Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s3s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 8.A N HIS 44.A O no hydrogen 2.714 N/A ARG 9.A N HIS 44.A O no hydrogen 3.132 N/A ASP 11.A N THR 42.A O no hydrogen 2.816 N/A GLU 13.A N ASP 11.A OD1 no hydrogen 2.847 N/A ASN 17.A N GLU 13.A O no hydrogen 2.899 N/A ASN 17.A ND2 LEU 12.A O no hydrogen 2.744 N/A ASN 17.A ND2 TRP 40.A O no hydrogen 2.872 N/A GLY 18.A N LEU 14.A O no hydrogen 2.870 N/A ARG 19.A N GLU 15.A O no hydrogen 3.410 N/A ASP 20.A N THR 16.A O no hydrogen 3.330 N/A HIS 21.A N ASN 17.A O no hydrogen 2.898 N/A HIS 21.A NE2 PRO 38.A O no hydrogen 2.811 N/A HIS 22.A N ARG 19.A O no hydrogen 3.346 N/A THR 23.A N GLY 18.A O no hydrogen 2.816 N/A THR 23.A OG1 GLY 18.A O no hydrogen 3.543 N/A THR 23.A OG1 VAL 32.A O no hydrogen 2.631 N/A LEU 26.A N THR 23.A O no hydrogen 2.711 N/A CYS 27.A N ALA 24.A O no hydrogen 3.173 N/A CYS 27.A SG THR 23.A O no hydrogen 3.601 N/A CYS 27.A SG THR 23.A OG1 no hydrogen 3.511 N/A CYS 27.A SG LYS 30.A O no hydrogen 4.032 N/A CYS 27.A SG VAL 32.A O no hydrogen 3.345 N/A VAL 33.A N ILE 136.A O no hydrogen 2.912 N/A ARG 34.A N HIS 21.A ND1 no hydrogen 3.114 N/A ARG 34.A NE HIS 21.A O no hydrogen 2.824 N/A ARG 34.A NH1 PHE 139.A O no hydrogen 3.065 N/A ARG 34.A NH2 HIS 22.A O no hydrogen 2.978 N/A ARG 35.A N LEU 138.A O no hydrogen 3.023 N/A ARG 35.A NE ASP 146.A OD2 no hydrogen 2.777 N/A ARG 35.A NH1 ALA 110.A O no hydrogen 2.913 N/A ARG 35.A NH1 SER 215.A O no hydrogen 2.820 N/A ARG 35.A NH2 ASP 146.A OD1 no hydrogen 2.956 N/A ARG 35.A NH2 SER 215.A O no hydrogen 3.293 N/A GLY 36.A N THR 106.A OG1 no hydrogen 2.998 N/A GLN 37.A NE2 ASP 20.A O no hydrogen 2.935 N/A PHE 39.A N LEU 104.A O no hydrogen 2.784 N/A TRP 40.A N ASN 17.A OD1 no hydrogen 2.790 N/A TRP 40.A NE1 GLN 103.A OE1 no hydrogen 2.672 N/A LEU 41.A N LEU 102.A O no hydrogen 3.221 N/A THR 42.A N ASP 11.A O no hydrogen 2.933 N/A THR 42.A OG1 GLU 13.A OE2 no hydrogen 2.755 N/A THR 42.A OG1 SER 101.A OG no hydrogen 3.162 N/A LEU 43.A N LEU 100.A O no hydrogen 2.849 N/A HIS 44.A N ARG 9.A O no hydrogen 2.912 N/A PHE 45.A N CYS 98.A O no hydrogen 3.133 N/A GLU 46.A N VAL 6.A O no hydrogen 2.645 N/A ARG 48.A NE GLU 3.A O no hydrogen 2.942 N/A ARG 48.A NH1 ASP 55.A OD1 no hydrogen 2.818 N/A ARG 48.A NH2 GLU 3.A O no hydrogen 2.906 N/A ARG 48.A NH2 ASP 55.A OD1 no hydrogen 3.349 N/A ARG 48.A NH2 ASP 55.A OD2 no hydrogen 2.653 N/A ASN 49.A ND2 GLN 96.A O no hydrogen 2.782 N/A ASN 49.A ND2 ASP 97.A O no hydrogen 3.181 N/A ASN 49.A ND2 THR 99.A O no hydrogen 2.892 N/A TYR 50.A N ASN 49.A OD1 no hydrogen 2.716 