Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1mw9_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASP 23.A O no hydrogen 2.701 N/A LEU 4.A N HIS 81.A O no hydrogen 3.017 N/A VAL 5.A N VAL 25.A O no hydrogen 2.804 N/A ILE 6.A N.A TYR 83.A O no hydrogen 2.944 N/A ILE 6.A N.B TYR 83.A O no hydrogen 2.949 N/A VAL 7.A N LYS 27.A O no hydrogen 3.143 N/A GLU 8.A N GLU 8.A OE2 no hydrogen 2.595 N/A SER 9.A OG GLU 289.A OE1 no hydrogen 3.004 N/A LYS 12.A N SER 9.A OG no hydrogen 3.113 N/A LYS 12.A NZ GLU 8.A OE2 no hydrogen 2.671 N/A LYS 12.A NZ ALA 85.A O no hydrogen 2.908 N/A LYS 12.A NZ ASP 87.A OD1 no hydrogen 2.934 N/A ALA 13.A N SER 9.A O no hydrogen 2.956 N/A LYS 14.A N PRO 10.A O no hydrogen 2.954 N/A THR 15.A N ALA 11.A O no hydrogen 3.174 N/A THR 15.A OG1 ALA 11.A O no hydrogen 3.206 N/A THR 15.A OG1 GLU 289.A O no hydrogen 2.643 N/A ILE 16.A N LYS 12.A O no hydrogen 2.879 N/A ASN 17.A N ALA 13.A O no hydrogen 2.975 N/A LYS 18.A N THR 15.A O no hydrogen 3.219 N/A TYR 19.A N ILE 16.A O no hydrogen 3.012 N/A LEU 20.A N ASN 17.A O no hydrogen 3.412 N/A TYR 24.A N GLY 21.A O no hydrogen 3.093 N/A VAL 25.A N ALA 3.A O no hydrogen 2.692 N/A LYS 27.A N VAL 5.A O no hydrogen 2.841 N/A SER 29.A N VAL 7.A O no hydrogen 2.884 N/A SER 29.A OG VAL 7.A O no hydrogen 3.381 N/A SER 29.A OG GLY 31.A O no hydrogen 2.802 N/A VAL 30.A N SER 28.A OG.B no hydrogen 2.960 N/A GLY 31.A N GLU 8.A O no hydrogen 2.765 N/A HIS 32.A NE2 GLU 91.A OE1 no hydrogen 3.101 N/A ASP 35.A N GLU 60.A O no hydrogen 3.116 N/A LEU 36.A N ASP 35.A OD2 no hydrogen 2.687 N/A GLY 41.A N GLU 39.A OE1 no hydrogen 2.637 N/A ALA 42.A N GLU 39.A OE2 no hydrogen 2.724 N/A LEU 43.A N GLU 39.A O no hydrogen 3.033 N/A VAL 44.A N ARG 40.A O no hydrogen 2.870 N/A ASN 45.A N GLY 41.A O no hydrogen 2.988 N/A ARG 46.A N ALA 42.A O no hydrogen 2.977 N/A MET 47.A N LEU 43.A O no hydrogen 2.902 N/A GLY 48.A N VAL 44.A O no hydrogen 2.815 N/A ASP 50.A N GLU 56.A O no hydrogen 3.013 N/A TRP 52.A N ASP 50.A OD1 no hydrogen 3.114 N/A HIS 53.A N ASP 50.A O no hydrogen 3.106 N/A TRP 55.A N ASP 50.A O no hydrogen 2.875 N/A TRP 55.A NE1 ASP 529.A OD1 no hydrogen 2.887 N/A GLU 56.A N HIS 53.A O no hydrogen 3.311 N/A HIS 58.A N GLY 48.A O no hydrogen 2.884 N/A GLU 60.A N ASP 35.A O no hydrogen 2.846 N/A LEU 62.A N ILE 33.A O no hydrogen 2.914 N/A LYS 65.A N LEU 62.A O no hydrogen 3.040 N/A LYS 65.A NZ VAL 30.A O no hydrogen 2.946 N/A VAL 69.A N LYS 65.A O no hydrogen 2.907 N/A SER 70.A N GLU 66.A O no hydrogen 2.986 N/A SER 70.A OG GLU 66.A O no hydrogen 3.263 N/A GLU 71.A N LYS 67.A O no hydrogen 3.008 N/A LEU 72.A N VAL 68.A O no hydrogen 2.923 N/A LYS 73.A N VAL 69.A O no hydrogen 2.894 N/A GLN 74.A N SER 70.A O no hydrogen 3.093 N/A LEU 75.A N GLU 71.A O no hydrogen 3.195 N/A ALA 76.A N LEU 72.A O no hydrogen 2.813 N/A GLU 77.A N LYS 73.A O no hydrogen 3.066 N/A LYS 78.A N LEU 75.A O no hydrogen 3.220 N/A ALA 79.A N ALA 76.A O no hydrogen 3.006 N/A ASP 80.A N LYS 2.A O no hydrogen 3.174 N/A HIS 81.A NE2 SER 111.A OG no hydrogen 2.549 N/A ILE 82.A N ARG 109.A O no hydrogen 2.860 N/A TYR 83.A N LEU 4.A O no hydrogen 2.687 N/A LEU 84.A N SER 111.A O no hydrogen 2.810 N/A ALA 85.A N ILE 6.A O.A no hydrogen 2.896 N/A ALA 85.A N ILE 6.A O.B no hydrogen 2.889 N/A THR 86.A OG1 GLY 92.A O no hydrogen 2.767 N/A ASP 87.A N GLU 8.A OE1 no hydrogen 2.703 N/A ARG 90.A NH1 ASP 515.A OD1 no hydrogen 3.220 N/A ARG 90.A NH2 ASP 515.A OD1 no hydrogen 2.807 N/A GLY 92.A N ASP 89.A OD1 no hydrogen 2.952 N/A GLU 93.A N ASP 89.A O no hydrogen 