Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vws_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N ASP 3.A OD2 no hydrogen 3.313 N/A ASN 1.A ND2 ASN 283.A OD1 no hydrogen 3.045 N/A VAL 4.A N ASN 1.A O no hydrogen 3.245 N/A ILE 5.A N ASN 1.A O no hydrogen 3.396 N/A GLY 6.A N MET 2.A O no hydrogen 2.766 N/A ARG 8.A NH1 CYS 167.A O no hydrogen 3.094 N/A ARG 8.A NH1 LEU 279.A O no hydrogen 3.233 N/A ARG 8.A NH1 ASN 283.A O no hydrogen 3.473 N/A ARG 8.A NH2 VAL 4.A O no hydrogen 3.214 N/A ARG 8.A NH2 LEU 279.A O no hydrogen 2.729 N/A ARG 8.A NH2 ASN 283.A O no hydrogen 3.554 N/A ILE 9.A N ILE 5.A O no hydrogen 3.276 N/A LYS 10.A N GLY 6.A O no hydrogen 2.883 N/A LYS 10.A NZ GLU 14.A OE1 no hydrogen 3.067 N/A ARG 11.A N GLU 7.A O no hydrogen 3.024 N/A ARG 11.A NE GLU 7.A OE2 no hydrogen 2.764 N/A ILE 12.A N ARG 8.A O no hydrogen 3.170 N/A LYS 13.A N ILE 9.A O no hydrogen 2.838 N/A GLU 14.A N LYS 10.A O no hydrogen 2.996 N/A GLU 15.A N ARG 11.A O no hydrogen 3.075 N/A HIS 16.A N ILE 12.A O no hydrogen 3.148 N/A ASN 17.A N GLU 14.A O no hydrogen 3.439 N/A TRP 20.A N HIS 16.A O no hydrogen 3.035 N/A HIS 21.A N SER 36.A O no hydrogen 2.970 N/A HIS 21.A ND1 THR 19.A O no hydrogen 2.802 N/A ASP 23.A N TYR 33.A OH no hydrogen 3.027 N/A GLU 25.A N ASP 23.A OD1 no hydrogen 2.898 N/A TYR 28.A OH ASP 299.A OD2 no hydrogen 2.637 N/A LYS 29.A N ASP 77.A OD1 no hydrogen 2.995 N/A LYS 29.A N ASP 77.A OD2 no hydrogen 3.341 N/A THR 30.A N ASP 77.A OD2 no hydrogen 2.742 N/A THR 30.A OG1 ASP 77.A OD2 no hydrogen 2.879 N/A THR 30.A OG1 THR 78.A O no hydrogen 3.385 N/A TRP 31.A NE1 VAL 76.A O no hydrogen 3.066 N/A ALA 32.A N SER 302.A O no hydrogen 2.819 N/A TYR 33.A OH SER 36.A OG no hydrogen 2.539 N/A HIS 34.A N ILE 300.A O no hydrogen 2.798 N/A HIS 34.A NE2 SER 302.A OG no hydrogen 3.248 N/A SER 36.A N HIS 21.A O no hydrogen 2.876 N/A SER 36.A OG TYR 33.A OH no hydrogen 2.539 N/A SER 36.A OG ASP 299.A OD1 no hydrogen 2.656 N/A TYR 37.A N MET 298.A O no hydrogen 3.361 N/A GLU 38.A N THR 19.A OG1 no hydrogen 3.166 N/A VAL 39.A N THR 296.A O no hydrogen 2.898 N/A LYS 40.A NZ ALA 41.A O no hydrogen 2.872 N/A THR 42.A OG1 LYS 175.A O no hydrogen 3.046 N/A MET 44.A N SER 450.A O no hydrogen 3.284 N/A ASN 46.A N ARG 448.A O no hydrogen 2.616 N/A ASN 46.A ND2 THR 460.A O no hydrogen 3.162 N/A VAL 48.A N ASN 46.A OD1 no hydrogen 3.159 N/A VAL 49.A N ASN 46.A OD1 no hydrogen 3.195 N/A LYS 50.A N ASN 46.A O no hydrogen 2.929 N/A LYS 50.A NZ ASP 57.A OD1 no hydrogen 3.350 N/A LEU 51.A N GLY 47.A O no hydrogen 3.023 N/A LEU 52.A N VAL 48.A O no hydrogen 3.349 N/A LEU 52.A N VAL 49.A O no hydrogen 3.100 N/A THR 53.A N LYS 50.A O no hydrogen 3.172 N/A THR 53.A OG1 VAL 49.A O no hydrogen 2.830 N/A TRP 56.A N THR 53.A O no hydrogen 3.222 N/A ASP 57.A N LYS 54.A O no hydrogen 2.930 N/A VAL 59.A N TRP 56.A O no hydrogen 3.285 N/A THR 63.A N VAL 59.A O no hydrogen 3.011 N/A THR 63.A OG1 VAL 59.A O no hydrogen 3.187 N/A GLN 64.A N PRO 60.A O no hydrogen 2.982 N/A MET 65.A N MET 61.A O no hydrogen 3.097 N/A ALA 66.A N VAL 62.A O no hydrogen 3.362 N/A MET 67.A N GLN 64.A O no hydrogen 3.148 N/A THR 68.A N GLN 64.A O no hydrogen 2.956 N/A ARG 70.A NH1 GLU 132.A OE2 no hydrogen 2.731 N/A PHE 72.A N MET 172.A O no hydrogen 2.596 N/A VAL 76.A N LYS 73.A O no hydrogen 3.245 N/A THR 78.A OG1 LYS 75.A O no hydrogen 2.692 N/A THR 80.A OG1 THR 248.A O no hydrogen 3.204 N/A ARG 82.A NE ASP 253.A OD2 no hydrogen 3.002 N/A ARG 82.A NH2 ASP 253.A OD1 no hydrogen 2.892 N/A LEU 84.A N ASP 392.A OD2 no hydrogen 2.749 N/A THR 87.A N LEU 342.A O no hydrogen 3.186 N/A THR 87.A OG1 ASP 392.A OD2 no hydrogen 2.619 N/A ARG 88.A N LEU 84.A O no hydrogen 2.990 N/A ARG 88.A NH1 PRO 83.A O no hydrogen 3.224 N/A LYS 89.A N PRO 