Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ywb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N PRO 1.A O no hydrogen 2.239 N/A ASP 8.A N ASN 5.A O no hydrogen 3.403 N/A PHE 9.A N GLU 30.A OE2 no hydrogen 3.097 N/A SER 10.A N ASP 8.A OD1 no hydrogen 2.916 N/A SER 10.A OG ASP 8.A OD1 no hydrogen 2.605 N/A LYS 12.A N PHE 9.A O no hydrogen 2.952 N/A LYS 12.A NZ.A GLU 39.A O no hydrogen 3.346 N/A LYS 12.A NZ.B PRO 38.A O no hydrogen 2.724 N/A VAL 13.A N SER 10.A O no hydrogen 3.248 N/A ILE 14.A N ILE 41.A O no hydrogen 2.852 N/A GLN 15.A NE2 ILE 43.A O no hydrogen 3.009 N/A GLN 15.A NE2 GLU 50.A OE2 no hydrogen 2.788 N/A SER 20.A N SER 17.A O no hydrogen 3.151 N/A SER 20.A OG SER 17.A O no hydrogen 3.017 N/A LEU 21.A N LEU 18.A O no hydrogen 3.191 N/A ARG 26.A N PRO 22.A O no hydrogen 2.891 N/A ARG 26.A NE GLU 30.A OE1 no hydrogen 2.961 N/A ARG 26.A NH1 ASP 19.A OD1 no hydrogen 2.861 N/A ARG 26.A NH2 GLU 30.A OE2 no hydrogen 3.022 N/A LYS 27.A N GLN 23.A O no hydrogen 3.076 N/A LYS 27.A NZ GLU 24.A OE2 no hydrogen 2.922 N/A PHE 28.A N GLU 24.A O no hydrogen 3.106 N/A VAL 29.A N VAL 25.A O no hydrogen 2.895 N/A GLU 30.A N ARG 26.A O no hydrogen 2.838 N/A GLY 31.A N LYS 27.A O no hydrogen 2.931 N/A ASN 32.A N PHE 28.A O no hydrogen 3.208 N/A ASN 32.A ND2 PHE 28.A O no hydrogen 3.041 N/A ALA 33.A N VAL 29.A O no hydrogen 2.790 N/A GLN 34.A N GLU 30.A O no hydrogen 2.987 N/A LEU 35.A N GLY 31.A O no hydrogen 3.072 N/A CYS 36.A N ASN 32.A O no hydrogen 2.765 N/A CYS 36.A SG PHE 128.A O no hydrogen 3.974 N/A GLN 37.A N ALA 33.A O no hydrogen 2.841 N/A GLN 37.A NE2.A GLN 34.A O no hydrogen 2.725 N/A GLN 37.A NE2.A GLN 34.A OE1.B no hydrogen 3.385 N/A GLU 39.A N ARG 135.A O no hydrogen 2.753 N/A ILE 41.A N LYS 12.A O no hydrogen 2.868 N/A HIS 42.A N MET 137.A O no hydrogen 2.896 N/A HIS 42.A NE2 GLU 50.A OE2 no hydrogen 2.855 N/A ILE 43.A N GLN 15.A O no hydrogen 2.927 N/A CYS 44.A N VAL 139.A O no hydrogen 2.895 N/A ASP 45.A N GLU 50.A OE2 no hydrogen 2.906 N/A GLY 46.A N GLU 50.A OE1 no hydrogen 2.891 N/A SER 47.A N ASP 45.A OD1 no hydrogen 2.889 N/A SER 47.A OG ASP 45.A OD1 no hydrogen 2.723 N/A SER 47.A OG ASP 45.A OD2 no hydrogen 3.407 N/A GLU 50.A N SER 47.A OG no hydrogen 3.116 N/A TYR 51.A N SER 47.A O no hydrogen 3.065 N/A GLY 52.A N GLU 48.A O no hydrogen 2.751 N/A ARG 53.A N GLU 49.A O no hydrogen 3.028 N/A LEU 54.A N GLU 50.A O no hydrogen 3.035 N/A LEU 55.A N TYR 51.A O no hydrogen 3.007 N/A ALA 56.A N GLY 52.A O no hydrogen 3.039 N/A HIS 57.A N ARG 53.A O no hydrogen 2.980 N/A MET 58.A N LEU 54.A O no hydrogen 2.965 N/A GLN 59.A N LEU 55.A O no hydrogen 2.980 N/A GLU 60.A N ALA 56.A O no hydrogen 2.976 N/A GLU 61.A N HIS 57.A O no hydrogen 3.101 N/A GLU 61.A N MET 58.A O no hydrogen 3.170 N/A GLY 62.A N GLN 59.A O no hydrogen 3.109 N/A VAL 63.A N MET 58.A O no hydrogen 2.831 N/A ARG 65.A N LEU 75.A O no hydrogen 2.814 N/A ARG 65.A NE GLU 360.A OE1 no hydrogen 2.946 N/A ARG 65.A NH2 GLU 360.A OE1 no hydrogen 3.423 N/A ARG 65.A NH2 GLU 360.A OE2 no hydrogen 2.862 N/A LEU 67.A N CYS 73.A O no hydrogen 2.944 N/A LYS 69.A N GLY 364.A O no hydrogen 3.042 N/A TYR 70.A N LEU 67.A O no hydrogen 3.405 N/A ASN 72.A ND2 ASN 352.A OD1 no hydrogen 2.999 N/A CYS 73.A SG ASP 71.A O no hydrogen 3.634 N/A CYS 73.A SG ILE 349.A O no hydrogen 3.915 N/A TRP 74.A N THR 353.A O no hydrogen 3.054 N/A TRP 74.A NE1 ASN 72.A OD1 no hydrogen 2.894 N/A LEU 75.A N ARG 65.A O no hydrogen 2.855 N/A ALA 76.A N PHE 355.A O no hydrogen 2.873 N/A THR 78.A N ASN 357.A OD1 no hydrogen 2.813 N/A THR 78.A OG1 ASP 79.A O no hydrogen 2.875 N/A THR 78.A OG1 ASP 82.A O no hydrogen 