2.956 N/A ALA 94.A N ARG 90.A O no hydrogen 2.932 N/A ILE 95.A N GLU 91.A O no hydrogen 2.897 N/A ALA 96.A N GLY 92.A O no hydrogen 3.019 N/A TRP 97.A N GLU 93.A O no hydrogen 2.947 N/A HIS 98.A N ALA 94.A O no hydrogen 2.917 N/A LEU 99.A N ILE 95.A O no hydrogen 3.002 N/A ARG 100.A N ALA 96.A O no hydrogen 2.993 N/A ARG 100.A NE GLU 101.A OE1 no hydrogen 3.561 N/A GLU 101.A N TRP 97.A O no hydrogen 2.886 N/A VAL 102.A N HIS 98.A O no hydrogen 2.930 N/A ILE 103.A N LEU 99.A O no hydrogen 2.967 N/A GLY 104.A N ARG 100.A O no hydrogen 2.926 N/A ARG 109.A N ASP 106.A O no hydrogen 3.017 N/A ARG 109.A NH1 ALA 79.A O no hydrogen 2.568 N/A ARG 109.A NH2 ALA 76.A O no hydrogen 2.696 N/A ARG 109.A NH2 ALA 79.A O no hydrogen 3.165 N/A TYR 110.A N ASP 107.A O no hydrogen 2.928 N/A TYR 110.A OH GLY 104.A O no hydrogen 2.613 N/A SER 111.A N ILE 82.A O no hydrogen 2.989 N/A SER 111.A OG HIS 81.A NE2 no hydrogen 2.549 N/A ARG 112.A N GLY 131.A O no hydrogen 2.843 N/A ARG 112.A NE GLU 93.A OE1 no hydrogen 2.685 N/A ARG 112.A NE GLU 93.A OE2 no hydrogen 3.459 N/A ARG 112.A NH1 THR 86.A O no hydrogen 2.894 N/A ARG 112.A NH1 VAL 113.A O no hydrogen 2.992 N/A ARG 112.A NH2 ASP 87.A O no hydrogen 2.827 N/A ARG 112.A NH2 GLU 93.A OE1 no hydrogen 2.933 N/A VAL 113.A N LEU 84.A O no hydrogen 3.030 N/A ALA 122.A N THR 119.A OG1 no hydrogen 3.142 N/A ILE 123.A N THR 119.A O no hydrogen 2.944 N/A ARG 124.A N LYS 120.A O no hydrogen 2.993 N/A GLN 125.A N ASN 121.A O no hydrogen 2.980 N/A GLN 125.A NE2 ASN 121.A O no hydrogen 3.292 N/A ALA 126.A N ALA 122.A O no hydrogen 2.907 N/A PHE 127.A N ILE 123.A O no hydrogen 2.951 N/A ASN 128.A N GLN 125.A O no hydrogen 3.277 N/A LYS 129.A N GLN 125.A O no hydrogen 3.242 N/A GLY 131.A N ARG 112.A O no hydrogen 3.105 N/A ASN 134.A N GLU 93.A OE2 no hydrogen 2.832 N/A ARG 137.A N ASN 134.A O no hydrogen 3.114 N/A ARG 137.A N ASN 134.A OD1 no hydrogen 3.175 N/A ARG 137.A NH1 LEU 88.A O no hydrogen 3.007 N/A ARG 137.A NH2 LEU 88.A O no hydrogen 2.858 N/A VAL 138.A N ASN 134.A O no hydrogen 3.181 N/A ASN 139.A N ILE 135.A O no hydrogen 2.803 N/A ALA 140.A N ASP 136.A O no hydrogen 2.984 N/A GLN 141.A N.A ARG 137.A O no hydrogen 3.044 N/A GLN 141.A N.B ARG 137.A O no hydrogen 3.081 N/A GLN 141.A N.B VAL 138.A O no hydrogen 3.072 N/A GLN 141.A NE2.B VAL 138.A O no hydrogen 3.680 N/A GLN 142.A N.A VAL 138.A O no hydrogen 2.943 N/A GLN 142.A N.B VAL 138.A O no hydrogen 2.871 N/A GLN 142.A NE2.A TYR 59.A OH no hydrogen 2.791 N/A GLN 142.A NE2.B TYR 59.A OH no hydrogen 2.740 N/A ALA 143.A N ASN 139.A O no hydrogen 2.890 N/A ARG 144.A N ALA 140.A O no hydrogen 3.171 N/A ARG 144.A NH1 GLU 511.A OE1 no hydrogen 3.167 N/A ARG 144.A NH1 GLU 511.A OE2 no hydrogen 2.979 N/A ARG 144.A NH2 GLU 511.A OE1 no hydrogen 2.913 N/A ARG 145.A N GLN 141.A O.A no hydrogen 2.944 N/A ARG 145.A N GLN 141.A O.B no hydrogen 2.879 N/A ARG 145.A NE ASP 35.A OD2 no hydrogen 2.627 N/A PHE 146.A N GLN 142.A O.A no hydrogen 2.741 N/A PHE 146.A N GLN 142.A O.B no hydrogen 2.827 N/A MET 147.A N ALA 143.A O no hydrogen 2.953 N/A ASP 148.A N ARG 144.A O no hydrogen 3.016 N/A ARG 149.A N ARG 145.A O no hydrogen 2.960 N/A ARG 149.A NH1 PRO 37.A O no hydrogen 3.018 N/A ARG 149.A NH1 MET 47.A O no hydrogen 2.702 N/A ARG 149.A NH2 PRO 37.A O no hydrogen 2.457 N/A VAL 150.A N PHE 146.A O no hydrogen 2.910 N/A VAL 151.A N MET 147.A O no hydrogen 2.996 N/A GLY 152.A N ASP 148.A O no hydrogen 2.994 N/A TYR 153.A N ARG 149.A O no hydrogen 2.828 N/A MET 154.A N VAL 150.A O no hydrogen 2.877 N/A VAL 