N/A GLU 51.A N ASP 55.A OD1 no hydrogen 3.043 N/A VAL 54.A N GLU 51.A O no hydrogen 2.922 N/A ASP 55.A N GLU 51.A O no hydrogen 2.751 N/A SER 56.A N SER 122.A O no hydrogen 2.709 N/A THR 58.A N GLU 120.A O no hydrogen 2.805 N/A PHE 59.A N PHE 77.A O no hydrogen 2.750 N/A SER 60.A N SER 118.A O no hydrogen 3.059 N/A VAL 61.A N ALA 75.A O no hydrogen 2.946 N/A VAL 62.A N ARG 116.A O no hydrogen 3.126 N/A THR 63.A N THR 73.A O no hydrogen 3.002 N/A THR 63.A OG1 LEU 114.A O no hydrogen 2.795 N/A SER 68.A N THR 73.A OG1 no hydrogen 2.888 N/A ALA 71.A N SER 68.A OG no hydrogen 2.954 N/A GLY 72.A N GLN 69.A O no hydrogen 3.079 N/A THR 73.A N SER 68.A O no hydrogen 3.041 N/A THR 73.A OG1 SER 68.A O no hydrogen 3.267 N/A ALA 75.A N VAL 61.A O no hydrogen 3.038 N/A PHE 77.A N PHE 59.A O no hydrogen 2.848 N/A LEU 79.A N LEU 57.A O no hydrogen 2.893 N/A ARG 80.A N ALA 90.A O no hydrogen 3.274 N/A ASP 87.A N GLU 84.A O no hydrogen 3.279 N/A THR 89.A N THR 105.A O no hydrogen 3.098 N/A THR 91.A N GLN 103.A O no hydrogen 2.832 N/A THR 91.A OG1 ARG 80.A O no hydrogen 2.528 N/A THR 91.A OG1 ASP 81.A O no hydrogen 3.546 N/A VAL 93.A N SER 101.A O no hydrogen 2.954 N/A GLN 95.A NE2 TYR 50.A O no hydrogen 2.763 N/A GLN 96.A N THR 99.A O no hydrogen 3.230 N/A GLN 96.A NE2 ASP 94.A OD1 no hydrogen 2.794 N/A GLN 96.A NE2 ASP 94.A OD2 no hydrogen 3.383 N/A LEU 100.A N LEU 43.A O no hydrogen 2.798 N/A SER 101.A N ASP 94.A O no hydrogen 2.853 N/A SER 101.A OG THR 42.A OG1 no hydrogen 3.162 N/A LEU 102.A N LEU 41.A O no hydrogen 2.746 N/A GLN 103.A N THR 91.A O no hydrogen 2.727 N/A LEU 104.A N PHE 39.A O no hydrogen 2.877 N/A THR 105.A N THR 89.A O no hydrogen 3.084 N/A THR 106.A OG1 PRO 107.A O no hydrogen 3.313 N/A ALA 110.A N PRO 107.A O no hydrogen 3.325 N/A ILE 112.A N ARG 214.A O no hydrogen 3.243 N/A GLY 113.A N LEU 137.A O no hydrogen 2.907 N/A TYR 115.A N PHE 135.A O no hydrogen 2.813 N/A TYR 115.A OH PRO 111.A O no hydrogen 2.916 N/A ARG 116.A N VAL 62.A O no hydrogen 3.001 N/A LEU 117.A N GLY 133.A O no hydrogen 2.699 N/A SER 118.A N SER 60.A O no hydrogen 2.773 N/A LEU 119.A N PHE 130.A O no hydrogen 2.750 N/A GLU 120.A N THR 58.A O no hydrogen 2.746 N/A ALA 121.A N SER 128.A O no hydrogen 3.163 N/A SER 122.A N SER 56.A O no hydrogen 2.820 N/A SER 122.A OG GLN 126.A O no hydrogen 3.038 N/A THR 123.A N GLN 126.A O no hydrogen 3.123 N/A THR 123.A OG1 ASP 55.A OD2 no hydrogen 2.764 N/A SER 128.A N ALA 121.A O no hydrogen 2.981 N/A PHE 130.A N LEU 119.A O no hydrogen 2.887 N/A LEU 132.A N LEU 117.A O no hydrogen 2.886 N/A GLY 133.A N LEU 117.A O no hydrogen 3.206 N/A PHE 135.A