2.945 N/A ARG 81.A N ASP 79.A OD1 no hydrogen 3.017 N/A ARG 81.A NE ASP 79.A OD1 no hydrogen 3.092 N/A ARG 81.A NE ASP 79.A OD2 no hydrogen 3.282 N/A ARG 81.A NH2 ASP 79.A OD2 no hydrogen 2.869 N/A ASP 82.A N ASP 79.A O no hydrogen 2.900 N/A ARG 85.A NH1 GLU 87.A OE2.B no hydrogen 2.856 N/A LYS 89.A N ILE 86.A O no hydrogen 3.013 N/A THR 90.A N GLU 87.A O no hydrogen 3.091 N/A THR 90.A OG1 ILE 86.A O no hydrogen 2.802 N/A VAL 91.A N ILE 217.A O no hydrogen 2.904 N/A ILE 92.A N ARG 113.A O no hydrogen 2.919 N/A ILE 93.A N HIS 219.A O no hydrogen 2.804 N/A THR 94.A OG1 GLU 96.A O no hydrogen 2.810 N/A THR 94.A OG1 THR 100.A OG1 no hydrogen 2.793 N/A GLN 95.A NE2 GLU 96.A OE2 no hydrogen 3.018 N/A ARG 98.A NE.A ASP 593.A OD1 no hydrogen 3.028 N/A ARG 98.A NE.A ASP 593.A OD2 no hydrogen 3.208 N/A ARG 98.A NH1.B GLU 96.A OE1 no hydrogen 3.268 N/A ARG 98.A NH2.A ASP 593.A OD1 no hydrogen 2.516 N/A ASP 99.A N GLU 96.A O no hydrogen 3.102 N/A THR 100.A N GLN 97.A O no hydrogen 2.927 N/A THR 100.A OG1 THR 94.A OG1 no hydrogen 2.793 N/A VAL 101.A N GLN 97.A O no hydrogen 3.021 N/A LYS 105.A N ASP 588.A O no hydrogen 2.864 N/A SER 106.A N ASP 588.A OD1 no hydrogen 2.938 N/A SER 106.A OG ASP 588.A OD1 no hydrogen 3.240 N/A GLY 107.A N ASP 588.A OD1 no hydrogen 3.048 N/A GLN 110.A N GLN 589.A OE1 no hydrogen 2.759 N/A LEU 111.A N SER 109.A OG no hydrogen 2.993 N/A ARG 113.A NH1.A THR 90.A O no hydrogen 3.380 N/A TRP 114.A NE1 THR 94.A O no hydrogen 2.939 N/A MET 115.A N ILE 92.A O no hydrogen 3.086 N/A ASP 119.A N SER 116.A OG no hydrogen 3.048 N/A PHE 120.A N SER 116.A O no hydrogen 2.936 N/A GLU 121.A N GLU 117.A O no hydrogen 2.851 N/A LYS 122.A N GLU 118.A O no hydrogen 3.204 N/A ALA 123.A N ASP 119.A O no hydrogen 3.053 N/A PHE 124.A N PHE 120.A O no hydrogen 2.796 N/A ASN 125.A N GLU 121.A O no hydrogen 2.967 N/A ALA 126.A N LYS 122.A O no hydrogen 3.085 N/A ALA 126.A N ALA 123.A O no hydrogen 3.228 N/A ARG 127.A N PHE 124.A O no hydrogen 3.054 N/A ARG 127.A NE LEU 214.A O no hydrogen 2.740 N/A ARG 127.A NH1 ALA 123.A O no hydrogen 2.974 N/A ARG 127.A NH2 LEU 214.A O no hydrogen 3.451 N/A PHE 128.A N PHE 124.A O no hydrogen 3.038 N/A GLY 130.A N LEU 35.A O no hydrogen 2.959 N/A CYS 131.A N PHE 128.A O no hydrogen 2.958 N/A CYS 131.A SG PHE 128.A O no hydrogen 3.232 N/A CYS 131.A SG SER 193.A OG no hydrogen 3.390 N/A MET 132.A N CYS 36.A O no hydrogen 2.858 N/A LYS 133.A N GLY 130.A O no hydrogen 3.216 N/A ARG 135.A N MET 132.A O no hydrogen 2.869 N/A ARG 135.A NE CYS 196.A O no hydrogen 2.987 N/A ARG 135.A NH2 CYS 196.A O no hydrogen 2.786 N/A MET 137.A N TYR 40.A O no hydrogen 2.890 N/A TYR 138.A N THR 159.A O no hydrogen 2.729 N/A VAL 139.A N HIS 42.A O no hydrogen 2.857 N/A ILE 140.A N GLU 157.A O no hydrogen 2.829 N/A PHE 142.A N GLY 155.A O no hydrogen 2.908 N/A SER 143.A N ARG 173.A O no hydrogen 2.837 N/A SER 143.A OG GLY 145.A O no hydrogen 2.877 N/A MET 144.A N LYS 153.A O no hydrogen 2.827 N/A SER 149.A N PRO 146.A O no hydrogen 2.942 N/A SER 149.A OG PRO 418.A O no hydrogen 2.606 N/A LEU 151.A N SER 149.A OG no hydrogen 3.042 N/A ALA 152.A N SER 149.A O no hydrogen 3.014 N/A LYS 153.A N MET 144.A O no hydrogen 2.961 N/A LYS 153.A NZ GLU 256.A OE1 no hydrogen 2.885 N/A GLY 155.A N PHE 142.A O no hydrogen 2.882 N/A ILE 156.A N ILE 188.A O no hydrogen 2.978 N/A GLU 157.A N ILE 140.A O no hydrogen 2.850 N/A LEU 158.A N CYS 190.A O no hydrogen 2.879 N/A THR 159.A N TYR 138.A O no hydrogen 3.089 N/A THR 159.A OG1 HIS 192.A ND1 no hydrogen 2.781 N/A SER 161.A N THR 159.A OG1 no hydrogen 3.024 N/A TYR 163.A OH THR 356.A OG1 no hydrogen 2.645 N/A VAL 