ARG 187.A N THR 204.A O no hydrogen 2.912 N/A ARG 189.A N GLN 202.A O no hydrogen 2.921 N/A VAL 191.A N VAL 200.A O no hydrogen 2.918 N/A ASP 193.A N LYS 198.A O no hydrogen 2.791 N/A LYS 197.A N ASP 193.A O no hydrogen 2.777 N/A VAL 200.A N VAL 191.A O no hydrogen 2.877 N/A GLN 202.A N ARG 189.A O no hydrogen 2.865 N/A GLN 202.A NE2 ASN 663.A OD1 no hydrogen 3.341 N/A ARG 203.A N ASN 663.A O no hydrogen 2.793 N/A THR 204.A N ARG 187.A O no hydrogen 2.907 N/A THR 204.A OG1 ARG 187.A O no hydrogen 3.094 N/A ILE 205.A N SER 665.A O no hydrogen 3.200 N/A GLY 206.A N PHE 185.A O no hydrogen 2.954 N/A LYS 207.A NZ ASP 672.A OD2 no hydrogen 2.946 N/A LYS 208.A N THR 183.A O no hydrogen 3.046 N/A GLN 210.A N ILE 181.A O no hydrogen 2.904 N/A LEU 212.A N MET 179.A O no hydrogen 2.884 N/A ASN 213.A N ASN 213.A OD1 no hydrogen 2.528 N/A ARG 215.A NE GLU 60.A O no hydrogen 2.971 N/A SER 216.A OG ASN 213.A OD1 no hydrogen 3.065 N/A TYR 217.A N ASN 213.A O no hydrogen 3.077 N/A TYR 217.A OH SER 173.A OG no hydrogen 2.806 N/A LEU 218.A N.A LYS 214.A O no hydrogen 2.905 N/A LEU 218.A N.B LYS 214.A O no hydrogen 2.906 N/A ILE 219.A N ARG 215.A O no hydrogen 2.900 N/A ARG 220.A N SER 216.A O no hydrogen 2.936 N/A ARG 220.A NH1 TRP 131.A O no hydrogen 2.385 N/A ALA 221.A N TYR 217.A O no hydrogen 2.870 N/A ALA 221.A N LEU 218.A O.A no hydrogen 3.226 N/A ALA 221.A N LEU 218.A O.B no hydrogen 3.233 N/A LEU 222.A N LEU 218.A O.A no hydrogen 3.192 N/A LEU 222.A N LEU 218.A O.B no hydrogen 3.195 N/A THR 223.A N ARG 220.A O no hydrogen 3.489 N/A THR 223.A OG1 ILE 219.A O no hydrogen 2.448 N/A LEU 224.A N MET 348.A O no hydrogen 2.765 N/A ASN 225.A N THR 243.A O no hydrogen 2.935 N/A ASN 225.A ND2 ASN 136.A OD1 no hydrogen 2.550 N/A THR 226.A N ASN 225.A OD1 no hydrogen 3.255 N/A THR 226.A OG1 THR 39.A OG1 no hydrogen 2.974 N/A THR 226.A OG1 ARG 350.A O no hydrogen 2.054 N/A THR 226.A OG1 LEU 351.A O no hydrogen 3.184 N/A MET 227.A N ILE 241.A O no hydrogen 2.937 N/A LYS 229.A N ARG 239.A O no hydrogen 3.040 N/A ALA 231.A N PRO 29.A O no hydrogen 3.140 N/A ARG 233.A NH1 GLY 26.A O no hydrogen 2.545 N/A ARG 233.A NH2 GLY 26.A O no hydrogen 2.941 N/A ARG 238.A NH1 LEU 236.A O no hydrogen 3.224 N/A ARG 238.A NH2 LYS 235.A O no hydrogen 2.756 N/A ARG 239.A NE GLU 232.A OE1 no hydrogen 3.073 N/A ARG 239.A NE GLU 232.A OE2 no hydrogen 3.242 N/A ARG 239.A NH2 GLU 232.A OE1 no hydrogen 2.538 N/A ILE 241.A N MET 227.A O no hydrogen 2.873 N/A THR 243.A N ASN 225.A O no hydrogen 2.848 N/A GLN 247.A N GLN 247.A OE1 no hydrogen 2.999 N/A GLN 247.A NE2 TYR 217.A OH no hydrogen 3.317 N/A ILE 248.A N GLY 245.A O no hydrogen 3.374 N/A ARG 249.A NE PRO 244.A O no hydrogen 3.399 N/A VAL 252.A N ILE 248.A O no hydrogen 3.181 N/A TYR 