155.A N VAL 151.A O no hydrogen 2.916 N/A SER 156.A OG GLY 152.A O no hydrogen 2.671 N/A LEU 159.A N VAL 155.A O no hydrogen 3.106 N/A TRP 160.A N SER 156.A O no hydrogen 2.932 N/A TRP 160.A NE1 LEU 167.A O no hydrogen 2.745 N/A LYS 161.A N PRO 157.A O no hydrogen 3.177 N/A LYS 162.A N LEU 158.A O no hydrogen 2.916 N/A LYS 162.A NZ LYS 544.A O no hydrogen 3.054 N/A LYS 162.A NZ MET 551.A O no hydrogen 2.787 N/A ILE 163.A N LEU 159.A O no hydrogen 2.762 N/A ALA 164.A N LEU 159.A O no hydrogen 2.974 N/A ARG 165.A NE TRP 160.A O no hydrogen 2.926 N/A ALA 169.A N SER 156.A OG no hydrogen 2.953 N/A ARG 171.A NE ASP 148.A OD1 no hydrogen 2.811 N/A ARG 171.A NH2 ASP 148.A OD1 no hydrogen 3.466 N/A ARG 171.A NH2 GLU 511.A OE2 no hydrogen 3.401 N/A GLN 173.A N GLN 173.A OE1 no hydrogen 2.710 N/A SER 174.A N GLY 170.A O no hydrogen 3.003 N/A SER 174.A OG GLY 170.A O no hydrogen 2.920 N/A ALA 176.A N VAL 172.A O no hydrogen 2.957 N/A VAL 177.A N GLN 173.A O no hydrogen 2.988 N/A ARG 178.A N SER 174.A O no hydrogen 3.103 N/A ARG 178.A NE GLU 182.A OE2 no hydrogen 2.954 N/A ARG 178.A NH1 MET 502.A O no hydrogen 2.804 N/A ARG 178.A NH2 GLU 182.A OE2 no hydrogen 3.425 N/A LEU 179.A N VAL 175.A O no hydrogen 3.214 N/A VAL 180.A N ALA 176.A O no hydrogen 3.413 N/A VAL 181.A N VAL 177.A O no hydrogen 2.899 N/A GLU 182.A N ARG 178.A O no hydrogen 2.936 N/A ARG 183.A N LEU 179.A O no hydrogen 3.175 N/A ARG 183.A NE GLU 186.A OE1 no hydrogen 3.040 N/A ARG 183.A NH1 ALA 439.A O no hydrogen 2.949 N/A GLU 184.A N VAL 180.A O no hydrogen 2.954 N/A ARG 185.A N VAL 181.A O no hydrogen 3.046 N/A ARG 185.A NH1 ASP 492.A OD1 no hydrogen 2.734 N/A ARG 185.A NH2 ASP 492.A OD1 no hydrogen 3.457 N/A ARG 185.A NH2 ASP 492.A OD2 no hydrogen 2.731 N/A GLU 186.A N GLU 182.A O no hydrogen 2.923 N/A ILE 187.A N ARG 183.A O no hydrogen 2.994 N/A LYS 188.A N GLU 184.A O no hydrogen 3.003 N/A ALA 189.A N ARG 185.A O no hydrogen 3.107 N/A PHE 190.A N ILE 187.A O no hydrogen 3.359 N/A GLU 193.A N THR 435.A OG1 no hydrogen 2.731 N/A PHE 195.A N HIS 433.A O no hydrogen 3.148 N/A TRP 196.A N PRO 224.A O.A no hydrogen 2.801 N/A TRP 196.A N PRO 224.A O.B no hydrogen 2.794 N/A TRP 196.A NE1 GLU 194.A OE2 no hydrogen 2.779 N/A GLU 197.A N.A ALA 431.A O no hydrogen 2.915 N/A GLU 197.A N.B ALA 431.A O no hydrogen 2.910 N/A ASP 199.A N THR 429.A O no hydrogen 3.093 N/A ALA 200.A N LEU 212.A O no hydrogen 2.743 N/A SER 201.A N GLU 427.A O.A no hydrogen 2.800 N/A SER 201.A N GLU 427.A O.B no hydrogen 2.839 N/A SER 201.A OG GLU 427.A OE2.B no hydrogen 2.866 N/A THR 202.A N LEU 210.A O no hydrogen 2.883 N/A THR 202.A OG1 LEU 210.A O no hydrogen 2.905 N/A THR 203.A N THR 424.A O no hydrogen 2.902 N/A THR 204.A N GLU 208.A O no hydrogen 2.849 N/A THR 204.A OG1 SER 206.A OG no hydrogen 2.825 N/A THR 204.A OG1 GLU 208.A O no hydrogen 3.506 N/A SER 206.A OG THR 204.A OG1 no hydrogen 2.825 N/A SER 206.A OG GLU 208.A OE2 no hydrogen 3.141 N/A GLY 207.A N THR 204.A O no hydrogen 2.698 N/A GLU 208.A N THR 204.A OG1 no hydrogen 3.158 N/A LEU 210.A N THR 202.A O no hydrogen 2.818 N/A LEU 212.A N ALA 200.A O no hydrogen 2.758 N/A GLN 213.A N LYS 391.A O no hydrogen 2.982 N/A VAL 214.A N VAL 198.A O no hydrogen 2.956 N/A THR 215.A N ARG 389.A O no hydrogen 2.847 N/A THR 215.A OG1 HIS 216.A ND1 no hydrogen 2.879 N/A THR 215.A OG1 ARG 389.A O no hydrogen 3.221 N/A HIS 216.A N ARG 389.A O no hydrogen 3.226 N/A HIS 216.A ND1 THR 215.A OG1 no hydrogen 2.879 N/A GLN 217.A N LYS 220.A O no hydrogen 2.851 N/A ASN 218.A N ASP 387.A O no