85.A O no hydrogen 3.111 N/A LYS 89.A NZ LEU 347.A O no hydrogen 2.809 N/A VAL 90.A N GLY 86.A O no hydrogen 3.071 N/A MET 91.A N THR 87.A O no hydrogen 2.971 N/A GLU 92.A N ARG 88.A O no hydrogen 3.096 N/A ILE 93.A N LYS 89.A O no hydrogen 2.924 N/A THR 94.A N VAL 90.A O no hydrogen 2.932 N/A THR 94.A OG1 VAL 90.A O no hydrogen 2.641 N/A ALA 95.A N MET 91.A O no hydrogen 2.830 N/A GLU 96.A N GLU 92.A O no hydrogen 3.110 N/A TRP 97.A N ILE 93.A O no hydrogen 3.068 N/A LEU 98.A N THR 94.A O no hydrogen 2.762 N/A TRP 99.A N ALA 95.A O no hydrogen 2.887 N/A TRP 99.A NE1 ASN 257.A O no hydrogen 3.047 N/A ARG 100.A N GLU 96.A O no hydrogen 3.132 N/A ARG 100.A NH2.B GLU 357.A OE2.B no hydrogen 3.081 N/A THR 101.A N TRP 97.A O no hydrogen 2.983 N/A THR 101.A OG1 TRP 97.A O no hydrogen 2.961 N/A LEU 102.A N LEU 98.A O no hydrogen 2.920 N/A GLY 103.A N TRP 99.A O no hydrogen 3.053 N/A ARG 104.A N THR 101.A O no hydrogen 3.379 N/A ARG 104.A NH1 THR 101.A O no hydrogen 2.808 N/A ARG 104.A NH1 ASN 210.A O no hydrogen 2.851 N/A ARG 104.A NH2 GLU 209.A O no hydrogen 3.377 N/A ARG 104.A NH2 ASN 210.A O no hydrogen 3.495 N/A LYS 106.A NZ ASP 203.A O no hydrogen 2.966 N/A ARG 109.A NE ASP 203.A OD1 no hydrogen 3.360 N/A ARG 109.A NE ASP 203.A OD2 no hydrogen 2.947 N/A ARG 109.A NH1 LEU 110.A O no hydrogen 3.138 N/A ARG 109.A NH1 GLU 115.A OE1 no hydrogen 3.226 N/A ARG 109.A NH1 GLU 115.A OE2 no hydrogen 2.762 N/A ARG 109.A NH2 GLU 115.A OE1 no hydrogen 2.800 N/A ARG 109.A NH2 ASP 203.A OD1 no hydrogen 2.934 N/A CYS 111.A N GLU 195.A O no hydrogen 2.883 N/A THR 112.A N GLU 115.A OE2 no hydrogen 3.033 N/A THR 112.A OG1 GLU 114.A OE1 no hydrogen 3.523 N/A THR 112.A OG1 GLU 115.A OE2 no hydrogen 3.494 N/A ARG 113.A NH1 GLU 146.A OE1 no hydrogen 3.137 N/A ARG 113.A NH2 GLU 146.A OE2 no hydrogen 2.931 N/A GLU 115.A N THR 112.A OG1 no hydrogen 3.035 N/A PHE 116.A N THR 112.A O no hydrogen 3.141 N/A THR 117.A N ARG 113.A O no hydrogen 2.892 N/A THR 117.A OG1 ARG 113.A O no hydrogen 2.689 N/A LYS 118.A N GLU 114.A O no hydrogen 2.947 N/A LYS 119.A N GLU 115.A O no hydrogen 3.003 N/A LYS 119.A NZ GLU 202.A OE1 no hydrogen 3.362 N/A LYS 119.A NZ GLU 202.A OE2 no hydrogen 2.762 N/A VAL 120.A N PHE 116.A O no hydrogen 2.861 N/A ARG 121.A N THR 117.A O no hydrogen 2.970 N/A THR 122.A N LYS 118.A O no hydrogen 2.812 N/A THR 122.A OG1 LYS 118.A O no hydrogen 2.790 N/A THR 122.A OG1 LYS 119.A O no hydrogen 3.402 N/A ASN 123.A N LYS 119.A O no hydrogen 3.043 N/A ASN 123.A N VAL 120.A O no hydrogen 3.260 N/A ALA 124.A N VAL 120.A O no hydrogen 2.789 N/A MET 126.A N ASN 123.A O no hydrogen 3.178 N/A GLY 127.A N ALA 124.A O no hydrogen 3.124 N/A VAL 129.A N GLU 133.A OE1 no hydrogen 2.627 N/A PHE 130.A N GLU 133.A OE1 no hydrogen 3.321 N/A GLU 133.A N PHE 130.A O no hydrogen 3.284 N/A ASN 134.A N ASP 137.A O no hydrogen 3.166 N/A ALA 139.A N GLU 133.A OE2 no hydrogen 2.800 N/A ALA 142.A N SER 138.A O no hydrogen 3.195 N/A VAL 143.A N ALA 139.A O no hydrogen 2.979 N/A GLU 144.A N LYS 140.A O no hydrogen 3.303 N/A GLU 144.A N ALA 141.A O no hydrogen 3.181 N/A ASP 145.A N ALA 142.A O no hydrogen 3.112 N/A GLU 147.A N ASP 145.A OD1 no hydrogen 3.037 N/A TRP 149.A NE1 VAL 143.A O no hydrogen 2.749 N/A LYS 150.A N GLU 146.A O no hydrogen 3.062 N/A LYS 150.A NZ GLU 147.A OE2 no hydrogen 2.690 N/A LEU 151.A N GLU 147.A O no hydrogen 3.136 N/A VAL 152.A N PHE 148.A O no hydrogen 3.145 N/A ASP 153.A N TRP 149.A O no hydrogen 3.090 N/A ARG 154.A N LYS 150.A O no hydrogen 3.073 N/A GLU 155.A N LEU 151.A O no hydrogen 2.910 N/A ARG 156.A N VAL 152.A O no hydrogen 2.880 N/A ARG 156.A NE GLU 195.A OE1 no hydrogen 3.418 N/A ARG 156.A NE GLU 195.A OE2 no hydrogen 2.821 N/A ARG 156.A NH1 ASP 153.A OD2 no hydrogen 2.884 N/A