253.A N ARG 249.A O no hydrogen 2.871 N/A PHE 254.A N GLY 250.A O no hydrogen 2.973 N/A VAL 255.A N PHE 251.A O no hydrogen 2.952 N/A GLU 256.A N VAL 252.A O no hydrogen 2.870 N/A ALA 257.A N TYR 253.A O no hydrogen 2.890 N/A LEU 258.A N PHE 254.A O no hydrogen 2.984 N/A ALA 259.A N VAL 255.A O no hydrogen 2.914 N/A ARG 260.A N GLU 256.A O no hydrogen 2.835 N/A ARG 260.A NH1 GLU 264.A OE2 no hydrogen 2.676 N/A SER 261.A N ALA 257.A O no hydrogen 2.953 N/A SER 261.A OG ALA 257.A O no hydrogen 2.798 N/A ILE 262.A N LEU 258.A O no hydrogen 2.956 N/A CYS 263.A N ALA 259.A O no hydrogen 2.842 N/A CYS 263.A SG ALA 259.A O no hydrogen 3.449 N/A CYS 263.A SG SER 269.A OG no hydrogen 3.543 N/A CYS 263.A SG MET 414.A O no hydrogen 3.810 N/A GLU 264.A N ARG 260.A O no hydrogen 2.932 N/A LYS 265.A N ILE 262.A O no hydrogen 3.262 N/A LYS 265.A NZ GLU 109.A OE2 no hydrogen 2.795 N/A LYS 265.A NZ SER 261.A O no hydrogen 3.098 N/A GLN 268.A NE2 ASP 439.A OD1 no hydrogen 2.512 N/A SER 269.A N LEU 266.A O no hydrogen 3.229 N/A SER 269.A OG LEU 271.A O no hydrogen 3.183 N/A GLY 270.A N GLN 442.A O no hydrogen 2.796 N/A ASN 276.A ND2 ASN 536.A OD1 no hydrogen 3.040 N/A LYS 279.A N GLY 275.A O no hydrogen 3.068 N/A ALA 280.A N ASN 276.A O no hydrogen 2.898 N/A LYS 281.A N GLU 277.A O no hydrogen 2.928 N/A LYS 281.A NZ LEU 266.A O no hydrogen 3.035 N/A LYS 281.A NZ SER 269.A O no hydrogen 2.783 N/A LEU 282.A N LYS 278.A O no hydrogen 2.891 N/A ALA 283.A N LYS 279.A O no hydrogen 2.919 N/A ASN 284.A N ALA 280.A O no hydrogen 2.888 N/A VAL 285.A N LYS 281.A O no hydrogen 2.938 N/A VAL 286.A N LEU 282.A O no hydrogen 2.928 N/A ARG 287.A N ALA 283.A O no hydrogen 2.896 N/A ARG 287.A NE ASN 284.A OD1 no hydrogen 2.974 N/A LYS 288.A N ASN 284.A O no hydrogen 2.898 N/A MET 289.A N VAL 285.A O no hydrogen 2.919 N/A MET 290.A N VAL 286.A O no hydrogen 2.895 N/A THR 291.A N ARG 287.A O no hydrogen 2.883 N/A THR 291.A OG1 ARG 287.A O no hydrogen 2.915 N/A ASN 292.A N LYS 288.A O no hydrogen 2.910 N/A SER 293.A N MET 289.A O no hydrogen 3.134 N/A SER 293.A OG MET 290.A O no hydrogen 2.609 N/A GLN 294.A N GLU 297.A OE1 no hydrogen 3.301 N/A LEU 298.A N ALA 453.A O no hydrogen 2.893 N/A SER 299.A OG ASN 452.A OD1 no hydrogen 2.928 N/A SER 299.A OG THR 487.A OG1 no hydrogen 3.058 N/A PHE 300.A N VAL 451.A O no hydrogen 2.906 N/A THR 301.A N ASN 485.A O no hydrogen 2.875 N/A THR 301.A OG1 THR 487.A OG1 no hydrogen 2.685 N/A ILE 302.A N LEU 449.A O no hydrogen 2.869 N/A THR 303.A N TYR 483.A O no hydrogen 2.895 N/A THR 303.A OG1 GLU 491.A O no hydrogen 3.150 N/A GLY 304.A N PHE 447.A O no hydrogen 2.962 N/A ASP 305.A N SER 482.A OG no hydrogen 3.301 N/A ASN 306.A N ASP 445.A OD2 no hydrogen 3.364 N/A ASN 306.A ND2 ASP 445.A O no