N TYR 115.A O no hydrogen 3.091 N/A ILE 136.A N LEU 31.A O no hydrogen 2.959 N/A LEU 137.A N GLY 113.A O no hydrogen 2.725 N/A LEU 138.A N VAL 33.A O no hydrogen 2.783 N/A PHE 139.A N LEU 266.A O no hydrogen 3.046 N/A ASN 140.A N ASP 146.A OD2 no hydrogen 2.800 N/A ASN 140.A ND2 ARG 35.A O no hydrogen 3.035 N/A ASN 140.A ND2 GLN 37.A OE1 no hydrogen 2.842 N/A TRP 142.A N ASN 140.A OD1 no hydrogen 3.000 N/A TRP 142.A NE1 GLU 153.A OE2 no hydrogen 3.095 N/A CYS 143.A N ASN 140.A O no hydrogen 3.187 N/A CYS 143.A SG GLY 36.A O no hydrogen 3.622 N/A ASP 146.A N CYS 143.A O no hydrogen 2.905 N/A VAL 148.A N ASP 146.A OD1 no hydrogen 2.970 N/A TYR 149.A N ASP 146.A O no hydrogen 2.799 N/A LEU 150.A N ALA 141.A O no hydrogen 3.154 N/A GLU 155.A N SER 152.A OG no hydrogen 3.266 N/A ARG 156.A N SER 152.A O no hydrogen 3.010 N/A ARG 156.A NE GLU 153.A OE2 no hydrogen 3.138 N/A ARG 156.A NH1 LEU 150.A O no hydrogen 2.744 N/A ARG 156.A NH2 GLU 153.A OE2 no hydrogen 2.829 N/A GLN 157.A N GLU 153.A O no hydrogen 2.910 N/A GLN 157.A NE2 GLU 153.A OE1 no hydrogen 2.687 N/A GLU 158.A N GLU 154.A O no hydrogen 3.142 N/A TYR 159.A N GLU 155.A O no hydrogen 2.840 N/A VAL 160.A N ARG 156.A O no hydrogen 3.141 N/A LEU 161.A N ARG 156.A O no hydrogen 3.439 N/A THR 162.A N GLN 157.A O no hydrogen 2.745 N/A THR 162.A OG1 GLN 157.A O no hydrogen 2.552 N/A GLN 164.A NE2 ASN 181.A OD1 no hydrogen 2.818 N/A GLY 165.A N TRP 180.A O no hydrogen 2.966 N/A ILE 167.A N ILE 178.A O no hydrogen 2.818 N/A GLN 169.A N LYS 176.A O no hydrogen 2.678 N/A SER 171.A N PHE 174.A O no hydrogen 3.051 N/A LYS 173.A N SER 171.A OG no hydrogen 3.244 N/A PHE 174.A N SER 171.A OG no hydrogen 2.982 N/A LYS 176.A N GLN 169.A O no hydrogen 2.607 N/A ASN 177.A ND2 ASN 177.A O no hydrogen 2.371 N/A ILE 178.A N ILE 167.A O no hydrogen 2.943 N/A TRP 180.A N GLY 165.A O no hydrogen 2.891 N/A TRP 180.A NE1 SER 242.A OG no hydrogen 3.042 N/A ASN 181.A N ILE 240.A O no hydrogen 2.861 N/A ASN 181.A ND2 GLU 186.A OE2 no hydrogen 3.120 N/A GLY 183.A N GLN 163.A O no hydrogen 3.069 N/A GLN 184.A N GLN 184.A OE1 no hydrogen 2.782 N/A GLN 184.A NE2 VAL 160.A O no hydrogen 2.774 N/A GLN 184.A NE2 THR 162.A O no hydrogen 2.914 N/A PHE 185.A N GLN 163.A OE1 no hydrogen 2.931 N/A GLU 186.A N GLY 183.A O no hydrogen 3.155 N/A ILE 189.A N GLU 186.A O no hydrogen 3.015 N/A ILE 192.A N GLY 188.A O no hydrogen 3.057 N/A CYS 193.A N ILE 189.A O no hydrogen 2.945 N/A CYS 193.A SG ILE 189.A O no hydrogen 3.256 N/A LEU 194.A N LEU 190.A O no hydrogen 3.065 N/A ILE 195.A N ASP 191.A O no hydrogen 3.029 N/A LEU 196.A N ILE 192.A O no hydrogen 