ARG 156.A NH2 GLU 195.A OE1 no hydrogen 2.949 N/A GLU 157.A N ASP 153.A O no hydrogen 3.100 N/A LEU 158.A N ARG 154.A O no hydrogen 3.372 N/A HIS 159.A N GLU 155.A O no hydrogen 2.971 N/A LYS 160.A N ARG 156.A O no hydrogen 2.810 N/A LYS 160.A NZ GLU 157.A OE1 no hydrogen 3.177 N/A LYS 160.A NZ GLU 157.A OE2 no hydrogen 2.785 N/A LEU 161.A N GLU 157.A O no hydrogen 3.189 N/A LEU 161.A N LEU 158.A O no hydrogen 2.935 N/A GLY 162.A N HIS 159.A O no hydrogen 2.950 N/A LYS 163.A N LEU 158.A O no hydrogen 2.825 N/A CYS 164.A SG GLU 155.A OE1 no hydrogen 3.488 N/A CYS 164.A SG HIS 159.A NE2 no hydrogen 3.660 N/A GLY 165.A N GLU 155.A OE1 no hydrogen 2.811 N/A SER 166.A OG GLU 155.A OE2 no hydrogen 2.832 N/A CYS 167.A SG HIS 159.A NE2 no hydrogen 3.554 N/A TYR 169.A N VAL 285.A O no hydrogen 3.373 N/A MET 171.A N LYS 287.A O no hydrogen 2.939 N/A MET 172.A N ARG 70.A O no hydrogen 2.969 N/A GLY 173.A N GLN 289.A O no hydrogen 3.078 N/A LYS 175.A NZ GLU 132.A O no hydrogen 3.514 N/A LYS 175.A NZ GLU 132.A OE1 no hydrogen 3.093 N/A LYS 175.A NZ ASN 134.A OD1 no hydrogen 3.146 N/A LYS 175.A NZ ALA 176.A O no hydrogen 3.459 N/A TRP 183.A N SER 179.A O no hydrogen 3.102 N/A TYR 184.A N ARG 180.A O no hydrogen 2.886 N/A TYR 184.A OH ASP 145.A OD2 no hydrogen 2.857 N/A MET 185.A N ALA 181.A O no hydrogen 3.158 N/A TRP 186.A N ILE 182.A O no hydrogen 3.087 N/A LEU 187.A N TRP 183.A O no hydrogen 2.883 N/A GLY 188.A N TYR 184.A O no hydrogen 2.864 N/A VAL 189.A N MET 185.A O no hydrogen 3.007 N/A ARG 190.A N TRP 186.A O no hydrogen 3.008 N/A ARG 190.A NE GLU 193.A OE1 no hydrogen 2.949 N/A ARG 190.A NH1 VAL 168.A O no hydrogen 2.927 N/A ARG 190.A NH2 GLU 193.A OE1 no hydrogen 3.544 N/A ARG 190.A NH2 GLU 193.A OE2 no hydrogen 2.690 N/A TYR 191.A N LEU 187.A O no hydrogen 2.821 N/A TYR 191.A OH GLU 195.A OE1 no hydrogen 2.530 N/A LEU 192.A N GLY 188.A O no hydrogen 2.857 N/A GLU 193.A N VAL 189.A O no hydrogen 3.188 N/A PHE 194.A N ARG 190.A O no hydrogen 2.874 N/A GLU 195.A N TYR 191.A O no hydrogen 2.736 N/A ALA 196.A N LEU 192.A O no hydrogen 3.268 N/A LEU 197.A N GLU 193.A O no hydrogen 2.716 N/A GLY 198.A N PHE 194.A O no hydrogen 2.766 N/A LEU 200.A N LEU 197.A O no hydrogen 3.338 N/A ASN 201.A N GLY 198.A O no hydrogen 3.119 N/A GLU 202.A N GLY 198.A O no hydrogen 2.883 N/A ASP 203.A N PHE 199.A O no hydrogen 2.796 N/A HIS 204.A N ASN 201.A O no hydrogen 3.055 N/A HIS 204.A ND1 GLU 216.A OE1 no hydrogen 2.981 N/A TRP 205.A N LEU 200.A O no hydrogen 2.894 N/A SER 207.A N HIS 204.A O no hydrogen 3.275 N/A SER 207.A OG HIS 204.A O no hydrogen 3.284 N/A ARG 208.A N GLU 218.A OE2 no hydrogen 3.058 N/A ARG 208.A NH1 SER 213.A O no hydrogen 2.971 N/A ARG 208.A NH1 GLY 214.A O no hydrogen 3.202 N/A ARG 208.A NH1 MET 367.A O no hydrogen 3.063 N/A ARG 208.A NH2 MET 367.A O no hydrogen 2.801 N/A ASN 210.A N SER 207.A OG no hydrogen 2.922 N/A ASN 210.A ND2 LEU 102.A O no hydrogen 2.983 N/A ASN 210.A ND2 TRP 205.A O no hydrogen 2.740 N/A SER 211.A N SER 207.A O no hydrogen 2.888 N/A SER 211.A OG SER 207.A O no hydrogen 2.755 N/A TYR 212.A N ARG 208.A O no hydrogen 2.928 N/A SER 213.A N SER 211.A O no hydrogen 2.912 N/A SER 213.A OG LEU 364.A O no hydrogen 2.527 N/A GLY 214.A N SER 211.A OG no hydrogen 2.936 N/A GLU 216.A N PHE 206.A O no hydrogen 3.179 N/A GLU 218.A N VAL 215.A O no hydrogen 3.042 N/A LEU 220.A N HIS 507.A O no hydrogen 3.044 N/A LYS 222.A N GLY 219.A O no hydrogen 3.119 N/A LEU 223.A N LEU 220.A O no hydrogen 3.243 N/A ILE 226.A N LYS 222.A O no hydrogen 3.031 N/A LEU 227.A N LEU 223.A O no hydrogen 3.112 N/A ARG 228.A N GLY 224.A O no hydrogen 2.806 N/A ARG 228.A NH1 GLU 424.A OE1 no hydrogen 2.771 N/A ASP 229.A N TYR 225.A O no hydrogen 2.846 N/A ILE 230.A N ILE 226.A O no