hydrogen 3.019 N/A THR 307.A N ASN 476.A O no hydrogen 3.049 N/A GLU 311.A N LYS 308.A O no hydrogen 3.221 N/A ARG 316.A NH2 SER 404.A OG no hydrogen 3.108 N/A PHE 318.A N ASN 314.A O no hydrogen 3.333 N/A LEU 319.A N PRO 315.A O no hydrogen 2.886 N/A ALA 320.A N ARG 316.A O no hydrogen 2.920 N/A MET 321.A N MET 317.A O no hydrogen 2.897 N/A ILE 322.A N PHE 318.A O no hydrogen 2.883 N/A THR 323.A N LEU 319.A O no hydrogen 2.883 N/A THR 323.A OG1 LEU 319.A O no hydrogen 2.612 N/A TYR 324.A N ALA 320.A O no hydrogen 2.942 N/A ILE 325.A N MET 321.A O no hydrogen 2.892 N/A THR 326.A N ILE 322.A O no hydrogen 2.988 N/A THR 326.A OG1 ILE 322.A O no hydrogen 2.971 N/A THR 326.A OG1 THR 323.A O no hydrogen 3.561 N/A ARG 327.A N TYR 324.A O no hydrogen 3.439 N/A ARG 327.A NE TYR 324.A O no hydrogen 3.236 N/A ARG 334.A N PRO 330.A O no hydrogen 3.147 N/A ARG 334.A NE THR 326.A OG1 no hydrogen 3.149 N/A ARG 334.A NH2 THR 323.A O no hydrogen 2.974 N/A ASN 335.A N GLU 331.A O no hydrogen 2.900 N/A VAL 336.A N TRP 332.A O no hydrogen 2.931 N/A LEU 337.A N PHE 333.A O no hydrogen 2.941 N/A SER 338.A N ARG 334.A O no hydrogen 2.879 N/A SER 338.A OG ASN 335.A O no hydrogen 3.453 N/A MET 343.A N ILE 339.A O no hydrogen 2.920 N/A PHE 344.A N ALA 340.A O no hydrogen 2.926 N/A SER 345.A N PRO 341.A O no hydrogen 2.891 N/A ASN 346.A N MET 343.A O no hydrogen 3.259 N/A ASN 346.A ND2 ILE 342.A O no hydrogen 2.552 N/A LYS 347.A N PHE 344.A O no hydrogen 3.351 N/A LYS 347.A NZ PHE 344.A O no hydrogen 3.006 N/A LYS 347.A NZ LEU 403.A O no hydrogen 2.936 N/A LYS 347.A NZ PRO 405.A O no hydrogen 3.485 N/A LYS 347.A NZ GLY 406.A O no hydrogen 2.740 N/A MET 348.A N LEU 222.A O no hydrogen 3.064 N/A ALA 349.A N ALA 401.A O no hydrogen 2.899 N/A ARG 350.A N LEU 224.A O no hydrogen 2.847 N/A ARG 350.A NH1 ASN 225.A OD1 no hydrogen 2.890 N/A GLY 354.A N THR 34.A OG1 no hydrogen 3.278 N/A GLY 354.A N THR 36.A OG1 no hydrogen 2.980 N/A TYR 355.A N VAL 368.A O no hydrogen 2.937 N/A PHE 357.A N THR 366.A O no hydrogen 2.897 N/A SER 359.A N LEU 364.A O no hydrogen 2.870 N/A MET 362.A N SER 359.A OG no hydrogen 3.403 N/A LYS 363.A N LYS 360.A O no hydrogen 3.046 N/A LEU 364.A N SER 359.A O no hydrogen 2.925 N/A THR 366.A N PHE 357.A O no hydrogen 2.912 N/A VAL 368.A N TYR 355.A O no hydrogen 2.874 N/A GLU 371.A N GLU 371.A OE1 no hydrogen 2.460 N/A MET 372.A N PRO 369.A O no hydrogen 3.224 N/A LEU 373.A N ALA 370.A O no hydrogen 2.911 N/A ASN 375.A N MET 372.A O no hydrogen 2.905 N/A LYS 379.A N ASP 377.A OD1 no hydrogen 3.279 N/A ASN 382.A ND2 SER 384.A OG no hydrogen 2.945 N/A THR 385.A OG1 ASN 382.A OD1 no hydrogen 3.229 N/A ARG 386.A N ASN 382.A O no hydrogen 2.666 N/A ARG 386.A NE LEU 378.A O no hydrogen 3.149 N/A ARG 386.A NE PHE 