hydrogen 2.835 N/A LYS 220.A N GLN 217.A O no hydrogen 3.036 N/A PHE 222.A N THR 215.A O no hydrogen 2.835 N/A VAL 225.A N GLN 229.A OE1 no hydrogen 2.831 N/A THR 230.A N ASN 226.A O no hydrogen 3.187 N/A THR 230.A OG1 ASN 226.A O no hydrogen 2.997 N/A GLN 231.A N LYS 227.A O no hydrogen 2.825 N/A ALA 232.A N GLU 228.A O no hydrogen 3.014 N/A ALA 233.A N GLN 229.A O no hydrogen 3.128 N/A VAL 234.A N THR 230.A O no hydrogen 2.845 N/A SER 235.A N.A GLN 231.A O no hydrogen 2.931 N/A SER 235.A N.B GLN 231.A O no hydrogen 2.932 N/A SER 235.A OG.B GLN 231.A O no hydrogen 3.094 N/A LEU 236.A N ALA 232.A O no hydrogen 3.344 N/A LEU 237.A N ALA 233.A O no hydrogen 2.870 N/A GLU 238.A N VAL 234.A O no hydrogen 2.873 N/A LYS 239.A N LEU 236.A O no hydrogen 3.159 N/A LYS 239.A NZ SER 235.A O.A no hydrogen 3.247 N/A LYS 239.A NZ SER 235.A O.B no hydrogen 3.240 N/A ALA 240.A N LEU 236.A O no hydrogen 3.110 N/A TYR 242.A OH LEU 237.A O no hydrogen 2.759 N/A SER 243.A N GLY 384.A O no hydrogen 3.010 N/A VAL 244.A N ASP 421.A O no hydrogen 2.871 N/A LEU 245.A N THR 382.A O no hydrogen 2.749 N/A GLU 246.A N THR 382.A O no hydrogen 3.170 N/A ARG 247.A NE ASP 249.A OD2 no hydrogen 3.021 N/A GLU 248.A N THR 380.A O no hydrogen 2.969 N/A LYS 250.A N SER 378.A O no hydrogen 2.972 N/A THR 252.A N TYR 376.A O no hydrogen 2.786 N/A THR 252.A OG1 SER 378.A OG no hydrogen 2.687 N/A SER 254.A N.A ALA 374.A O no hydrogen 3.017 N/A SER 254.A N.B ALA 374.A O no hydrogen 3.016 N/A LYS 255.A NZ.A THR 253.A OG1 no hydrogen 2.648 N/A LYS 255.A NZ.B PRO 256.A O no hydrogen 2.578 N/A LYS 255.A NZ.B TYR 331.A OH no hydrogen 2.414 N/A ILE 261.A N THR 264.A OG1 no hydrogen 2.984 N/A THR 262.A N THR 298.A O no hydrogen 3.015 N/A THR 262.A OG1 MET 296.A O no hydrogen 2.653 N/A THR 262.A OG1 THR 298.A O no hydrogen 3.248 N/A SER 263.A OG.A GLU 451.A OE1 no hydrogen 2.713 N/A SER 263.A OG.B GLU 451.A OE1 no hydrogen 3.111 N/A SER 263.A OG.B GLU 451.A OE2 no hydrogen 3.024 N/A THR 264.A OG1 ILE 261.A O no hydrogen 3.301 N/A LEU 265.A N ILE 261.A O no hydrogen 2.927 N/A GLN 266.A N THR 262.A O no hydrogen 3.080 N/A GLN 267.A N SER 263.A O.A no hydrogen 3.092 N/A GLN 267.A N SER 263.A O.B no hydrogen 3.102 N/A GLN 267.A NE2 SER 263.A O.A no hydrogen 3.324 N/A GLN 267.A NE2 SER 263.A O.B no hydrogen 3.291 N/A GLN 267.A NE2 SER 263.A OG.A no hydrogen 2.981 N/A ALA 268.A N THR 264.A O no hydrogen 2.914 N/A ALA 269.A N LEU 265.A O no hydrogen 2.874 N/A SER 270.A N GLN 266.A O no hydrogen 3.099 N/A THR 271.A N.A GLN 267.A O no hydrogen 2.906 N/A THR 271.A N.B GLN 267.A O no hydrogen 2.907 N/A THR 271.A OG1.A GLN 267.A O no hydrogen 3.134 N/A THR 271.A OG1.B GLN 267.A O no hydrogen 3.123 N/A THR 271.A OG1.B ALA 268.A O no hydrogen 3.447 N/A ARG 272.A N ALA 268.A O no hydrogen 2.771 N/A LEU 273.A N ALA 269.A O no hydrogen 3.004 N/A GLY 274.A N SER 270.A O no hydrogen 2.952 N/A PHE 275.A N ALA 269.A O no hydrogen 3.122 N/A VAL 277.A N GLU 443.A OE1 no hydrogen 3.022 N/A LYS 279.A NZ ASP 354.A OD2 no hydrogen 2.647 N/A THR 280.A N GLY 276.A O no hydrogen 2.972 N/A THR 280.A OG1 GLY 276.A O no hydrogen 3.257 N/A MET 281.A N VAL 277.A O no hydrogen 3.052 N/A MET 282.A N.A LYS 278.A O no hydrogen 2.948 N/A MET 282.A N.B LYS 278.A O no hydrogen 2.943 N/A MET 283.A N LYS 279.A O no hydrogen 2.956 N/A ALA 284.A N THR 280.A O no hydrogen 2.850 N/A GLN 285.A N MET 281.A O no hydrogen 3.032 N/A GLN 285.A NE2 GLU 289.A OE2 no hydrogen 3.375 N/A ARG 286.A N MET 282.A O.A no hydrogen 3.191 N/A ARG 286.A N MET 282.A O.B no hydrogen 