hydrogen 2.851 N/A SER 231.A N LEU 227.A O no hydrogen 2.918 N/A SER 231.A OG ARG 228.A O no hydrogen 2.479 N/A LYS 232.A N ASP 229.A O no hydrogen 3.265 N/A LYS 232.A NZ ASP 229.A OD1 no hydrogen 2.957 N/A ILE 233.A N ILE 230.A O no hydrogen 2.951 N/A GLY 236.A N PRO 378.A O no hydrogen 2.843 N/A ALA 237.A N ASP 381.A OD1 no hydrogen 2.844 N/A MET 238.A N TRP 409.A O no hydrogen 2.813 N/A TYR 239.A N VAL 376.A O no hydrogen 2.784 N/A TYR 239.A OH ASP 381.A OD1 no hydrogen 2.575 N/A ALA 244.A N VAL 396.A O no hydrogen 3.045 N/A TRP 246.A NE1 ASN 318.A OD1 no hydrogen 2.958 N/A THR 248.A N GLY 245.A O no hydrogen 3.024 N/A THR 248.A OG1 GLY 245.A O no hydrogen 2.683 N/A ARG 249.A N TRP 246.A O no hydrogen 2.908 N/A ARG 249.A NE GLY 394.A O no hydrogen 2.656 N/A ARG 249.A NH2 GLY 394.A O no hydrogen 3.385 N/A ILE 250.A N ASP 247.A O no hydrogen 3.472 N/A THR 251.A N ASP 254.A OD1 no hydrogen 3.069 N/A ASP 254.A N THR 251.A OG1 no hydrogen 3.084 N/A LEU 255.A N THR 251.A O no hydrogen 2.923 N/A HIS 256.A N GLU 252.A O no hydrogen 3.001 N/A ASN 257.A N ASP 253.A O no hydrogen 3.035 N/A ASN 257.A N ASP 254.A O no hydrogen 3.042 N/A GLU 258.A N ASP 254.A O no hydrogen 2.913 N/A GLU 259.A N LEU 255.A O no hydrogen 3.134 N/A LYS 260.A N ASN 257.A O no hydrogen 3.402 N/A LYS 260.A NZ GLU 92.A OE2 no hydrogen 3.467 N/A LYS 260.A NZ GLU 96.A OE2 no hydrogen 3.568 N/A ILE 261.A N GLU 258.A O no hydrogen 3.500 N/A ILE 262.A N GLU 259.A O no hydrogen 2.954 N/A GLN 263.A N LYS 260.A O no hydrogen 3.131 N/A GLN 264.A N ILE 261.A O no hydrogen 3.030 N/A MET 265.A N ILE 262.A O no hydrogen 3.085 N/A HIS 269.A NE2 ALA 196.A O no hydrogen 2.704 N/A ARG 270.A N ASP 266.A O no hydrogen 2.782 N/A GLN 271.A N PRO 267.A O no hydrogen 3.114 N/A ALA 273.A N HIS 269.A O no hydrogen 2.932 N/A ASN 274.A N ARG 270.A O no hydrogen 2.860 N/A ALA 275.A N GLN 271.A O no hydrogen 3.223 N/A ILE 276.A N LEU 272.A O no hydrogen 3.157 N/A PHE 277.A N ALA 273.A O no hydrogen 2.915 N/A LYS 278.A N ASN 274.A O no hydrogen 2.969 N/A LYS 278.A NZ GLU 259.A OE2 no hydrogen 3.096 N/A LEU 279.A N ALA 275.A O no hydrogen 2.946 N/A THR 280.A N ILE 276.A O no hydrogen 3.081 N/A THR 280.A OG1 ILE 276.A O no hydrogen 2.946 N/A TYR 281.A N ILE 276.A O no hydrogen 2.878 N/A GLN 282.A N PHE 277.A O no hydrogen 2.873 N/A GLN 282.A NE2 GLU 259.A OE1 no hydrogen 2.551 N/A ASN 283.A ND2 LYS 278.A O no hydrogen 2.965 N/A LYS 284.A N ARG 303.A O no hydrogen 3.110 N/A LYS 284.A NZ TYR 281.A O no hydrogen 2.772 N/A LYS 284.A NZ LYS 304.A O no hydrogen 3.360 N/A LYS 284.A NZ ASP 305.A O no hydrogen 2.874 N/A LYS 284.A NZ GLN 306.A O no hydrogen 3.055 N/A VAL 286.A N ILE 301.A O no hydrogen 2.800 N/A LYS 287.A N TYR 169.A O no hydrogen 3.131 N/A LYS 287.A NZ TYR 37.A OH no hydrogen 3.303 N/A VAL 288.A N ASP 299.A O no hydrogen 2.861 N/A GLN 289.A N MET 171.A O no hydrogen 3.215 N/A ARG 290.A N VAL 297.A O no hydrogen 2.799 N/A ARG 290.A NE ASP 299.A OD1 no hydrogen 3.345 N/A ARG 290.A NE ASP 299.A OD2 no hydrogen 2.731 N/A ARG 290.A NH1 ASP 23.A OD2 no hydrogen 3.268 N/A ARG 290.A NH1 ASP 299.A OD1 no hydrogen 2.980 N/A THR 292.A N GLY 295.A O no hydrogen 2.719 N/A THR 292.A OG1 GLY 295.A O no hydrogen 2.639 N/A VAL 297.A N ARG 290.A O no hydrogen 2.880 N/A MET 298.A N TYR 37.A O no hydrogen 2.922 N/A ASP 299.A N VAL 288.A O no hydrogen 2.746 N/A ILE 300.A N GLY 35.A O no hydrogen 2.949 N/A ILE 301.A N VAL 286.A O no hydrogen 2.904 N/A SER 302.A N ALA 32.A O no hydrogen 2.848 N/A SER 302.A OG HIS 34.A NE2 no hydrogen 3.248 N/A ARG 303.A N LYS 284.A O no hydrogen 3.386 N/A ARG 303.A NE ASP 305.A OD1 no hydrogen 2.896 N/A ARG 303.A NH1 THR 30.A OG1 no hydrogen 2.909 N/A ARG 303.A NH1 THR 78.A O no hydrogen 3.256 N/A ARG 303.A NH2 THR 