164.A N SER 161.A OG no hydrogen 3.130 N/A VAL 165.A N SER 161.A O no hydrogen 3.056 N/A ALA 166.A N PRO 162.A O no hydrogen 2.934 N/A SER 167.A N TYR 163.A O no hydrogen 3.027 N/A SER 167.A OG TYR 163.A O no hydrogen 2.917 N/A MET 168.A N VAL 164.A O no hydrogen 2.788 N/A ARG 169.A N VAL 165.A O no hydrogen 3.012 N/A ARG 169.A NE GLY 46.A O no hydrogen 3.084 N/A ARG 169.A NH1 GLU 48.A OE2 no hydrogen 3.367 N/A ARG 169.A NH2 GLY 46.A O no hydrogen 2.995 N/A MET 171.A N SER 167.A O no hydrogen 2.856 N/A THR 172.A N MET 168.A O no hydrogen 3.001 N/A THR 172.A OG1 MET 168.A O no hydrogen 2.696 N/A ARG 173.A N SER 143.A O no hydrogen 3.319 N/A ARG 173.A NH1 GLU 327.A O no hydrogen 3.030 N/A ARG 173.A NH2 GLU 416.A OE2 no hydrogen 2.829 N/A GLY 175.A N PRO 141.A O no hydrogen 2.939 N/A THR 176.A N ASP 45.A O no hydrogen 3.034 N/A VAL 178.A N GLY 175.A O no hydrogen 2.999 N/A LEU 179.A N GLY 175.A O no hydrogen 3.425 N/A GLU 180.A N THR 176.A O no hydrogen 2.958 N/A ALA 181.A N SER 177.A O no hydrogen 2.857 N/A LEU 182.A N VAL 178.A O no hydrogen 2.847 N/A GLY 183.A N LEU 179.A O no hydrogen 3.250 N/A GLY 185.A N LEU 182.A O no hydrogen 2.943 N/A ILE 188.A N ILE 154.A O no hydrogen 2.957 N/A LYS 189.A N ARG 224.A O no hydrogen 3.010 N/A CYS 190.A N ILE 156.A O no hydrogen 2.938 N/A CYS 190.A SG ILE 188.A O no hydrogen 3.811 N/A LEU 191.A N ILE 226.A O no hydrogen 2.846 N/A HIS 192.A N LEU 158.A O no hydrogen 2.812 N/A HIS 192.A ND1 THR 159.A OG1 no hydrogen 2.781 N/A HIS 192.A NE2 SER 231.A O no hydrogen 2.734 N/A SER 193.A N SER 228.A O no hydrogen 3.044 N/A SER 193.A OG ASP 160.A OD2 no hydrogen 2.730 N/A VAL 194.A N ASP 160.A OD1 no hydrogen 2.944 N/A GLY 195.A N SER 193.A OG no hydrogen 2.910 N/A CYS 196.A SG VAL 194.A O no hydrogen 3.783 N/A CYS 196.A SG CYS 210.A O no hydrogen 2.980 N/A LEU 198.A N LYS 133.A O no hydrogen 2.948 N/A LYS 201.A NZ PRO 199.A O no hydrogen 3.543 N/A ASN 206.A ND2 THR 78.A O no hydrogen 3.010 N/A TRP 208.A N VAL 205.A O no hydrogen 3.004 N/A TRP 208.A NE1 ASP 82.A OD2 no hydrogen 2.809 N/A CYS 210.A SG ASP 79.A OD2 no hydrogen 3.389 N/A CYS 210.A SG TRP 208.A O no hydrogen 3.784 N/A ASN 211.A N GLY 230.A O no hydrogen 2.720 N/A ASN 211.A ND2 GLY 195.A O no hydrogen 2.950 N/A GLU 213.A N GLU 213.A OE1 no hydrogen 2.673 N/A LEU 214.A N ASN 211.A O no hydrogen 3.221 N/A THR 215.A N PRO 212.A O no hydrogen 3.172 N/A THR 215.A OG1 ASN 211.A O no hydrogen 2.893 N/A THR 215.A OG1 PRO 212.A O no hydrogen 3.392 N/A LEU 216.A N PHE 229.A O no hydrogen 2.916 N/A ILE 217.A N LYS 89.A O no hydrogen 2.836 N/A ALA 218.A N ILE 227.A O no hydrogen 2.787 N/A HIS 219.A N VAL 91.A O no hydrogen 2.980 N/A HIS 219.A ND1 VAL 91.A O no hydrogen 2.834 N/A LEU 220.A N GLU 225.A O no hydrogen 2.738 N/A ARG 223.A N LEU 220.A O no hydrogen 3.050 N/A ARG 223.A NH1 GLU 121.A OE2 no hydrogen 2.927 N/A ARG 223.A NH2 GLU 117.A OE2 no hydrogen 2.668 N/A ARG 224.A N PRO 221.A O no hydrogen 3.058 N/A ARG 224.A NH1 PRO 221.A O no hydrogen 3.092 N/A ARG 224.A NH1 GLU 255.A OE2 no hydrogen 2.958 N/A ARG 224.A NH2 GLU 255.A OE1 no hydrogen 2.970 N/A GLU 225.A N LEU 220.A O no hydrogen 3.164 N/A ILE 226.A N LYS 189.A O no hydrogen 2.838 N/A ILE 227.A N ALA 218.A O no hydrogen 2.926 N/A SER 228.A N LEU 191.A O no hydrogen 2.818 N/A SER 228.A OG ASN 236.A O no hydrogen 2.553 N/A PHE 229.A N LEU 216.A O no hydrogen 2.869 N/A GLY 230.A N SER 193.A O no hydrogen 2.767 N/A SER 231.A OG ASP 82.A OD1 no hydrogen 2.575 N/A SER 231.A OG ASP 82.A OD2 no hydrogen 3.550 N/A GLY 232.A N ASP 82.A OD2 no hydrogen 2.787 N/A TYR 233.A N SER 231.A OG no hydrogen 3.091 N/A TYR 233.A