381.A O no hydrogen 3.266 N/A ARG 386.A NH2 PHE 381.A O no hydrogen 3.265 N/A GLU 387.A N LYS 383.A O no hydrogen 2.918 N/A LYS 388.A N SER 384.A O no hydrogen 2.935 N/A ILE 389.A N THR 385.A O no hydrogen 2.902 N/A GLU 390.A N ARG 386.A O no hydrogen 2.911 N/A LYS 391.A N GLU 387.A O no hydrogen 2.929 N/A ILE 392.A N LYS 388.A O no hydrogen 2.926 N/A ILE 392.A N ILE 389.A O no hydrogen 3.250 N/A ARG 393.A NH1 ALA 374.A O no hydrogen 2.584 N/A LEU 395.A N ILE 392.A O no hydrogen 3.064 N/A LEU 396.A N ARG 393.A O no hydrogen 3.116 N/A ILE 397.A N THR 400.A O no hydrogen 2.783 N/A THR 400.A N ILE 397.A O no hydrogen 2.853 N/A THR 400.A OG1 ILE 397.A O no hydrogen 2.377 N/A ALA 401.A N ALA 349.A O no hydrogen 2.898 N/A SER 402.A N LEU 395.A O no hydrogen 2.976 N/A SER 402.A OG PRO 64.A O no hydrogen 2.350 N/A LEU 403.A N LYS 347.A O no hydrogen 3.350 N/A SER 404.A OG SER 345.A O no hydrogen 2.679 N/A MET 407.A N ASN 310.A O no hydrogen 2.884 N/A SER 416.A N PHE 412.A O no hydrogen 2.977 N/A SER 416.A OG PHE 412.A O no hydrogen 2.821 N/A SER 416.A OG ASN 413.A O no hydrogen 2.583 N/A THR 417.A N ASN 413.A O no hydrogen 2.913 N/A THR 417.A OG1 ASN 413.A O no hydrogen 2.824 N/A VAL 418.A N MET 414.A O no hydrogen 2.876 N/A LEU 419.A N LEU 415.A O no hydrogen 2.961 N/A GLY 420.A N SER 416.A O no hydrogen 2.953 N/A VAL 421.A N THR 417.A O no hydrogen 2.859 N/A SER 422.A N VAL 418.A O no hydrogen 2.900 N/A SER 422.A OG LEU 419.A O no hydrogen 2.622 N/A ILE 423.A N LEU 419.A O no hydrogen 3.004 N/A LEU 424.A N GLY 420.A O no hydrogen 2.919 N/A ASN 425.A N VAL 421.A O no hydrogen 2.839 N/A LEU 426.A N SER 422.A O no hydrogen 2.975 N/A LEU 426.A N ILE 423.A O no hydrogen 3.176 N/A GLY 427.A N LEU 424.A O no hydrogen 3.008 N/A TYR 431.A N GLN 428.A O no hydrogen 2.945 N/A TYR 431.A OH SER 98.A OG no hydrogen 3.255 N/A THR 432.A N GLN 428.A O no hydrogen 3.062 N/A THR 432.A OG1 TYR 436.A O no hydrogen 2.972 N/A LYS 433.A N LYS 429.A O no hydrogen 3.337 N/A LYS 433.A NZ TYR 431.A O no hydrogen 3.374 N/A THR 434.A OG1 THR 432.A O no hydrogen 2.856 N/A TRP 437.A N ASN 452.A O no hydrogen 2.933 N/A TRP 438.A N GLY 427.A O no hydrogen 3.090 N/A ASP 439.A N ILE 450.A O no hydrogen 2.889 N/A LEU 441.A N ALA 448.A O no hydrogen 2.936 N/A GLN 442.A N GLN 268.A O no hydrogen 3.184 N/A GLN 442.A NE2 SER 444.A O no hydrogen 3.354 N/A SER 443.A N ASP 446.A O no hydrogen 2.907 N/A SER 444.A N THR 417.A OG1 no hydrogen 3.025 N/A PHE 447.A N GLY 304.A O no hydrogen 2.932 N/A ALA 448.A N LEU 441.A O no hydrogen 2.931 N/A LEU 449.A N ILE 302.A O no hydrogen 2.965 N/A ILE 450.A N ASP 439.A O no hydrogen 2.884 N/A VAL 451.A N PHE 300.A O no hydrogen 2.880 N/A ASN 452.A N TRP 437.A O no hydrogen 2.882 N/A ASN 452.A ND2 MET 