78.A O no hydrogen 3.190 N/A ARG 303.A NH2 ASP 305.A OD1 no hydrogen 2.727 N/A GLN 306.A N ILE 250.A O no hydrogen 2.810 N/A GLN 306.A NE2 VAL 76.A O no hydrogen 2.896 N/A ARG 307.A N ASP 247.A O no hydrogen 2.955 N/A ARG 307.A NE ASN 318.A OD1 no hydrogen 2.737 N/A ARG 307.A NH1 GLU 258.A OE1 no hydrogen 2.629 N/A ARG 307.A NH1 GLU 258.A OE2 no hydrogen 3.424 N/A ARG 307.A NH2 GLU 258.A OE1 no hydrogen 3.381 N/A ARG 307.A NH2 GLU 258.A OE2 no hydrogen 2.612 N/A ARG 307.A NH2 ASN 318.A OD1 no hydrogen 2.899 N/A SER 309.A OG ASP 247.A OD2 no hydrogen 2.861 N/A SER 309.A OG ARG 307.A O no hydrogen 3.450 N/A GLN 311.A N GLY 308.A O no hydrogen 3.233 N/A GLN 311.A NE2 THR 280.A O no hydrogen 2.886 N/A VAL 312.A N GLU 193.A OE1 no hydrogen 2.778 N/A THR 314.A OG1 GLY 308.A O no hydrogen 2.906 N/A THR 314.A OG1 GLN 311.A O no hydrogen 2.724 N/A TYR 315.A OH SER 370.A OG no hydrogen 2.693 N/A LEU 317.A N GLY 313.A O no hydrogen 2.957 N/A ASN 318.A N THR 314.A O no hydrogen 2.753 N/A ASN 318.A ND2 ASP 247.A OD1 no hydrogen 2.887 N/A THR 319.A N TYR 315.A O no hydrogen 2.890 N/A THR 319.A OG1 TYR 315.A O no hydrogen 2.674 N/A PHE 320.A N GLY 316.A O no hydrogen 2.820 N/A THR 321.A N LEU 317.A O no hydrogen 2.993 N/A THR 321.A OG1 GLU 258.A OE2 no hydrogen 2.633 N/A THR 321.A OG1 LEU 317.A O no hydrogen 3.425 N/A ASN 322.A N ASN 318.A O no hydrogen 2.923 N/A ASN 322.A ND2 GLY 371.A O no hydrogen 2.890 N/A MET 323.A N THR 319.A O no hydrogen 2.964 N/A GLU 324.A N PHE 320.A O no hydrogen 2.981 N/A ALA 325.A N THR 321.A O no hydrogen 2.772 N/A GLN 326.A N ASN 322.A O no hydrogen 2.914 N/A GLN 326.A NE2 ASN 322.A OD1 no hydrogen 2.909 N/A LEU 327.A N MET 323.A O no hydrogen 3.130 N/A VAL 328.A N GLU 324.A O no hydrogen 3.210 N/A ARG 329.A N ALA 325.A O no hydrogen 2.986 N/A ARG 329.A NE PHE 383.A O no hydrogen 3.150 N/A ARG 329.A NE ALA 386.A O no hydrogen 3.019 N/A ARG 329.A NH1 ASP 241.A OD2 no hydrogen 2.777 N/A ARG 329.A NH2 PHE 383.A O no hydrogen 2.863 N/A ARG 329.A NH2 ALA 384.A O no hydrogen 3.497 N/A ARG 329.A NH2 SER 406.A OG no hydrogen 2.777 N/A GLN 330.A N GLN 326.A O no hydrogen 2.887 N/A MET 331.A N LEU 327.A O no hydrogen 2.927 N/A GLU 332.A N VAL 328.A O no hydrogen 3.035 N/A GLY 333.A N ARG 329.A O no hydrogen 2.924 N/A GLU 334.A N GLN 330.A O no hydrogen 3.055 N/A GLY 335.A N GLU 332.A O no hydrogen 3.040 N/A VAL 336.A N MET 331.A O no hydrogen 2.895 N/A THR 338.A N ASP 341.A OD1 no hydrogen 2.986 N/A ASP 341.A N THR 338.A O no hydrogen 3.171 N/A ASP 341.A N THR 338.A OG1 no hydrogen 3.157 N/A LEU 342.A N THR 338.A O no hydrogen 3.242 N/A GLU 343.A N LYS 339.A O no hydrogen 3.169 N/A ASN 344.A N ALA 340.A O no hydrogen 3.228 N/A ASN 344.A N ASP 341.A O no hydrogen 3.339 N/A HIS 346.A N ASN 344.A OD1 no hydrogen 2.808 N/A LYS 351.A NZ VAL 336.A O no hydrogen 2.766 N/A LYS 351.A NZ ASP 341.A OD1 no hydrogen 2.646 N/A LYS 351.A NZ ASP 341.A OD2 no hydrogen 3.449 N/A ILE 352.A N GLU 349.A O no hydrogen 2.873 N/A THR 353.A N GLU 349.A O no hydrogen 3.018 N/A GLN 354.A N LYS 350.A O no hydrogen 2.779 N/A TRP 355.A N LYS 351.A O no hydrogen 3.124 N/A TRP 355.A NE1 GLU 334.A OE1 no hydrogen 2.824 N/A LEU 356.A N ILE 352.A O no hydrogen 2.960 N/A GLU 357.A N THR 353.A O no hydrogen 2.903 N/A THR 358.A N GLN 354.A O no hydrogen 2.960 N/A THR 358.A OG1 GLN 354.A O no hydrogen 2.680 N/A LYS 359.A N TRP 355.A O no hydrogen 2.762 N/A GLY 360.A N TRP 355.A O no hydrogen 3.215 N/A GLY 360.A N LEU 356.A O no hydrogen 3.035 N/A ARG 363.A N LYS 359.A O no hydrogen 2.855 N/A ARG 363.A NE GLU 334.A OE2 no hydrogen 2.575 N/A ARG 363.A NH1 GLU 362.A OE2 no hydrogen 2.694 N/A ARG 363.A NH2 GLU 334.A OE1 no hydrogen 2.854 N/A LEU 364.A N GLY 360.A O no hydrogen 2.911 N/A LYS 365.A N VAL 