OH ASN 398.A O no hydrogen 2.752 N/A ASN 236.A N TYR 233.A O no hydrogen 2.867 N/A ASN 236.A ND2 ALA 84.A O no hydrogen 3.042 N/A ASN 236.A ND2 SER 231.A OG no hydrogen 2.894 N/A SER 237.A N GLY 234.A O no hydrogen 3.062 N/A SER 237.A OG GLY 232.A O no hydrogen 2.892 N/A SER 237.A OG GLY 234.A O no hydrogen 3.502 N/A LEU 238.A N GLY 234.A O no hydrogen 2.800 N/A LEU 239.A N GLU 157.A OE1 no hydrogen 3.117 N/A LYS 241.A N LEU 238.A O no hydrogen 3.352 N/A LYS 241.A NZ ASP 309.A OD2 no hydrogen 2.714 N/A LYS 241.A NZ GLU 327.A OE1 no hydrogen 2.940 N/A LYS 241.A NZ GLU 327.A OE2 no hydrogen 2.889 N/A LYS 242.A NZ ASP 309.A OD1 no hydrogen 3.042 N/A LYS 242.A NZ ASP 309.A OD2 no hydrogen 2.939 N/A CYS 243.A SG HIS 219.A NE2 no hydrogen 3.405 N/A CYS 243.A SG GLY 235.A O no hydrogen 3.711 N/A PHE 244.A N LEU 239.A O no hydrogen 3.033 N/A ALA 245.A N GLY 240.A O no hydrogen 2.871 N/A LEU 246.A N LYS 242.A O no hydrogen 3.143 N/A ARG 247.A N LYS 242.A O no hydrogen 2.918 N/A ARG 247.A NE PRO 474.A O no hydrogen 3.105 N/A ARG 247.A NH1 HIS 219.A NE2 no hydrogen 3.078 N/A ARG 247.A NH2 PRO 474.A O no hydrogen 2.924 N/A ILE 248.A N CYS 243.A O no hydrogen 2.889 N/A ALA 249.A N PHE 244.A O no hydrogen 2.767 N/A SER 250.A N LEU 246.A O no hydrogen 2.847 N/A SER 250.A OG LEU 246.A O no hydrogen 2.810 N/A SER 250.A OG ARG 247.A O no hydrogen 3.080 N/A ARG 251.A NE GLU 255.A OE2 no hydrogen 2.944 N/A ARG 251.A NH1 ASP 222.A OD1 no hydrogen 3.218 N/A ARG 251.A NH1 ASP 222.A OD2 no hydrogen 3.493 N/A ARG 251.A NH2 ASP 222.A OD1 no hydrogen 2.870 N/A ARG 251.A NH2 GLU 255.A OE2 no hydrogen 2.969 N/A LEU 252.A N ILE 248.A O no hydrogen 2.971 N/A ALA 253.A N ALA 249.A O no hydrogen 2.782 N/A LYS 254.A N SER 250.A O no hydrogen 3.042 N/A GLU 255.A N ARG 251.A O no hydrogen 3.054 N/A GLU 256.A N LEU 252.A O no hydrogen 2.849 N/A GLU 256.A N ALA 253.A O no hydrogen 3.259 N/A GLY 257.A N ALA 253.A O no hydrogen 2.800 N/A TRP 258.A N ALA 253.A O no hydrogen 2.940 N/A TRP 258.A NE1 GLU 256.A OE1 no hydrogen 2.899 N/A LEU 259.A N MET 313.A O no hydrogen 2.822 N/A GLU 261.A N ALA 311.A O no hydrogen 2.819 N/A HIS 262.A ND1 ALA 471.A O no hydrogen 2.776 N/A LEU 264.A N ALA 280.A O no hydrogen 2.986 N/A ILE 265.A N GLY 307.A O no hydrogen 2.900 N/A LEU 266.A N LEU 278.A O no hydrogen 2.918 N/A GLY 267.A N GLU 304.A O no hydrogen 2.800 N/A ILE 268.A N LYS 276.A O no hydrogen 2.721 N/A THR 269.A N LYS 302.A O no hydrogen 2.836 N/A ASN 270.A N LYS 274.A O no hydrogen 2.900 N/A GLU 272.A N ASN 270.A OD1 no hydrogen 2.965 N/A GLY 273.A N ASN 270.A O no hydrogen 2.921 N/A LYS 274.A N ASN 270.A OD1 no hydrogen 2.946 N/A LYS 274.A NZ GLU 535.A OE1 no hydrogen 3.142 N/A LYS 275.A NZ TYR 277.A OH no hydrogen 3.040 N/A LYS 275.A NZ GLU 304.A OE1 no hydrogen 3.328 N/A LYS 275.A NZ ASP 412.A OD1 no hydrogen 2.648 N/A LYS 275.A NZ ASP 412.A OD2 no hydrogen 3.500 N/A LYS 276.A N ILE 268.A O no hydrogen 2.857 N/A LYS 276.A NZ GLU 424.A OE1 no hydrogen 2.900 N/A LYS 276.A NZ GLU 535.A OE2 no hydrogen 2.823 N/A TYR 277.A OH ASP 412.A OD1 no hydrogen 3.358 N/A TYR 277.A OH ASP 412.A OD2 no hydrogen 2.591 N/A LEU 278.A N LEU 266.A O no hydrogen 2.999 N/A ALA 279.A N GLY 425.A O no hydrogen 3.053 N/A ALA 280.A N LEU 264.A O no hydrogen 3.017 N/A ALA 281.A N ILE 427.A O no hydrogen 2.770 N/A CYS 286.A N PRO 283.A O no hydrogen 2.845 N/A LYS 288.A NZ HIS 262.A O no hydrogen 3.399 N/A LYS 288.A NZ ASP 309.A O no hydrogen 3.119 N/A LYS 288.A NZ ASP 309.A OD1 no hydrogen 3.313 N/A THR 289.A OG1 ASP 308.A OD2 no hydrogen 2.667 N/A LEU 291.A N GLY 287.A O no hydrogen 3.127 N/A ALA 292.A N LYS 288.A O no