2.918 N/A LEU 197.A N CYS 193.A O no hydrogen 3.195 N/A ASP 198.A N LEU 194.A O no hydrogen 2.966 N/A VAL 199.A N ILE 195.A O no hydrogen 2.977 N/A VAL 199.A N LEU 196.A O no hydrogen 3.412 N/A ASN 200.A N LEU 197.A O no hydrogen 3.142 N/A ASN 200.A ND2 LEU 197.A O no hydrogen 2.791 N/A ASN 200.A ND2 ASP 210.A OD2 no hydrogen 3.024 N/A LYS 202.A N ASN 200.A OD1 no hydrogen 2.896 N/A LEU 204.A N ASN 200.A O no hydrogen 3.292 N/A LYS 205.A N PRO 201.A O no hydrogen 3.003 N/A ASN 206.A N LYS 202.A O no hydrogen 2.929 N/A ASN 206.A N PHE 203.A O no hydrogen 3.120 N/A ARG 209.A N ASN 206.A OD1 no hydrogen 3.404 N/A ASP 210.A N ASN 206.A O no hydrogen 2.891 N/A CYS 211.A N ALA 207.A O no hydrogen 2.902 N/A CYS 211.A SG ALA 207.A O no hydrogen 3.455 N/A SER 212.A N GLY 208.A O no hydrogen 3.058 N/A SER 212.A OG ALA 71.A O no hydrogen 2.577 N/A ARG 213.A N ARG 209.A O no hydrogen 2.806 N/A ARG 214.A N CYS 211.A O no hydrogen 3.345 N/A ARG 214.A NE ASP 210.A OD1 no hydrogen 2.948 N/A ARG 214.A NH1 ASP 198.A OD1 no hydrogen 2.992 N/A ARG 214.A NH2 ASP 198.A OD1 no hydrogen 2.952 N/A ARG 214.A NH2 ASP 210.A OD1 no hydrogen 2.667 N/A SER 215.A N SER 212.A O no hydrogen 3.297 N/A SER 215.A OG SER 212.A O no hydrogen 3.385 N/A SER 216.A N ARG 213.A O no hydrogen 3.069 N/A TYR 219.A N SER 216.A OG no hydrogen 3.066 N/A TYR 219.A OH ASP 210.A OD2 no hydrogen 2.488 N/A VAL 220.A N SER 216.A O no hydrogen 2.906 N/A GLY 221.A N PRO 217.A O no hydrogen 2.839 N/A ARG 222.A N VAL 218.A O no hydrogen 2.961 N/A ARG 222.A NH1 GLY 326.A O no hydrogen 2.975 N/A ARG 222.A NH1 ASP 343.A OD2 no hydrogen 2.966 N/A VAL 223.A N TYR 219.A O no hydrogen 2.998 N/A VAL 224.A N VAL 220.A O no hydrogen 3.055 N/A SER 225.A N GLY 221.A O no hydrogen 3.052 N/A SER 225.A OG ARG 222.A O no hydrogen 2.769 N/A SER 225.A OG CYS 325.A O no hydrogen 3.540 N/A GLY 226.A N ARG 222.A O no hydrogen 3.328 N/A MET 227.A N VAL 223.A O no hydrogen 3.053 N/A MET 227.A N VAL 224.A O no hydrogen 3.094 N/A VAL 228.A N VAL 224.A O no hydrogen 3.265 N/A CYS 230.A N LEU 236.A O no hydrogen 2.854 N/A CYS 230.A SG GLY 234.A O no hydrogen 3.716 N/A ASN 231.A ND2 ASN 229.A O no hydrogen 3.371 N/A GLY 234.A N ASP 232.A O no hydrogen 2.774 N/A VAL 235.A N MET 227.A O no hydrogen 3.149 N/A VAL 235.A N VAL 228.A O no hydrogen 3.240 N/A LEU 236.A N VAL 228.A O no hydrogen 2.807 N/A SER 242.A N ASN 181.A O no hydrogen 2.982 N/A SER 242.A OG ALA 257.A O no hydrogen 3.102 N/A SER 242.A OG THR 261.A OG1 no hydrogen 2.763 N/A LEU 246.A N SER 242.A O no hydrogen 3.106 N/A ARG 247.A N VAL 243.A O no hydrogen 2.899 N/A ARG 247.A NE ASP 