361.A O no hydrogen 3.136 N/A LYS 365.A N GLU 362.A O no hydrogen 3.147 N/A ARG 366.A N ARG 363.A O no hydrogen 3.393 N/A ARG 366.A NE GLU 362.A OE1 no hydrogen 3.274 N/A ARG 366.A NE GLU 362.A OE2 no hydrogen 2.938 N/A ARG 366.A NH1 PRO 234.A O no hydrogen 2.829 N/A ARG 366.A NH1 LYS 377.A O no hydrogen 2.915 N/A ARG 366.A NH2 PRO 234.A O no hydrogen 2.851 N/A ARG 366.A NH2 GLU 362.A OE1 no hydrogen 3.048 N/A MET 367.A N LEU 364.A O no hydrogen 3.210 N/A ALA 368.A N VAL 375.A O no hydrogen 2.948 N/A ILE 369.A N SER 213.A O no hydrogen 2.764 N/A SER 370.A N ASP 373.A O no hydrogen 2.798 N/A SER 370.A OG TYR 315.A OH no hydrogen 2.693 N/A SER 370.A OG HIS 507.A NE2 no hydrogen 3.257 N/A GLY 371.A N THR 319.A OG1 no hydrogen 2.976 N/A ASP 373.A N SER 370.A O no hydrogen 2.975 N/A CYS 374.A SG ASP 241.A O no hydrogen 3.817 N/A VAL 375.A N ALA 368.A O no hydrogen 2.900 N/A VAL 376.A N TYR 239.A O no hydrogen 2.838 N/A LYS 377.A N ARG 366.A O no hydrogen 2.901 N/A LYS 377.A NZ ILE 233.A O no hydrogen 3.047 N/A LYS 377.A NZ GLY 236.A O no hydrogen 2.819 N/A ARG 382.A N ASP 380.A OD1 no hydrogen 3.111 N/A ARG 382.A NE ASP 380.A OD1 no hydrogen 2.906 N/A ARG 382.A NE ASP 380.A OD2 no hydrogen 3.406 N/A ARG 382.A NH2 ASP 380.A OD2 no hydrogen 2.820 N/A ALA 384.A N ASP 381.A O no hydrogen 3.103 N/A ASN 385.A N ARG 382.A O no hydrogen 3.081 N/A ALA 386.A N PHE 383.A O no hydrogen 3.102 N/A LEU 388.A N GLU 332.A OE1 no hydrogen 3.001 N/A ALA 389.A N GLU 332.A OE2 no hydrogen 2.770 N/A ASN 391.A N LEU 387.A O no hydrogen 3.040 N/A ASP 392.A N LEU 388.A O no hydrogen 3.060 N/A MET 393.A N ALA 389.A O no hydrogen 2.780 N/A GLY 394.A N ASN 391.A O no hydrogen 2.922 N/A LYS 395.A N LEU 390.A O no hydrogen 3.086 N/A LYS 395.A NZ ARG 249.A O no hydrogen 2.713 N/A LYS 395.A NZ ASP 254.A OD1 no hydrogen 2.643 N/A LYS 395.A NZ MET 393.A O no hydrogen 3.114 N/A ARG 397.A NH1 GLN 404.A O no hydrogen 2.829 N/A ARG 397.A NH1 SER 406.A OG no hydrogen 2.968 N/A ARG 397.A NH2 GLN 402.A O no hydrogen 2.936 N/A ARG 397.A NH2 GLN 404.A O no hydrogen 2.710 N/A LYS 398.A N ASP 242.A O no hydrogen 2.683 N/A GLN 404.A N PRO 401.A O no hydrogen 3.272 N/A SER 406.A N ALA 384.A O no hydrogen 2.797 N/A SER 406.A OG ASP 241.A OD1 no hydrogen 3.529 N/A SER 406.A OG ASP 241.A OD2 no hydrogen 2.524 N/A LYS 407.A NZ GLY 408.A O no hydrogen 2.906 N/A TRP 409.A N MET 238.A O no hydrogen 2.841 N/A GLN 414.A N ASP 411.A O no hydrogen 2.872 N/A VAL 415.A N TRP 412.A O no hydrogen 3.220 N/A PHE 417.A N HIS 420.A O no hydrogen 2.794 N/A CYS 418.A N ASP 373.A OD1 no hydrogen 2.903 N/A CYS 418.A SG HIS 507.A NE2 no hydrogen 3.176 N/A HIS 420.A N PHE 417.A O no hydrogen 2.976 N/A HIS 420.A ND1 CYS 418.A O no hydrogen 2.806 N/A HIS 420.A NE2 TYR 475.A OH no hydrogen 2.552 N/A HIS 421.A N CYS 437.A O no hydrogen 2.919 N/A HIS 423.A N VAL 435.A O no hydrogen 3.042 N/A LEU 425.A N LEU 433.A O no hydrogen 2.728 N/A MET 427.A N ARG 431.A O no hydrogen 2.713 N/A LYS 428.A NZ GLU 543.A O no hydrogen 2.815 N/A GLY 430.A N MET 427.A O no hydrogen 2.754 N/A ARG 431.A N ASP 429.A OD1 no hydrogen 3.041 N/A ARG 431.A NE ASP 429.A OD1 no hydrogen 3.137 N/A ARG 431.A NE ASP 429.A OD2 no hydrogen 3.214 N/A ARG 431.A NH1 ASP 535.A O no hydrogen 2.825 N/A ARG 431.A NH1 THR 537.A O no hydrogen 2.844 N/A ARG 431.A NH2 ASP 429.A OD2 no hydrogen 2.831 N/A ARG 431.A NH2 THR 537.A O no hydrogen 3.063 N/A LEU 433.A N LEU 425.A O no hydrogen 2.831 N/A VAL 434.A N TYR 225.A OH no hydrogen 3.247 N/A VAL 435.A N HIS 423.A O no hydrogen 2.809 N/A CYS 437.A N HIS 421.A O no hydrogen 2.722 N/A CYS 437.A SG HIS 421.A NE2 no hydrogen 3.422 N/A CYS 437.A SG HIS 423.A NE2 no hydrogen 3.726 N/A CYS 437.A SG ARG 438.A O no hydrogen 3.955 N/A ARG 438.A NE GLU 442.A