hydrogen 2.880 N/A MET 293.A N THR 289.A O no hydrogen 3.084 N/A MET 294.A N LEU 291.A O no hydrogen 3.269 N/A THR 297.A N GLY 521.A O no hydrogen 3.239 N/A THR 297.A OG1 GLY 521.A O no hydrogen 3.289 N/A THR 297.A OG1 GLU 522.A OE1 no hydrogen 2.521 N/A TRP 301.A N LEU 298.A O no hydrogen 3.324 N/A LYS 302.A N THR 269.A O no hydrogen 2.889 N/A GLU 304.A N GLY 267.A O no hydrogen 2.838 N/A CYS 305.A N ILE 410.A O no hydrogen 2.844 N/A VAL 306.A N ILE 265.A O no hydrogen 2.852 N/A GLY 307.A N ILE 265.A O no hydrogen 3.105 N/A ALA 311.A N GLU 261.A O no hydrogen 2.923 N/A TRP 312.A N ILE 324.A O no hydrogen 2.941 N/A TRP 312.A NE1 ALA 245.A O no hydrogen 2.920 N/A MET 313.A N LEU 259.A O no hydrogen 2.819 N/A LYS 314.A N ARG 322.A O no hydrogen 2.813 N/A ASP 316.A N ASN 320.A O no hydrogen 2.907 N/A GLN 318.A N ASP 316.A OD1 no hydrogen 2.988 N/A GLY 319.A N ASP 316.A O no hydrogen 2.898 N/A ASN 320.A N ASP 316.A OD1 no hydrogen 2.972 N/A ARG 322.A N LYS 314.A O no hydrogen 2.904 N/A ARG 322.A NE ASP 316.A OD2 no hydrogen 2.978 N/A ARG 322.A NH1 GLY 420.A O no hydrogen 3.025 N/A ALA 323.A N VAL 421.A O no hydrogen 2.799 N/A ILE 324.A N TRP 312.A O no hydrogen 2.956 N/A ASN 325.A ND2 VAL 306.A O no hydrogen 2.979 N/A GLU 327.A N ASN 325.A OD1 no hydrogen 2.904 N/A ASN 328.A N MET 171.A O no hydrogen 2.917 N/A ASN 328.A ND2 THR 172.A O no hydrogen 2.981 N/A PHE 330.A N THR 403.A O no hydrogen 2.865 N/A GLY 332.A N PHE 401.A O no hydrogen 2.914 N/A ALA 334.A N SER 399.A O no hydrogen 2.847 N/A GLY 336.A N GLU 369.A O no hydrogen 2.805 N/A THR 337.A N ALA 334.A O no hydrogen 2.946 N/A THR 337.A OG1 VAL 333.A O no hydrogen 3.244 N/A THR 337.A OG1 ALA 334.A O no hydrogen 2.776 N/A SER 338.A N THR 341.A OG1 no hydrogen 2.959 N/A THR 341.A N SER 338.A OG no hydrogen 2.988 N/A THR 341.A OG1 GLY 336.A O no hydrogen 2.753 N/A ASN 342.A N SER 338.A O no hydrogen 2.799 N/A ASN 342.A ND2 ASN 290.A OD1 no hydrogen 3.027 N/A ASN 344.A ND2 MET 293.A O no hydrogen 2.910 N/A ALA 345.A N ASN 342.A OD1 no hydrogen 3.034 N/A ILE 346.A N ASN 342.A O no hydrogen 3.188 N/A LYS 347.A N PRO 343.A O no hydrogen 3.041 N/A THR 348.A N ASN 344.A O no hydrogen 2.997 N/A THR 348.A OG1 ASN 344.A O no hydrogen 2.751 N/A ILE 349.A N ALA 345.A O no hydrogen 3.202 N/A GLN 350.A N LYS 347.A O no hydrogen 3.360 N/A GLN 350.A NE2 ILE 346.A O no hydrogen 3.515 N/A ASN 352.A N ASP 71.A O no hydrogen 2.958 N/A ASN 352.A ND2 GLN 407.A OE1 no hydrogen 2.905 N/A THR 353.A OG1 LYS 351.A O no hydrogen 2.659 N/A THR 353.A OG1 THR 403.A OG1 no hydrogen 2.824 N/A ILE 354.A N CYS 402.A O no hydrogen 3.082 N/A PHE 355.A N TRP 74.A O no hydrogen 2.806 N/A THR 356.A N ARG 400.A O no hydrogen 2.967 N/A THR 356.A OG1 TYR 163.A OH no hydrogen 2.645 N/A ASN 357.A N ALA 76.A O no hydrogen 2.837 N/A ASN 357.A ND2 THR 78.A OG1 no hydrogen 2.954 N/A ALA 359.A N TYR 367.A O no hydrogen 2.966 N/A GLU 360.A N THR 382.A O no hydrogen 2.867 N/A THR 361.A N GLY 365.A O no hydrogen 2.927 N/A THR 361.A OG1 ASP 363.A OD1 no hydrogen 2.331 N/A SER 362.A N THR 380.A O no hydrogen 2.985 N/A SER 362.A OG THR 380.A OG1 no hydrogen 3.276 N/A GLY 364.A N THR 361.A O no hydrogen 2.826 N/A GLY 365.A N THR 361.A OG1 no hydrogen 2.836 N/A VAL 366.A N TYR 70.A OH no hydrogen 2.924 N/A TYR 367.A N ALA 359.A O no hydrogen 2.885 N/A TYR 367.A OH GLU 373.A O no hydrogen 2.704 N/A TRP 368.A NE1 THR 337.A O no hydrogen 2.797 N/A GLU 369.A N GLU 369.A OE2 no hydrogen 2.739 N/A ILE 371.A N TRP 368.A O no hydrogen 3.110 N/A VAL 379.A N ALA 376.A O no hydrogen 2.999 N/A THR 380.A N SER 362.A OG no hydrogen 3.041 N/A THR 382.A N GLU 360.A O no hydrogen 