3.225 N/A ARG 286.A NE GLU 352.A OE1.B no hydrogen 3.378 N/A ARG 286.A NH2 GLU 352.A OE1.B no hydrogen 2.906 N/A LEU 287.A N MET 283.A O no hydrogen 2.930 N/A TYR 288.A N ALA 284.A O no hydrogen 2.894 N/A TYR 288.A OH ASP 87.A OD1 no hydrogen 2.799 N/A GLU 289.A N GLN 285.A O no hydrogen 2.865 N/A ALA 290.A N ARG 286.A O no hydrogen 3.059 N/A GLY 291.A N TYR 288.A O no hydrogen 2.966 N/A TYR 292.A N LEU 287.A O no hydrogen 2.907 N/A THR 294.A N ARG 337.A O no hydrogen 2.945 N/A THR 294.A OG1 ALA 335.A O no hydrogen 2.716 N/A THR 294.A OG1 ARG 337.A O no hydrogen 3.440 N/A TYR 295.A N ASN 116.A O.A no hydrogen 2.673 N/A TYR 295.A N ASN 116.A O.B no hydrogen 2.674 N/A ARG 297.A NH1 ASP 89.A OD2 no hydrogen 2.847 N/A ARG 297.A NH1 GLU 91.A OE2 no hydrogen 2.782 N/A THR 298.A N THR 262.A OG1 no hydrogen 2.860 N/A THR 298.A OG1 SER 300.A O.A no hydrogen 3.570 N/A THR 298.A OG1 SER 300.A O.B no hydrogen 3.566 N/A THR 298.A OG1 GLU 334.A O no hydrogen 2.872 N/A SER 300.A N.A THR 298.A OG1 no hydrogen 3.060 N/A SER 300.A N.B THR 298.A OG1 no hydrogen 3.064 N/A SER 300.A OG.B THR 298.A OG1 no hydrogen 3.004 N/A ASN 302.A N SER 300.A OG.A no hydrogen 3.066 N/A SER 304.A N GLU 334.A OE2 no hydrogen 2.792 N/A ALA 307.A N SER 304.A OG no hydrogen 3.004 N/A VAL 308.A N SER 304.A O no hydrogen 2.981 N/A ASN 309.A N GLN 305.A O no hydrogen 2.904 N/A MET 310.A N ASP 306.A O no hydrogen 2.871 N/A VAL 311.A N ALA 307.A O no hydrogen 3.065 N/A ARG 312.A N VAL 308.A O no hydrogen 2.940 N/A ARG 312.A NH1 PRO 325.A O no hydrogen 2.946 N/A ARG 312.A NH2 PRO 325.A O no hydrogen 2.985 N/A GLY 313.A N ASN 309.A O no hydrogen 3.044 N/A TYR 314.A N MET 310.A O no hydrogen 3.168 N/A ILE 315.A N VAL 311.A O no hydrogen 2.913 N/A SER 316.A N.A ARG 312.A O no hydrogen 2.960 N/A SER 316.A N.B ARG 312.A O no hydrogen 2.961 N/A SER 316.A OG.B ARG 312.A O no hydrogen 2.972 N/A ASP 317.A N GLY 313.A O no hydrogen 3.019 N/A ASN 318.A N TYR 314.A O no hydrogen 2.900 N/A ASN 318.A ND2 TYR 314.A O no hydrogen 3.082 N/A PHE 319.A N ILE 315.A O no hydrogen 2.836 N/A GLY 320.A N ILE 315.A O no hydrogen 2.995 N/A TYR 323.A N GLY 320.A O no hydrogen 3.082 N/A TYR 323.A OH ASP 400.A OD1 no hydrogen 2.656 N/A LEU 324.A N LYS 321.A O no hydrogen 3.090 N/A ASN 329.A N GLN 370.A OE1 no hydrogen 2.943 N/A ASN 329.A ND2 CYS 369.A O no hydrogen 2.954 N/A ASN 329.A ND2 MET 371.A O no hydrogen 3.554 N/A TYR 331.A OH CYS 369.A O no hydrogen 2.753 N/A ALA 335.A N ASN 302.A O no hydrogen 2.888 N/A ILE 336.A N PHE 260.A O no hydrogen 2.773 N/A ARG 337.A N THR 294.A OG1 no hydrogen 2.881 N/A ARG 337.A NE GLU 334.A OE2 no hydrogen 2.793 N/A ARG 337.A NH1 GLU 117.A OE1 no hydrogen 3.249 N/A ARG 337.A NH1 PRO 338.A O no hydrogen 2.904 N/A ARG 337.A NH2 GLU 117.A OE2 no hydrogen 3.094 N/A ARG 337.A NH2 GLU 334.A OE1 no hydrogen 2.886 N/A ARG 337.A NH2 GLU 334.A OE2 no hydrogen 3.283 N/A SER 339.A N TYR 292.A O no hydrogen 2.914 N/A SER 339.A OG GLY 291.A O no hydrogen 2.626 N/A ASN 342.A N ASP 340.A OD1 no hydrogen 2.877 N/A VAL 343.A N ASP 340.A O no hydrogen 2.992 N/A SER 347.A N.A MET 344.A O no hydrogen 2.901 N/A SER 347.A N.B MET 344.A O no hydrogen 2.896 N/A SER 347.A OG.A MET 344.A O no hydrogen 2.734 N/A LEU 348.A N ALA 345.A O no hydrogen 3.334 N/A LYS 349.A N TYR 292.A OH no hydrogen 3.208 N/A GLU 352.A N.B GLU 352.A OE2.B no hydrogen 2.533 N/A ALA 355.A N GLU 352.A O.A no hydrogen 2.874 N/A ALA 355.A N GLU 352.A O.B no hydrogen 2.952 N/A GLN 356.A N GLU 352.A O.A no hydrogen 2.999 N/A GLN 356.A N GLU 352.A O.B no