OE1 no hydrogen 3.026 N/A ARG 438.A NH2 GLU 442.A OE1 no hydrogen 3.104 N/A GLN 440.A N CYS 556.A O no hydrogen 3.170 N/A GLN 440.A NE2 ASP 480.A OD2 no hydrogen 2.825 N/A GLU 442.A N PRO 439.A O no hydrogen 3.200 N/A ILE 444.A N GLN 440.A O no hydrogen 3.062 N/A GLY 445.A N ASP 441.A O no hydrogen 2.888 N/A ARG 446.A N GLU 442.A O no hydrogen 3.063 N/A ALA 447.A N LEU 443.A O no hydrogen 2.973 N/A ARG 448.A N ILE 444.A O no hydrogen 2.989 N/A ARG 448.A NH1 THR 53.A OG1 no hydrogen 2.978 N/A ARG 448.A NH1 ASP 57.A OD1 no hydrogen 3.186 N/A ARG 448.A NH2 ASP 57.A OD1 no hydrogen 2.815 N/A ILE 449.A N ARG 446.A O no hydrogen 3.036 N/A SER 450.A N MET 44.A O no hydrogen 2.727 N/A SER 456.A N GLU 459.A OE1 no hydrogen 2.755 N/A SER 456.A OG GLU 459.A OE1 no hydrogen 2.999 N/A THR 460.A N SER 456.A O no hydrogen 3.006 N/A THR 460.A OG1 SER 456.A O no hydrogen 3.054 N/A ALA 461.A N LEU 457.A O no hydrogen 2.836 N/A CYS 462.A N ARG 458.A O no hydrogen 3.165 N/A CYS 462.A SG ARG 458.A O no hydrogen 3.336 N/A CYS 462.A SG VAL 497.A O no hydrogen 3.356 N/A LEU 463.A N GLU 459.A O no hydrogen 3.162 N/A GLY 464.A N THR 460.A O no hydrogen 3.118 N/A LYS 465.A N ALA 461.A O no hydrogen 2.829 N/A LYS 465.A NZ PRO 493.A O no hydrogen 3.304 N/A LYS 465.A NZ VAL 494.A O no hydrogen 3.163 N/A LYS 465.A NZ TRP 496.A O no hydrogen 2.925 N/A ALA 466.A N CYS 462.A O no hydrogen 3.029 N/A TYR 467.A N LEU 463.A O no hydrogen 3.068 N/A TYR 467.A OH THR 502.A O no hydrogen 2.710 N/A ALA 468.A N GLY 464.A O no hydrogen 2.928 N/A GLN 469.A N LYS 465.A O no hydrogen 2.901 N/A MET 470.A N ALA 466.A O no hydrogen 2.914 N/A TRP 471.A N TYR 467.A O no hydrogen 2.999 N/A SER 472.A N ALA 468.A O no hydrogen 3.011 N/A SER 472.A OG GLN 469.A O no hydrogen 2.764 N/A LEU 473.A N GLN 469.A O no hydrogen 3.113 N/A LEU 473.A N MET 470.A O no hydrogen 3.094 N/A MET 474.A N MET 470.A O no hydrogen 2.835 N/A TYR 475.A N TRP 471.A O no hydrogen 2.743 N/A TYR 475.A OH HIS 420.A NE2 no hydrogen 2.552 N/A ARG 478.A N TYR 475.A O no hydrogen 2.996 N/A ARG 478.A NE ASP 553.A OD1 no hydrogen 2.679 N/A ARG 478.A NH1 ASP 553.A O no hydrogen 2.921 N/A ARG 478.A NH1 ASP 553.A OD1 no hydrogen 3.194 N/A ARG 478.A NH2 ARG 438.A O no hydrogen 3.127 N/A ARG 478.A NH2 CYS 556.A O no hydrogen 3.414 N/A ARG 479.A N ASP 553.A OD2 no hydrogen 3.032 N/A ARG 479.A NH1 LEU 548.A O no hydrogen 2.778 N/A ARG 479.A NH1 ASP 553.A OD2 no hydrogen 2.833 N/A ARG 479.A NH2 LEU 548.A O no hydrogen 3.097 N/A ARG 482.A N ARG 478.A O no hydrogen 2.962 N/A ARG 482.A NE PHE 476.A O no hydrogen 2.776 N/A ARG 482.A NH1 TRP 542.A O no hydrogen 2.997 N/A ARG 482.A NH1 VAL 545.A O no hydrogen 3.155 N/A ARG 482.A NH2 PHE 476.A O no hydrogen 2.907 N/A ARG 482.A NH2 VAL 545.A O no hydrogen 2.826 N/A LEU 483.A N ARG 479.A O no hydrogen 3.085 N/A ALA 484.A N ASP 480.A O no hydrogen 2.838 N/A SER 485.A N LEU 481.A O no hydrogen 2.789 N/A SER 485.A OG ALA 468.A O no hydrogen 2.638 N/A ASN 486.A N ARG 482.A O no hydrogen 2.962 N/A ALA 487.A N LEU 483.A O no hydrogen 2.918 N/A ILE 488.A N ALA 484.A O no hydrogen 2.818 N/A CYS 489.A N SER 485.A O no hydrogen 2.983 N/A CYS 489.A SG SER 485.A O no hydrogen 3.355 N/A SER 490.A N ASN 486.A O no hydrogen 3.088 N/A SER 490.A OG ASN 486.A O no hydrogen 2.780 N/A ALA 491.A N ALA 487.A O no hydrogen 3.066 N/A ALA 491.A N ILE 488.A O no hydrogen 3.160 N/A VAL 492.A N ILE 488.A O no hydrogen 3.099 N/A VAL 494.A N GLU 587.A O no hydrogen 3.058 N/A TRP 496.A N PRO 493.A O no hydrogen 3.086 N/A ARG 501.A N MET 126.A O no hydrogen 3.112 N/A ARG 501.A NE THR 503.A O no hydrogen 3.210 N/A SER 505.A N THR 503.A OG1 no hydrogen 3.018 N/A HIS 507.A N SER 505.A OG no hydrogen 3.076 N/A ALA 508.A N SER 505.A O no hydrogen 3.280 N/A TRP 