2.797 N/A THR 382.A OG1 GLU 388.A OE2 no hydrogen 2.921 N/A SER 383.A N LYS 387.A O no hydrogen 2.748 N/A SER 383.A OG LYS 387.A O no hydrogen 3.515 N/A TRP 384.A N CYS 394.A O no hydrogen 2.719 N/A LYS 385.A N SER 383.A OG no hydrogen 2.937 N/A ASN 386.A N SER 383.A O no hydrogen 2.876 N/A TRP 389.A N ILE 381.A O no hydrogen 2.793 N/A TRP 389.A NE1 GLU 392.A O no hydrogen 2.863 N/A CYS 394.A N GLU 369.A OE1 no hydrogen 2.777 N/A CYS 394.A SG GLU 369.A OE1 no hydrogen 3.649 N/A CYS 394.A SG GLU 369.A OE2 no hydrogen 3.623 N/A ALA 395.A N GLU 369.A OE2 no hydrogen 3.164 N/A HIS 396.A N ASN 357.A O no hydrogen 3.032 N/A ASN 398.A N HIS 396.A ND1 no hydrogen 2.943 N/A ASN 398.A ND2 VAL 83.A O no hydrogen 2.941 N/A SER 399.A N HIS 396.A O no hydrogen 2.853 N/A SER 399.A OG HIS 396.A O no hydrogen 2.703 N/A ARG 400.A N THR 356.A O no hydrogen 3.011 N/A ARG 400.A NE ASN 398.A O no hydrogen 3.430 N/A ARG 400.A NE ASN 398.A OD1 no hydrogen 3.351 N/A ARG 400.A NH1 PHE 331.A O no hydrogen 2.795 N/A ARG 400.A NH2 ASN 398.A OD1 no hydrogen 2.834 N/A PHE 401.A N GLY 332.A O no hydrogen 2.917 N/A CYS 402.A N ILE 354.A O no hydrogen 2.787 N/A CYS 402.A SG SER 167.A O no hydrogen 3.983 N/A THR 403.A N PHE 330.A O no hydrogen 2.988 N/A THR 403.A OG1 THR 348.A O no hydrogen 3.315 N/A THR 403.A OG1 THR 353.A OG1 no hydrogen 2.824 N/A ALA 405.A N ASN 328.A O no hydrogen 3.056 N/A GLN 407.A N PRO 404.A O no hydrogen 3.235 N/A GLN 407.A NE2 THR 348.A O no hydrogen 3.045 N/A GLN 407.A NE2 LYS 351.A O no hydrogen 2.892 N/A CYS 408.A N ALA 405.A O no hydrogen 2.958 N/A ILE 411.A N CYS 408.A O no hydrogen 3.035 N/A ASP 412.A N CYS 305.A O no hydrogen 2.795 N/A ALA 414.A N ASP 412.A OD2 no hydrogen 2.820 N/A TRP 415.A N ASP 412.A O no hydrogen 2.987 N/A SER 417.A N ALA 414.A O no hydrogen 3.001 N/A SER 417.A OG.A ALA 414.A O no hydrogen 3.383 N/A SER 417.A OG.B GLU 419.A OE1 no hydrogen 2.372 N/A GLU 419.A N GLU 419.A OE1 no hydrogen 2.746 N/A GLY 420.A N SER 417.A O no hydrogen 3.113 N/A VAL 421.A N ALA 323.A O no hydrogen 2.788 N/A ILE 423.A N LEU 321.A O no hydrogen 2.776 N/A GLU 424.A N TYR 277.A O no hydrogen 2.920 N/A ILE 426.A N LYS 500.A O no hydrogen 2.863 N/A ILE 427.A N ALA 279.A O no hydrogen 2.808 N/A PHE 428.A N PHE 502.A O no hydrogen 2.873 N/A GLY 430.A N VAL 504.A O no hydrogen 3.395 N/A ARG 431.A N SER 457.A OG no hydrogen 2.880 N/A ARG 432.A N ASN 505.A OD1 no hydrogen 3.030 N/A ARG 432.A NH1 GLU 578.A OE1 no hydrogen 3.556 N/A ARG 432.A NH1 GLU 578.A OE2 no hydrogen 2.858 N/A ARG 432.A NH2 GLU 578.A OE1 no hydrogen 2.877 N/A LEU 438.A N LEU 567.A O no hydrogen 3.442 N/A TYR 440.A N HIS 503.A O no hydrogen 2.991 N/A GLU 441.A N TYR 547.A O no hydrogen 2.744 N/A ALA 442.A N ILE 501.A O no hydrogen 2.841 N/A LEU 443.A N HIS 447.A ND1 no hydrogen 2.899 N/A TRP 445.A NE1 TRP 487.A O no hydrogen 2.918 N/A HIS 447.A N SER 444.A OG no hydrogen 2.938 N/A GLY 448.A N SER 444.A O no hydrogen 2.828 N/A VAL 449.A N TRP 445.A O no hydrogen 2.870 N/A PHE 450.A N GLN 446.A O no hydrogen 3.093 N/A VAL 451.A N HIS 447.A O no hydrogen 2.820 N/A GLY 452.A N GLY 448.A O no hydrogen 2.993 N/A ALA 453.A N VAL 449.A O no hydrogen 2.935 N/A ALA 454.A N PHE 450.A O no hydrogen 2.819 N/A ALA 454.A N VAL 451.A O no hydrogen 3.307 N/A MET 455.A N GLY 452.A O no hydrogen 3.285 N/A ARG 456.A NH1 GLU 578.A OE2 no hydrogen 3.002 N/A SER 457.A N MET 466.A O no hydrogen 2.880 N/A GLU 458.A N ARG 431.A O no hydrogen 2.793 N/A ALA 459.A N VAL 464.A O no hydrogen 2.873 N/A LYS 463.A NZ GLU 458.A OE1 no hydrogen 2.938 N/A MET 466.A N SER 457.A O no hydrogen 2.990 N/A HIS 467.A NE2.A GLU 581.A