hydrogen 3.006 N/A GLN 356.A NE2 LEU 348.A O no hydrogen 3.570 N/A LYS 357.A N ALA 353.A O no hydrogen 2.935 N/A LEU 358.A N ASP 354.A O no hydrogen 2.985 N/A TYR 359.A N ALA 355.A O no hydrogen 3.012 N/A TYR 359.A OH VAL 343.A O no hydrogen 2.623 N/A GLN 360.A N.A GLN 356.A O no hydrogen 2.861 N/A GLN 360.A N.B GLN 356.A O no hydrogen 2.858 N/A GLN 360.A NE2.A GLN 360.A O.A no hydrogen 3.201 N/A LEU 361.A N LYS 357.A O no hydrogen 2.997 N/A ILE 362.A N LEU 358.A O no hydrogen 2.964 N/A TRP 363.A N TYR 359.A O no hydrogen 2.734 N/A TRP 363.A NE1 VAL 341.A O no hydrogen 2.938 N/A ARG 364.A N.A GLN 360.A O.A no hydrogen 2.856 N/A ARG 364.A N.A GLN 360.A O.B no hydrogen 2.871 N/A ARG 364.A N.B GLN 360.A O.A no hydrogen 2.844 N/A ARG 364.A N.B GLN 360.A O.B no hydrogen 2.859 N/A ARG 364.A NH1.A VAL 405.A O no hydrogen 2.556 N/A GLN 365.A N LEU 361.A O no hydrogen 3.077 N/A GLN 365.A NE2 ALA 258.A O no hydrogen 2.918 N/A PHE 366.A N ILE 362.A O no hydrogen 3.006 N/A VAL 367.A N TRP 363.A O no hydrogen 2.892 N/A ALA 368.A N ARG 364.A O.A no hydrogen 2.886 N/A ALA 368.A N ARG 364.A O.B no hydrogen 2.870 N/A CYS 369.A N GLN 365.A O no hydrogen 2.987 N/A CYS 369.A SG PHE 366.A O no hydrogen 3.252 N/A GLN 370.A N VAL 367.A O no hydrogen 3.133 N/A GLN 370.A NE2 ASN 329.A O no hydrogen 2.915 N/A MET 371.A N ALA 368.A O no hydrogen 3.028 N/A THR 372.A N TYR 323.A O no hydrogen 3.069 N/A THR 372.A OG1 LYS 322.A O no hydrogen 2.931 N/A ALA 374.A N SER 254.A O.A no hydrogen 2.987 N/A ALA 374.A N SER 254.A O.B no hydrogen 2.987 N/A LYS 375.A N PHE 399.A O no hydrogen 2.783 N/A TYR 376.A N THR 252.A O no hydrogen 2.811 N/A ASP 377.A N ILE 396.A O no hydrogen 2.845 N/A SER 378.A N LYS 250.A O no hydrogen 2.891 N/A SER 378.A OG THR 252.A OG1 no hydrogen 2.687 N/A THR 379.A N GLY 394.A O no hydrogen 2.854 N/A THR 379.A OG1 ASP 249.A OD1 no hydrogen 2.779 N/A THR 380.A N GLU 248.A O no hydrogen 2.980 N/A LEU 381.A N ALA 392.A O no hydrogen 2.829 N/A THR 382.A N GLU 246.A O no hydrogen 2.888 N/A VAL 383.A N LEU 390.A O no hydrogen 2.783 N/A GLY 384.A N SER 243.A O no hydrogen 2.858 N/A ALA 385.A N PHE 388.A O no hydrogen 2.989 N/A PHE 388.A N ALA 385.A O no hydrogen 2.913 N/A ARG 389.A N HIS 216.A O no hydrogen 2.981 N/A LEU 390.A N VAL 383.A O no hydrogen 2.792 N/A LYS 391.A N GLN 213.A O no hydrogen 2.865 N/A LYS 391.A NZ THR 215.A OG1 no hydrogen 3.007 N/A ALA 392.A N LEU 381.A O no hydrogen 3.052 N/A GLY 394.A N THR 379.A O no hydrogen 2.983 N/A ARG 395.A N ARG 412.A O no hydrogen 2.868 N/A ARG 395.A NH2 ASP 411.A OD2 no hydrogen 2.812 N/A ILE 396.A N ASP 377.A O no hydrogen 2.865 N/A ARG 398.A N LYS 375.A O no hydrogen 2.753 N/A ARG 398.A NE ASP 377.A OD2 no hydrogen 2.620 N/A PHE 399.A N LYS 375.A O no hydrogen 3.156 N/A TRP 402.A N THR 372.A O no hydrogen 2.893 N/A TRP 402.A NE1 SER 254.A O.A no hydrogen 2.685 N/A TRP 402.A NE1 SER 254.A OG.B no hydrogen 3.122 N/A THR 403.A N ASP 400.A O no hydrogen 3.011 N/A THR 403.A OG1 ASP 400.A O no hydrogen 2.631 N/A LYS 404.A N GLY 401.A O no hydrogen 3.007 N/A LYS 404.A NZ TYR 323.A OH no hydrogen 2.951 N/A VAL 405.A N TRP 402.A O no hydrogen 3.279 N/A MET 406.A N THR 403.A O no hydrogen 3.031 N/A ARG 412.A NH1 ALA 211.A O no hydrogen 3.389 N/A ARG 412.A NH2 ALA 211.A O no hydrogen 2.363 N/A ASN 418.A N ASP 421.A OD2 no hydrogen 2.681 N/A GLY 420.A N VAL 244.A O no hydrogen 2.739 N/A ASP 421.A N ASN 418.A O no hydrogen 2.948 N/A LEU 423.A N TYR 242.A O no hydrogen 2.906 N/A THR 424.A N THR 203.A O no hydrogen 3.014 N/A VAL 426.A N SER 201.A