512.A NE1 THR 502.A OG1 no hydrogen 3.025 N/A MET 513.A N HIS 510.A O no hydrogen 2.924 N/A GLU 516.A N THR 514.A OG1 no hydrogen 3.079 N/A THR 520.A OG1 ASP 517.A OD1 no hydrogen 2.653 N/A VAL 521.A N ASP 517.A O no hydrogen 3.088 N/A TRP 522.A N MET 518.A O no hydrogen 2.762 N/A ASN 523.A N LEU 519.A O no hydrogen 2.964 N/A ASN 523.A ND2 LEU 519.A O no hydrogen 2.840 N/A ASN 523.A ND2 VAL 539.A O no hydrogen 2.780 N/A ARG 524.A N THR 520.A O no hydrogen 3.014 N/A ARG 524.A NH1 GLU 516.A OE1 no hydrogen 2.726 N/A ARG 524.A NH2 GLU 516.A OE2 no hydrogen 2.850 N/A VAL 525.A N VAL 521.A O no hydrogen 2.900 N/A TRP 526.A N TRP 522.A O no hydrogen 2.891 N/A TRP 526.A NE1 LEU 473.A O no hydrogen 2.665 N/A ILE 527.A N ASN 523.A O no hydrogen 3.007 N/A GLU 528.A N ASN 523.A O no hydrogen 2.814 N/A GLU 529.A N ARG 524.A O no hydrogen 2.757 N/A ASN 530.A N ILE 527.A O no hydrogen 3.382 N/A ASN 530.A ND2 TYR 225.A OH no hydrogen 3.012 N/A ASN 530.A ND2 TRP 526.A O no hydrogen 2.889 N/A TRP 532.A N ASN 530.A OD1 no hydrogen 2.891 N/A TRP 532.A NE1 ASP 229.A OD2 no hydrogen 2.834 N/A MET 533.A N ASN 530.A O no hydrogen 3.052 N/A LYS 536.A NZ ILE 527.A O no hydrogen 2.819 N/A LYS 536.A NZ GLU 528.A O no hydrogen 3.080 N/A LYS 536.A NZ MET 533.A O no hydrogen 2.774 N/A THR 537.A N ASP 535.A OD2 no hydrogen 2.998 N/A THR 537.A OG1 ASP 535.A OD1 no hydrogen 3.534 N/A THR 537.A OG1 ASP 535.A OD2 no hydrogen 2.568 N/A VAL 539.A N ASN 523.A OD1 no hydrogen 2.800 N/A GLU 543.A N THR 541.A OG1 no hydrogen 3.366 N/A ASN 544.A N THR 541.A O no hydrogen 3.005 N/A VAL 545.A N TRP 542.A O no hydrogen 2.835 N/A LEU 548.A N HIS 477.A O no hydrogen 2.803 N/A ARG 551.A NE.A GLU 552.A OE1 no hydrogen 2.895 N/A ARG 551.A NH2.A GLU 552.A OE1 no hydrogen 2.726 N/A ASP 553.A N GLY 549.A O no hydrogen 2.889 N/A GLN 554.A N LYS 550.A O no hydrogen 3.080 N/A GLN 554.A NE2 ILE 560.A O no hydrogen 3.041 N/A TRP 555.A N ARG 551.A O no hydrogen 2.901 N/A CYS 556.A N GLU 552.A O no hydrogen 3.103 N/A CYS 556.A N ASP 553.A O no hydrogen 3.169 N/A CYS 556.A SG HIS 421.A NE2 no hydrogen 3.527 N/A CYS 556.A SG HIS 423.A NE2 no hydrogen 4.048 N/A CYS 556.A SG GLU 552.A O no hydrogen 3.314 N/A GLY 557.A N GLN 554.A O no hydrogen 3.174 N/A SER 558.A N ASP 553.A O no hydrogen 3.017 N/A SER 558.A OG ASP 480.A OD1 no hydrogen 3.368 N/A SER 558.A OG ASP 480.A OD2 no hydrogen 3.359 N/A LEU 559.A N ASP 480.A OD2 no hydrogen 2.791 N/A ILE 560.A N SER 558.A OG no hydrogen 3.308 N/A LEU 562.A N LEU 559.A O no hydrogen 3.126 N/A ARG 565.A NE ASP 480.A OD1 no hydrogen 2.831 N/A ARG 565.A NH2 ASP 480.A OD1 no hydrogen 3.114 N/A ALA 566.A N LEU 562.A O no hydrogen 3.115 N/A THR 567.A N THR 563.A O no hydrogen 2.809 N/A THR 567.A OG1 THR 563.A O no hydrogen 2.964 N/A TRP 568.A N SER 564.A O no hydrogen 3.147 N/A TRP 568.A NE1 LEU 52.A O no hydrogen 2.946 N/A ALA 569.A N ARG 565.A O no hydrogen 2.894 N/A GLN 570.A N ALA 566.A O no hydrogen 3.139 N/A ASN 571.A N THR 567.A O no hydrogen 3.081 N/A THR 574.A N ASN 571.A O no hydrogen 3.269 N/A ILE 576.A N ILE 572.A O no hydrogen 2.975 N/A GLN 577.A N PRO 573.A O no hydrogen 2.954 N/A GLN 578.A N THR 574.A O no hydrogen 3.040 N/A VAL 579.A N ALA 575.A O no hydrogen 3.093 N/A ARG 580.A N ILE 576.A O no hydrogen 2.882 N/A ARG 580.A NE SER 490.A O no hydrogen 2.796 N/A ARG 580.A NH1 ASP 590.A OD1.B no hydrogen 3.473 N/A ARG 580.A NH2 SER 490.A O no hydrogen 2.796 N/A ARG 580.A NH2 ASP 590.A OD1.B no hydrogen 2.946 N/A SER 581.A N GLN 577.A O no hydrogen 2.914 N/A SER 581.A OG GLN 577.A O no hydrogen 3.119 N/A LEU 582.A N GLN 578.A O no hydrogen 3.241 N/A ILE 583.A N VAL 579.A O no hydrogen 3.048 N/A GLY 584.A N ARG 580.A O no hydrogen 2.911 N/A TYR 591.A N SER 490.A OG no hydrogen 2.813 N/A