OE2.B no hydrogen 2.153 N/A HIS 467.A NE2.B GLU 581.A OE1.B no hydrogen 2.601 N/A ASP 468.A N MET 455.A O no hydrogen 2.979 N/A PHE 470.A N GLY 452.A O no hydrogen 2.983 N/A ALA 471.A N ASP 468.A O no hydrogen 2.925 N/A MET 472.A N PRO 469.A O no hydrogen 2.816 N/A ARG 473.A N ASP 468.A OD1 no hydrogen 2.947 N/A ARG 473.A NH1 GLU 87.A OE1.A no hydrogen 2.600 N/A ARG 473.A NH1 GLN 110.A O no hydrogen 2.776 N/A ARG 473.A NH2 GLU 87.A OE1.B no hydrogen 2.813 N/A ARG 473.A NH2 GLU 87.A OE2.A no hydrogen 2.983 N/A PHE 475.A N MET 472.A O no hydrogen 2.811 N/A GLY 477.A N SER 250.A OG no hydrogen 3.003 N/A ASN 479.A N ASP 99.A O no hydrogen 2.956 N/A ASN 479.A ND2 ARG 98.A O no hydrogen 2.855 N/A ASN 479.A ND2 ASP 593.A OD2 no hydrogen 2.831 N/A LYS 482.A N ASN 479.A OD1 no hydrogen 3.065 N/A LYS 482.A NZ.A ASP 99.A OD1 no hydrogen 2.562 N/A TYR 483.A N ASN 479.A O no hydrogen 2.967 N/A TYR 483.A OH GLU 261.A OE1 no hydrogen 2.600 N/A TYR 483.A OH GLU 261.A OE2 no hydrogen 3.397 N/A LEU 484.A N PHE 480.A O no hydrogen 2.945 N/A ALA 485.A N GLY 481.A O no hydrogen 3.013 N/A HIS 486.A N LYS 482.A O no hydrogen 2.831 N/A HIS 486.A NE2 TRP 258.A O no hydrogen 2.817 N/A TRP 487.A N TYR 483.A O no hydrogen 2.938 N/A TRP 487.A NE1 GLU 261.A OE2 no hydrogen 2.929 N/A LEU 488.A N LEU 484.A O no hydrogen 2.900 N/A SER 489.A N ALA 485.A O no hydrogen 2.951 N/A SER 489.A N HIS 486.A O no hydrogen 3.194 N/A SER 489.A OG HIS 486.A O no hydrogen 2.707 N/A MET 490.A N TRP 487.A O no hydrogen 3.163 N/A ALA 491.A N LEU 488.A O no hydrogen 3.221 N/A HIS 492.A N SER 489.A O no hydrogen 2.917 N/A ARG 493.A N MET 490.A O no hydrogen 3.235 N/A ARG 493.A NH1 GLY 257.A O no hydrogen 3.051 N/A ALA 496.A N ARG 493.A O no hydrogen 3.392 N/A LYS 497.A N GLY 319.A O no hydrogen 2.816 N/A LYS 497.A NZ ASN 320.A OD1 no hydrogen 3.006 N/A LYS 500.A NZ GLU 441.A OE2 no hydrogen 2.846 N/A PHE 502.A N ILE 426.A O no hydrogen 2.913 N/A HIS 503.A N TYR 440.A O no hydrogen 2.821 N/A VAL 504.A N PHE 428.A O no hydrogen 2.854 N/A ASN 505.A N LEU 438.A O no hydrogen 2.970 N/A ASN 505.A ND2 ARG 432.A O no hydrogen 2.827 N/A ASN 505.A ND2 VAL 436.A O no hydrogen 2.926 N/A PHE 507.A N ASN 505.A OD1 no hydrogen 3.002 N/A ARG 508.A NH1 LEU 567.A O no hydrogen 3.162 N/A ARG 508.A NH1 GLY 569.A O no hydrogen 2.802 N/A ARG 508.A NH2 GLY 569.A O no hydrogen 2.981 N/A LYS 509.A N PRO 433.A O no hydrogen 2.818 N/A ASP 510.A N LYS 514.A O no hydrogen 2.968 N/A ASN 512.A N ASP 510.A OD1 no hydrogen 2.799 N/A GLY 513.A N ASP 510.A O no hydrogen 2.959 N/A LYS 514.A N ASP 510.A OD1 no hydrogen 2.924 N/A LEU 516.A N ARG 508.A O no hydrogen 3.001 N/A TRP 517.A NE1 ASN 523.A OD1 no hydrogen 2.707 N/A GLU 522.A N GLY 519.A O no hydrogen 2.838 N/A ASN 523.A N PHE 520.A O no hydrogen 2.914 N/A SER 524.A N GLY 521.A O no hydrogen 3.205 N/A SER 524.A OG GLY 521.A O no hydrogen 2.754 N/A ARG 525.A N GLU 522.A O no hydrogen 2.849 N/A ARG 525.A NE GLU 522.A OE1 no hydrogen 2.776 N/A ARG 525.A NH1 ASN 555.A O no hydrogen 2.915 N/A ARG 525.A NH1 LYS 557.A O no hydrogen 2.787 N/A ARG 525.A NH2 GLU 522.A OE1 no hydrogen 3.075 N/A ARG 525.A NH2 LYS 557.A O no hydrogen 2.933 N/A VAL 526.A N ASN 523.A O no hydrogen 2.980 N/A LEU 527.A N ASN 523.A O no hydrogen 3.130 N/A GLU 528.A N SER 524.A O no hydrogen 2.913 N/A TRP 529.A N ARG 525.A O no hydrogen 3.333 N/A TRP 529.A NE1 SER 539.A O no hydrogen 2.948 N/A MET 530.A N VAL 526.A O no hydrogen 3.028 N/A PHE 531.A N LEU 527.A O no hydrogen 2.965 N/A GLY 532.A N GLU 528.A O no hydrogen 3.195 N/A ARG 533.A N TRP 529.A O no hydrogen 2.978 N/A ARG 533.A NE GLU 441.A OE1 no hydrogen 2.630 