289.A O no hydrogen 3.627 N/A ALA 453.A N LEU 298.A O no hydrogen 2.915 N/A GLY 458.A N ASN 455.A OD1 no hydrogen 3.020 N/A ILE 459.A N ASN 455.A O no hydrogen 3.153 N/A GLN 460.A N HIS 456.A O no hydrogen 2.915 N/A GLN 460.A NE2 GLN 460.A O no hydrogen 2.789 N/A ALA 461.A N GLU 457.A O no hydrogen 2.891 N/A GLY 462.A N GLY 458.A O no hydrogen 2.893 N/A VAL 463.A N ILE 459.A O no hydrogen 2.921 N/A ASP 464.A N GLN 460.A O no hydrogen 2.915 N/A ARG 465.A N ALA 461.A O no hydrogen 2.873 N/A PHE 466.A N GLY 462.A O no hydrogen 2.928 N/A TYR 467.A N VAL 463.A O no hydrogen 2.914 N/A TYR 467.A OH ASN 77.A OD1 no hydrogen 3.053 N/A ARG 468.A N ASP 464.A O no hydrogen 2.894 N/A THR 469.A N ARG 465.A O no hydrogen 2.910 N/A THR 469.A OG1 ARG 465.A O no hydrogen 2.715 N/A CYS 470.A N PHE 466.A O no hydrogen 2.919 N/A CYS 470.A SG PHE 466.A O no hydrogen 3.642 N/A LYS 471.A N TYR 467.A O no hydrogen 2.948 N/A LYS 471.A NZ GLU 78.A O no hydrogen 3.539 N/A LYS 471.A NZ ASN 476.A OD1 no hydrogen 2.644 N/A LEU 472.A N ARG 468.A O no hydrogen 2.877 N/A VAL 473.A N THR 469.A O no hydrogen 2.957 N/A GLY 474.A N CYS 470.A O no hydrogen 2.975 N/A GLY 474.A N LYS 471.A O no hydrogen 3.268 N/A ILE 475.A N CYS 470.A O no hydrogen 2.621 N/A ASN 476.A ND2 SER 80.A O no hydrogen 3.259 N/A SER 478.A N ASP 305.A O no hydrogen 2.903 N/A LYS 481.A NZ ASP 305.A OD1 no hydrogen 3.260 N/A SER 482.A N SER 478.A O no hydrogen 3.138 N/A SER 482.A OG SER 478.A O no hydrogen 2.476 N/A TYR 483.A N THR 303.A O no hydrogen 2.957 N/A ASN 485.A N THR 301.A O no hydrogen 2.929 N/A ASN 485.A ND2 THR 489.A O no hydrogen 3.543 N/A THR 487.A N SER 299.A O no hydrogen 3.376 N/A THR 487.A OG1 SER 299.A OG no hydrogen 3.058 N/A THR 487.A OG1 THR 301.A OG1 no hydrogen 2.685 N/A PHE 490.A N TYR 497.A O no hydrogen 2.911 N/A GLU 491.A N THR 303.A OG1 no hydrogen 3.218 N/A PHE 492.A N PHE 495.A O no hydrogen 2.883 N/A SER 494.A N GLU 491.A OE2 no hydrogen 3.292 N/A PHE 495.A N PHE 492.A O no hydrogen 2.901 N/A TYR 497.A N PHE 490.A O no hydrogen 2.902 N/A ARG 498.A N GLY 500.A O no hydrogen 3.033 N/A ARG 498.A NE GLN 15.A OE1 no hydrogen 3.370 N/A TYR 499.A N GLY 488.A O no hydrogen 2.893 N/A VAL 502.A N PHE 496.A O no hydrogen 3.102 N/A SER 506.A OG SER 19.A O no hydrogen 2.774 N/A SER 506.A OG SER 19.A OG no hydrogen 2.966 N/A GLU 508.A N PHE 505.A O no hydrogen 3.158 N/A LEU 509.A N SER 506.A O no hydrogen 2.911 N/A SER 511.A N GLU 508.A O no hydrogen 3.138 N/A SER 511.A OG GLU 508.A O no hydrogen 2.479 N/A PHE 512.A N LEU 509.A O no hydrogen 2.950 N/A GLY 516.A N ASP 522.A OD2 no hydrogen 2.933 N/A ILE 517.A N ASP 522.A OD1 no hydrogen 3.121 N/A SER 520.A OG ASN 518.A OD1 no hydrogen 3.379 N/A SER 520.A OG HIS 651.A O no hydrogen 3.543 N/A