O no hydrogen 2.780 N/A GLU 427.A N.A SER 201.A O no hydrogen 3.190 N/A GLU 427.A N.B SER 201.A O no hydrogen 3.201 N/A THR 429.A N ASP 199.A O no hydrogen 2.820 N/A THR 429.A OG1 GLU 427.A OE1.B no hydrogen 2.357 N/A THR 429.A OG1 GLU 427.A OE2.B no hydrogen 2.830 N/A ALA 431.A N GLU 197.A O.A no hydrogen 2.756 N/A ALA 431.A N GLU 197.A O.B no hydrogen 2.777 N/A HIS 433.A N PHE 195.A O no hydrogen 2.727 N/A HIS 433.A ND1 ALA 431.A O no hydrogen 3.050 N/A THR 435.A N GLU 193.A O no hydrogen 2.881 N/A THR 435.A OG1 GLU 193.A O no hydrogen 3.568 N/A ARG 440.A NH1 GLU 184.A OE1 no hydrogen 2.868 N/A ARG 440.A NH1 GLU 184.A OE2 no hydrogen 3.334 N/A ARG 440.A NH1 PHE 481.A O no hydrogen 2.990 N/A ARG 440.A NH2 GLU 184.A OE2 no hydrogen 2.826 N/A SER 442.A N SER 445.A OG no hydrogen 2.777 N/A SER 442.A OG SER 445.A OG no hydrogen 3.184 N/A SER 445.A N SER 442.A OG no hydrogen 3.014 N/A SER 445.A OG SER 442.A O no hydrogen 3.395 N/A SER 445.A OG SER 442.A OG no hydrogen 3.184 N/A LEU 446.A N SER 442.A O no hydrogen 2.888 N/A VAL 447.A N GLU 443.A O no hydrogen 3.191 N/A LYS 448.A N ALA 444.A O no hydrogen 3.120 N/A LYS 448.A NZ GLN 267.A OE1 no hydrogen 2.713 N/A GLU 449.A N SER 445.A O no hydrogen 2.923 N/A LEU 450.A N LEU 446.A O no hydrogen 2.893 N/A GLU 451.A N VAL 447.A O no hydrogen 2.952 N/A LYS 452.A N LYS 448.A O no hydrogen 2.807 N/A ARG 453.A N GLU 449.A O no hydrogen 2.996 N/A ARG 453.A NE GLU 449.A OE2 no hydrogen 2.849 N/A GLY 454.A N GLU 451.A O no hydrogen 2.992 N/A ILE 455.A N LEU 450.A O no hydrogen 3.028 N/A GLY 456.A N LEU 450.A O no hydrogen 3.239 N/A ARG 457.A N THR 460.A OG1 no hydrogen 3.073 N/A ARG 457.A NH1 GLY 454.A O no hydrogen 3.550 N/A ARG 457.A NH1 GLY 456.A O no hydrogen 3.295 N/A ARG 457.A NH2 ASP 515.A OD2 no hydrogen 3.076 N/A THR 460.A N ARG 457.A O no hydrogen 2.833 N/A THR 460.A OG1 ARG 457.A O no hydrogen 3.305 N/A TYR 461.A N ARG 457.A O no hydrogen 2.909 N/A SER 463.A OG THR 460.A O no hydrogen 2.745 N/A ILE 464.A N THR 460.A O no hydrogen 2.908 N/A ILE 465.A N TYR 461.A O no hydrogen 3.284 N/A SER 466.A N.A ALA 462.A O no hydrogen 3.034 N/A SER 466.A N.B ALA 462.A O no hydrogen 3.032 N/A SER 466.A OG.A ALA 462.A O no hydrogen 2.880 N/A SER 466.A OG.B ASP 470.A OD2 no hydrogen 3.296 N/A THR 467.A N SER 463.A O no hydrogen 2.916 N/A THR 467.A OG1 SER 463.A O no hydrogen 2.777 N/A THR 467.A OG1 ILE 464.A O no hydrogen 2.922 N/A ILE 468.A N ILE 464.A O no hydrogen 3.177 N/A GLN 469.A N SER 466.A O.A no hydrogen 3.167 N/A GLN 469.A N SER 466.A O.B no hydrogen 3.131 N/A GLN 469.A NE2 ILE 465.A O no hydrogen 2.793 N/A ASP 470.A N SER 466.A O.A no hydrogen 3.204 N/A ASP 470.A N SER 466.A O.B no hydrogen 3.201 N/A ARG 471.A N THR 467.A O no hydrogen 2.987 N/A GLY 472.A N GLN 469.A O no hydrogen 3.069 N/A TYR 473.A N ILE 468.A O no hydrogen 3.441 N/A TYR 473.A OH SER 168.A O no hydrogen 2.748 N/A ARG 475.A N TYR 482.A O no hydrogen 2.924 N/A ARG 475.A NE GLU 484.A OE2.A no hydrogen 3.400 N/A ARG 475.A NH1 GLU 477.A OE2 no hydrogen 2.503 N/A ARG 475.A NH2 GLU 477.A OE2 no hydrogen 3.103 N/A GLU 477.A N ARG 480.A O no hydrogen 2.961 N/A ARG 479.A NH2 SER 270.A O no hydrogen 2.821 N/A ARG 480.A N GLU 477.A O no hydrogen 3.149 N/A ARG 480.A NH1 ARG 479.A O no hydrogen 2.748 N/A PHE 481.A N PHE 441.A O no hydrogen 2.752 N/A TYR 482.A N ARG 475.A O no hydrogen 2.829 N/A ALA 483.A N GLU 184.A OE1 no hydrogen 2.813 N/A GLU 484.A N.A TYR 473.A O no hydrogen 2.850 N/A GLU 484.A N.B TYR 473.A O no hydrogen 2.863 N/A LYS 485.A NZ GLU 484.A OE2.A