N/A ARG 533.A NH1 GLU 537.A O no hydrogen 2.867 N/A ARG 533.A NH2 GLU 441.A OE1 no hydrogen 3.413 N/A ARG 533.A NH2 GLU 441.A OE2 no hydrogen 2.877 N/A ILE 534.A N MET 530.A O no hydrogen 2.949 N/A GLU 535.A N PHE 531.A O no hydrogen 3.077 N/A GLY 536.A N ARG 533.A O no hydrogen 2.968 N/A GLU 537.A N GLY 532.A O no hydrogen 3.010 N/A SER 539.A OG GLU 537.A O no hydrogen 3.450 N/A LYS 541.A N VAL 548.A O no hydrogen 2.734 N/A THR 543.A N GLY 546.A O no hydrogen 2.968 N/A THR 543.A OG1 GLY 546.A O no hydrogen 2.768 N/A ILE 545.A N THR 543.A OG1 no hydrogen 3.146 N/A GLY 546.A N THR 543.A O no hydrogen 3.136 N/A TYR 547.A N GLU 441.A O no hydrogen 2.850 N/A VAL 548.A N LYS 541.A O no hydrogen 2.871 N/A LYS 550.A N SER 539.A O no hydrogen 3.013 N/A LYS 550.A NZ ASP 538.A O no hydrogen 2.942 N/A ALA 553.A N LYS 550.A O no hydrogen 2.963 N/A LYS 557.A N ASN 555.A OD1 no hydrogen 2.873 N/A LEU 559.A N LEU 556.A O no hydrogen 2.887 N/A VAL 562.A N GLY 560.A O no hydrogen 3.164 N/A VAL 564.A N VAL 562.A O no hydrogen 2.922 N/A GLU 566.A N ASN 563.A OD1 no hydrogen 3.065 N/A LEU 567.A N ASN 563.A O no hydrogen 2.993 N/A PHE 568.A N VAL 564.A O no hydrogen 2.896 N/A GLY 569.A N GLU 566.A O no hydrogen 3.193 N/A SER 571.A OG GLU 573.A OE1 no hydrogen 3.389 N/A LYS 572.A NZ SER 610.A O no hydrogen 3.273 N/A LYS 572.A NZ MET 612.A O no hydrogen 2.828 N/A PHE 574.A N SER 571.A OG no hydrogen 3.137 N/A TRP 575.A N SER 571.A O no hydrogen 3.016 N/A TRP 575.A NE1 GLY 435.A O no hydrogen 3.156 N/A GLU 576.A N LYS 572.A O no hydrogen 2.776 N/A LYS 577.A N GLU 573.A O no hydrogen 3.229 N/A LYS 577.A NZ.B GLU 581.A OE2.A no hydrogen 2.699 N/A GLU 578.A N PHE 574.A O no hydrogen 2.854 N/A VAL 579.A N TRP 575.A O no hydrogen 2.912 N/A GLU 580.A N GLU 576.A O no hydrogen 3.159 N/A GLU 581.A N LYS 577.A O no hydrogen 2.972 N/A ILE 582.A N GLU 578.A O no hydrogen 2.954 N/A ASP 583.A N VAL 579.A O no hydrogen 2.850 N/A LYS 584.A N GLU 580.A O no hydrogen 2.891 N/A LYS 584.A NZ GLU 581.A OE1.A no hydrogen 3.395 N/A LYS 584.A NZ GLU 581.A OE2.A no hydrogen 2.536 N/A TYR 585.A N GLU 581.A O no hydrogen 3.041 N/A LEU 586.A N ILE 582.A O no hydrogen 2.853 N/A GLU 587.A N ASP 583.A O no hydrogen 2.899 N/A ASP 588.A N LYS 584.A O no hydrogen 3.129 N/A GLN 589.A N TYR 585.A O no hydrogen 2.837 N/A GLN 589.A NE2 GLN 108.A O no hydrogen 3.026 N/A GLN 589.A NE2 ASP 588.A OD2 no hydrogen 2.960 N/A VAL 590.A N LEU 586.A O no hydrogen 2.923 N/A ASN 591.A N LEU 586.A O no hydrogen 3.075 N/A ASN 591.A ND2 ILE 103.A O no hydrogen 3.048 N/A ASP 593.A N VAL 590.A O no hydrogen 2.985 N/A LEU 594.A N ASN 591.A O no hydrogen 3.194 N/A ILE 598.A N PRO 595.A O no hydrogen 2.953 N/A GLU 599.A N PRO 595.A O no hydrogen 3.214 N/A ARG 600.A N TYR 596.A O no hydrogen 2.913 N/A GLU 601.A N GLU 597.A O no hydrogen 2.975 N/A LEU 602.A N ILE 598.A O no hydrogen 2.968 N/A ARG 603.A N GLU 599.A O no hydrogen 2.886 N/A ARG 603.A NE.A GLN 607.A OE1 no hydrogen 3.241 N/A ARG 603.A NH2.A GLN 607.A OE1 no hydrogen 3.111 N/A ALA 604.A N ARG 600.A O no hydrogen 2.803 N/A LEU 605.A N GLU 601.A O no hydrogen 2.966 N/A LYS 606.A N LEU 602.A O no hydrogen 2.969 N/A GLN 607.A N ARG 603.A O no hydrogen 2.910 N/A ARG 608.A N ALA 604.A O no hydrogen 2.958 N/A ARG 608.A NE PRO 544.A O no hydrogen 2.809 N/A ARG 608.A NH2 PRO 544.A O no hydrogen 3.224 N/A ILE 609.A N LEU 605.A O no hydrogen 2.950 N/A SER 610.A N LYS 606.A O no hydrogen 2.858 N/A SER 610.A OG GLN 607.A O no hydrogen 2.650 N/A SER 610.A OG GLN 611.A OE1 no hydrogen 3.048 N/A GLN 611.A N ARG 608.A O no hydrogen 3.135 N/A MET 612.A N ILE 609.A O no hydrogen 3.094 N/A