ALA 521.A N ASN 518.A OD1 no hydrogen 2.581 N/A ASP 522.A N ASN 518.A O no hydrogen 2.993 N/A MET 523.A N GLU 519.A O no hydrogen 2.959 N/A SER 524.A N SER 520.A O no hydrogen 2.943 N/A SER 524.A OG SER 520.A O no hydrogen 2.851 N/A VAL 525.A N ALA 521.A O no hydrogen 2.895 N/A GLY 526.A N ASP 522.A O no hydrogen 2.909 N/A VAL 527.A N MET 523.A O no hydrogen 2.994 N/A THR 528.A N SER 524.A O no hydrogen 2.916 N/A THR 528.A OG1 SER 524.A O no hydrogen 2.497 N/A THR 528.A OG1 VAL 525.A O no hydrogen 2.913 N/A VAL 529.A N VAL 525.A O no hydrogen 2.861 N/A ILE 530.A N GLY 526.A O no hydrogen 2.992 N/A LYS 531.A N VAL 527.A O no hydrogen 2.955 N/A ASN 532.A N THR 528.A O no hydrogen 2.861 N/A ASN 533.A N VAL 529.A O no hydrogen 2.931 N/A ASN 533.A ND2 GLU 508.A OE2 no hydrogen 3.135 N/A ASN 533.A ND2 ASN 537.A OD1 no hydrogen 3.034 N/A MET 534.A N ILE 530.A O no hydrogen 2.930 N/A ILE 535.A N LYS 531.A O no hydrogen 2.949 N/A ASN 536.A N ASN 532.A O no hydrogen 2.887 N/A ASN 536.A ND2 ASN 532.A O no hydrogen 3.237 N/A ASN 537.A N ASN 533.A O no hydrogen 3.030 N/A LEU 539.A N ASN 533.A O no hydrogen 3.345 N/A ALA 544.A N GLY 540.A O no hydrogen 2.747 N/A GLN 545.A N PRO 541.A O no hydrogen 2.901 N/A GLN 545.A NE2 ASN 600.A OD1 no hydrogen 3.079 N/A MET 546.A N ALA 542.A O no hydrogen 2.926 N/A ALA 547.A N THR 543.A O no hydrogen 2.864 N/A LEU 548.A N ALA 544.A O no hydrogen 2.879 N/A GLN 549.A N GLN 545.A O no hydrogen 2.930 N/A LEU 550.A N MET 546.A O no hydrogen 2.911 N/A PHE 551.A N ALA 547.A O no hydrogen 2.870 N/A ILE 552.A N LEU 548.A O no hydrogen 2.899 N/A LYS 553.A N GLN 549.A O no hydrogen 2.940 N/A ASP 554.A N LEU 550.A O no hydrogen 2.927 N/A TYR 555.A N PHE 551.A O no hydrogen 2.844 N/A ARG 556.A N ILE 552.A O no hydrogen 2.867 N/A TYR 557.A N LYS 553.A O no hydrogen 2.980 N/A THR 558.A N ASP 554.A O no hydrogen 2.866 N/A THR 558.A OG1 ASP 554.A O no hydrogen 2.692 N/A THR 558.A OG1 ASP 554.A OD1 no hydrogen 2.970 N/A TYR 559.A N TYR 555.A O no hydrogen 2.958 N/A TYR 559.A OH ASP 522.A OD2 no hydrogen 2.235 N/A ARG 560.A N TYR 557.A O no hydrogen 3.401 N/A ARG 560.A NE THR 558.A O no hydrogen 3.495 N/A CYS 561.A N ARG 556.A O no hydrogen 3.099 N/A CYS 561.A SG TYR 555.A O no hydrogen 3.858 N/A CYS 561.A SG ARG 556.A O no hydrogen 3.901 N/A ARG 563.A NE ASP 565.A OD1 no hydrogen 2.823 N/A ARG 563.A NH2 ASP 565.A OD2 no hydrogen 3.016 N/A GLY 564.A N GLY 594.A O no hydrogen 3.061 N/A ARG 572.A NH1 GLU 519.A OE2 no hydrogen 2.965 N/A ARG 572.A NH1 TYR 559.A O no hydrogen 3.308 N/A ARG 572.A NH2 GLU 519.A OE2 no hydrogen 3.123 N/A ALA 573.A N THR 570.A O no hydrogen 2.959 N/A LEU 576.A N ARG 572.A O no hydrogen 3.128 N/A GLY 577.A N ALA 573.A O no hydrogen 2.889 N/A LYS 578.A N PHE 574.A O