no hydrogen 2.942 N/A GLU 488.A N GLU 484.A O.A no hydrogen 3.130 N/A GLU 488.A N GLU 484.A O.B no hydrogen 3.128 N/A ILE 489.A N LYS 485.A O no hydrogen 2.883 N/A VAL 490.A N MET 486.A O no hydrogen 2.922 N/A THR 491.A N GLY 487.A O no hydrogen 2.951 N/A THR 491.A OG1 GLY 487.A O no hydrogen 2.715 N/A ASP 492.A N GLU 488.A O no hydrogen 2.931 N/A ARG 493.A N ILE 489.A O no hydrogen 3.267 N/A ARG 493.A NE ARG 552.A O no hydrogen 2.757 N/A ARG 493.A NH1 ILE 489.A O no hydrogen 3.097 N/A ARG 493.A NH2 PRO 553.A O.A no hydrogen 3.124 N/A ARG 493.A NH2 PRO 553.A O.B no hydrogen 3.160 N/A LEU 494.A N VAL 490.A O no hydrogen 2.844 N/A GLU 495.A N THR 491.A O no hydrogen 2.845 N/A GLU 496.A N ASP 492.A O no hydrogen 3.049 N/A ASN 497.A N ARG 493.A O no hydrogen 3.040 N/A ASN 497.A ND2 GLY 549.A O no hydrogen 2.889 N/A PHE 498.A N LEU 494.A O no hydrogen 2.709 N/A LEU 501.A N GLN 538.A OE1 no hydrogen 3.203 N/A MET 502.A N PHE 498.A O no hydrogen 3.006 N/A MET 502.A N ARG 499.A O no hydrogen 3.220 N/A ASN 503.A N GLU 500.A O no hydrogen 3.206 N/A TYR 504.A OH GLU 182.A OE1 no hydrogen 2.519 N/A THR 507.A N ASN 503.A O no hydrogen 3.049 N/A THR 507.A OG1 ASN 503.A O no hydrogen 2.872 N/A ALA 508.A N TYR 504.A O no hydrogen 3.001 N/A GLN 509.A N ASP 505.A O no hydrogen 2.863 N/A MET 510.A N PHE 506.A O no hydrogen 2.945 N/A GLU 511.A N THR 507.A O no hydrogen 3.370 N/A ASN 512.A N ALA 508.A O no hydrogen 3.147 N/A ASN 513.A N GLN 509.A O no hydrogen 2.798 N/A LEU 514.A N MET 510.A O no hydrogen 3.004 N/A ASP 515.A N GLU 511.A O no hydrogen 3.100 N/A GLN 516.A N ASN 512.A O no hydrogen 2.920 N/A VAL 517.A N ASN 513.A O no hydrogen 3.051 N/A ALA 518.A N LEU 514.A O no hydrogen 3.009 N/A ASN 519.A N ASP 515.A O no hydrogen 3.004 N/A ASN 519.A N GLN 516.A O no hydrogen 3.208 N/A ASN 519.A ND2 ASP 515.A O no hydrogen 3.097 N/A HIS 520.A N VAL 517.A O no hydrogen 3.126 N/A GLU 521.A N GLN 516.A O no hydrogen 2.718 N/A LYS 525.A N GLU 523.A OE2 no hydrogen 3.035 N/A LYS 525.A NZ ASN 54.A O no hydrogen 2.874 N/A ALA 526.A N GLU 523.A OE1 no hydrogen 2.921 N/A VAL 527.A N GLU 523.A O no hydrogen 3.030 N/A LEU 528.A N TRP 524.A O no hydrogen 2.958 N/A ASP 529.A N LYS 525.A O no hydrogen 2.827 N/A HIS 530.A N ALA 526.A O no hydrogen 3.002 N/A PHE 531.A N VAL 527.A O no hydrogen 3.012 N/A PHE 532.A N LEU 528.A O no hydrogen 2.810 N/A SER 533.A N ASP 529.A O no hydrogen 2.844 N/A ASP 534.A N HIS 530.A O no hydrogen 3.189 N/A PHE 535.A N PHE 531.A O no hydrogen 2.835 N/A THR 536.A N PHE 532.A O no hydrogen 2.825 N/A THR 536.A OG1 PHE 532.A O no hydrogen 2.797 N/A THR 536.A OG1 SER 533.A O no hydrogen 3.096 N/A GLN 537.A N SER 533.A O no hydrogen 3.197 N/A GLN 538.A N ASP 534.A O no hydrogen 3.202 N/A GLN 538.A NE2 ASP 534.A O no hydrogen 3.026 N/A LEU 539.A N PHE 535.A O no hydrogen 2.849 N/A ASP 540.A N THR 536.A O no hydrogen 2.864 N/A ALA 542.A N GLN 538.A O no hydrogen 2.993 N/A GLU 543.A N LEU 539.A O no hydrogen 3.065 N/A LYS 544.A N LYS 541.A O no hydrogen 3.111 N/A LYS 544.A NZ GLU 548.A O no hydrogen 3.329 N/A GLU 548.A N ASP 545.A O no hydrogen 2.896 N/A GLY 549.A N PRO 546.A O.A no hydrogen 2.906 N/A GLY 549.A N PRO 546.A O.B no hydrogen 2.898 N/A GLY 550.A N ASP 545.A O no hydrogen 2.972 N/A MET 551.A N ALA 542.A O no hydrogen 2.891 N/A ARG 552.A NH1 GLU 496.A OE1 no hydrogen 3.271 N/A ARG 552.A NH1 GLU 496.A OE2 no hydrogen 2.925 N/A ASN 554.A N LYS 162.A O no hydrogen 2.937 N/A ASN 554.A ND2 ILE 163.A O no hydrogen 3.533 N/A GLN 555.A N PRO 553.A O.B no hydrogen 3.086 N/A