no hydrogen 2.935 N/A LYS 578.A NZ GLU 581.A OE1 no hydrogen 3.071 N/A LEU 579.A N GLU 575.A O no hydrogen 2.910 N/A TRP 580.A N LEU 576.A O no hydrogen 2.866 N/A GLU 581.A N GLY 577.A O no hydrogen 2.941 N/A GLN 582.A N LYS 578.A O no hydrogen 2.918 N/A THR 583.A N LEU 579.A O no hydrogen 3.071 N/A THR 583.A OG1 LEU 579.A O no hydrogen 3.331 N/A THR 583.A OG1 TRP 580.A O no hydrogen 3.250 N/A ARG 584.A N ASP 617.A OD2 no hydrogen 2.968 N/A ARG 584.A NH2 ASP 619.A OD1 no hydrogen 3.089 N/A SER 585.A OG LEU 615.A O no hydrogen 3.151 N/A LYS 586.A NZ TRP 580.A O no hydrogen 2.937 N/A GLY 588.A N SER 585.A O no hydrogen 3.128 N/A LEU 590.A N TYR 620.A OH no hydrogen 3.397 N/A VAL 591.A N GLU 608.A OE2 no hydrogen 3.255 N/A ASP 593.A N LEU 590.A O no hydrogen 2.964 N/A GLY 594.A N VAL 591.A O no hydrogen 2.989 N/A GLY 595.A N LEU 590.A O no hydrogen 2.770 N/A TYR 599.A OH ILE 606.A O no hydrogen 2.698 N/A ASN 600.A N ASN 603.A OD1 no hydrogen 3.006 N/A ILE 601.A N ASN 600.A OD1 no hydrogen 2.889 N/A ILE 606.A N ASN 603.A O no hydrogen 3.487 N/A LEU 611.A N PRO 607.A O no hydrogen 2.804 N/A LYS 612.A N GLU 608.A O no hydrogen 3.351 N/A LYS 612.A NZ LEU 589.A O no hydrogen 2.918 N/A LYS 612.A NZ PRO 596.A O no hydrogen 3.111 N/A LEU 615.A N LYS 612.A O no hydrogen 3.215 N/A MET 616.A N TRP 613.A O no hydrogen 3.186 N/A TYR 620.A OH ASP 593.A OD2 no hydrogen 2.635 N/A GLN 621.A N ASP 617.A O no hydrogen 2.523 N/A GLY 622.A N GLU 618.A O no hydrogen 2.903 N/A ARG 623.A N ASP 619.A O no hydrogen 2.924 N/A LEU 624.A N TYR 620.A O no hydrogen 2.885 N/A CYS 625.A N GLN 621.A O no hydrogen 3.075 N/A HIS 634.A ND1 VAL 632.A O no hydrogen 3.045 N/A HIS 634.A NE2 PRO 627.A O no hydrogen 3.047 N/A LYS 635.A NZ ASP 638.A OD1 no hydrogen 3.059 N/A ILE 637.A N GLU 636.A OE2 no hydrogen 2.917 N/A ILE 637.A N MET 642.A O no hydrogen 3.247 N/A ASP 638.A N TYR 644.A OH no hydrogen 3.409 N/A SER 639.A OG ASP 638.A O no hydrogen 2.628 N/A SER 639.A OG SER 639.A O no hydrogen 2.437 N/A TYR 644.A N LYS 635.A O no hydrogen 2.850 N/A ALA 646.A N PRO 627.A O no hydrogen 3.090 N/A HIS 651.A ND1 GLU 519.A OE1 no hydrogen 2.581 N/A HIS 651.A NE2 ASP 593.A OD2 no hydrogen 2.663 N/A SER 652.A N THR 649.A O no hydrogen 3.319 N/A SER 652.A OG THR 649.A O no hydrogen 2.543 N/A TRP 653.A NE1 GLU 519.A OE1 no hydrogen 2.998 N/A SER 660.A N ASN 658.A OD1 no hydrogen 2.931 N/A SER 660.A OG ASN 658.A OD1 no hydrogen 3.532 N/A THR 664.A OG1 LEU 662.A O no hydrogen 2.939 N/A SER 665.A N ARG 203.A O no hydrogen 2.751 N/A ILE 669.A N GLN 666.A O no hydrogen 2.888 N/A LEU 670.A N GLN 666.A O no hydrogen 3.236 N/A GLN 674.A N LEU 670.A O no hydrogen 2.940 N/A MET 675.A N GLU 671.A O no hydrogen 2.920 N/A TYR 676.A N ASP 672.A O no hydrogen 2.912 N/A GLN 677.A N GLU 673.A O no hydrogen 2.914 N/A GLN 677.A NE2 GLU 673.A O no hydrogen 3.466 N/A LYS 678.A N GLN 674.A O no hydrogen 2.941 N/A CYS 679.A N MET 675.A O no hydrogen 2.933 N/A CYS 679.A SG MET 675.A O no hydrogen 3.355 N/A CYS 680.A N TYR 676.A O no hydrogen 2.907 N/A CYS 680.A SG TYR 676.A O no hydrogen 3.281 N/A ASN 681.A N GLN 677.A O no hydrogen 2.898 N/A LEU 682.A N LYS 678.A O no hydrogen 2.974 N/A PHE 683.A N CYS 679.A O no hydrogen 2.926 N/A GLU 684.A N CYS 680.A O no hydrogen 2.912 N/A LYS 685.A N ASN 681.A O no hydrogen 2.932 N/A PHE 686.A N LEU 682.A O no hydrogen 2.955 N/A PHE 687.A N PHE 683.A O no hydrogen 2.718 N/A SER 690.A N PHE 687.A O no hydrogen 3.180 N/A ARG 693.A N SER 689.A O no hydrogen 3.321 N/A GLU 703.A N SER 700.A OG no hydrogen 3.148 N/A ALA 704.A N SER 700.A O no hydrogen 3.042 N/A MET 705.A N MET 701.A O no hydrogen 2.926 N/A VAL 706.A N VAL 702.A O no hydrogen 2.871 N/A SER 707.A N GLU 703.A O no hydrogen 2.933 N/A ARG 708.A N ALA 704.A O no hydrogen 2.910 N/A ALA 709.A N MET 705.A O no hydrogen 2.892 N/A ARG 710.A N VAL 706.A O no hydrogen 2.904 N/A ILE 711.A N SER 707.A O no hydrogen 2.967 N/A ASP 712.A N ARG 708.A O no hydrogen 2.855 N/A ALA 713.A N ALA 709.A O no hydrogen 2.899 N/A ARG 714.A N ARG 710.A O no hydrogen 2.947 N/A ILE 715.A N ILE 711.A O no hydrogen 2.896 N/A ASP 716.A N ASP 712.A O no hydrogen 2.872 N/A PHE 717.A N ALA 713.A O no hydrogen 2.916 N/A GLU 718.A N ARG 714.A O no hydrogen 2.917 N/A SER 719.A N ILE 715.A O no hydrogen 2.888 N/A GLY 720.A N ASP 716.A O no hydrogen 2.807 N/A ARG 721.A N ASP 716.A O no hydrogen 3.049 N/A ARG 721.A NE ASP 716.A OD1 no hydrogen 2.714 N/A ARG 721.A NH2 ASP 716.A OD1 no hydrogen 2.861 N/A LYS 723.A N GLU 726.A OE2 no hydrogen 2.505 N/A PHE 727.A N LYS 723.A O no hydrogen 3.318 N/A ALA 728.A N LYS 724.A O no hydrogen 2.919 N/A GLU 729.A N GLU 725.A O no hydrogen 2.906 N/A ILE 730.A N GLU 726.A O no hydrogen 2.908 N/A MET 731.A N PHE 727.A O no hydrogen 2.915 N/A LYS 732.A N ALA 728.A O no hydrogen 2.896 N/A ILE 733.A N GLU 729.A O no hydrogen 2.925 N/A CYS 734.A N ILE 730.A O no hydrogen 2.907 N/A CYS 734.A SG VAL 706.A O no hydrogen 4.042 N/A CYS 734.A SG ILE 730.A O no hydrogen 3.598 N/A SER 735.A N MET 731.A O no hydrogen 2.901 N/A SER 735.A OG MET 731.A O no hydrogen 2.833 N/A SER 735.A OG LYS 732.A O no hydrogen 2.545 N/A THR 736.A N LYS 732.A O no hydrogen 2.940 N/A ILE 737.A N ILE 733.A O no hydrogen 2.915 N/A GLU 738.A N CYS 734.A O no hydrogen 2.912 N/A GLU 739.A N SER 735.A O no hydrogen 2.907 N/A LEU 740.A N THR 736.A O no hydrogen 2.888 N/A ARG 741.A N ILE 737.A O no hydrogen 2.896 N/A ARG 742.A N GLU 738.A O no hydrogen 2.912 N/A GLN 743.A N GLU 739.A O no hydrogen 2.949 N/A