187.A O no hydrogen 3.391 N/A ARG 247.A NH2 ASP 187.A O no hydrogen 2.670 N/A ARG 248.A N ASP 244.A O no hydrogen 3.024 N/A TRP 249.A N ILE 245.A O no hydrogen 3.100 N/A TRP 249.A NE1 GLN 233.A O no hydrogen 3.358 N/A LYS 250.A N LEU 246.A O no hydrogen 3.127 N/A ASN 251.A N ARG 247.A O no hydrogen 3.352 N/A PHE 255.A N CYS 252.A O no hydrogen 3.412 N/A ALA 257.A N TRP 253.A O no hydrogen 3.046 N/A VAL 258.A N VAL 254.A O no hydrogen 3.057 N/A ALA 259.A N PHE 255.A O no hydrogen 3.144 N/A CYS 260.A N ALA 256.A O no hydrogen 2.990 N/A CYS 260.A SG THR 270.A O no hydrogen 3.931 N/A THR 261.A N ALA 257.A O no hydrogen 3.136 N/A THR 261.A OG1 PHE 182.A O no hydrogen 2.809 N/A THR 261.A OG1 SER 242.A OG no hydrogen 2.763 N/A THR 261.A OG1 ALA 257.A O no hydrogen 3.263 N/A VAL 262.A N VAL 258.A O no hydrogen 3.061 N/A LEU 263.A N ALA 259.A O no hydrogen 2.886 N/A ARG 264.A N CYS 260.A O no hydrogen 2.850 N/A ARG 264.A NE THR 270.A O no hydrogen 2.833 N/A ARG 264.A NH1 THR 162.A O no hydrogen 3.095 N/A ARG 264.A NH2 THR 270.A O no hydrogen 2.859 N/A CYS 265.A N THR 261.A O no hydrogen 2.988 N/A CYS 265.A SG GLN 184.A O no hydrogen 3.286 N/A LEU 266.A N VAL 262.A O no hydrogen 3.162 N/A GLY 267.A N LEU 263.A O no hydrogen 3.103 N/A GLY 267.A N ARG 264.A O no hydrogen 3.117 N/A ILE 268.A N LEU 263.A O no hydrogen 2.964 N/A THR 270.A N TYR 159.A O no hydrogen 2.936 N/A THR 270.A OG1 ILE 268.A O no hydrogen 2.788 N/A THR 270.A OG1 SER 302.A OG no hydrogen 2.780 N/A ARG 271.A N GLU 301.A O no hydrogen 2.931 N/A ARG 271.A NE GLU 301.A OE1 no hydrogen 2.948 N/A ARG 271.A NH1 TYR 159.A OH no hydrogen 3.046 N/A ARG 271.A NH2 GLU 301.A OE1 no hydrogen 3.010 N/A VAL 273.A N TRP 299.A O no hydrogen 2.957 N/A THR 274.A N SER 374.A O no hydrogen 2.948 N/A THR 274.A OG1 TYR 168.A O no hydrogen 2.566 N/A ASN 275.A N HIS 297.A O no hydrogen 2.804 N/A ASN 275.A ND2 ASN 277.A OD1 no hydrogen 3.030 N/A TYR 276.A N LEU 371.A O no hydrogen 3.142 N/A TYR 276.A OH GLN 169.A O no hydrogen 2.762 N/A ASN 277.A N ASN 295.A O no hydrogen 2.786 N/A ASN 277.A ND2 TRP 294.A O no hydrogen 2.834 N/A SER 278.A N ILE 368.A O no hydrogen 2.908 N/A HIS 280.A N SER 366.A O no hydrogen 2.743 N/A SER 281.A OG GLU 286.A OE2 no hydrogen 3.450 N/A GLU 286.A N ASN 282.A O no hydrogen 3.006 N/A TYR 287.A N LEU 283.A O no hydrogen 2.640 N/A PHE 288.A N LEU 284.A O no hydrogen 3.195 N/A ARG 289.A N ILE 285.A O no hydrogen 3.182 N/A ARG 289.A N GLU 286.A O no hydrogen 3.309 N/A ASN 295.A ND2 GLY 170.A O no hydrogen 2.849 N/A HIS 297.A N ASN 275.A O no hydrogen 2.832 N/A HIS 297.A NE2 ASP 320.A OD2 no hydrogen 2.880 N/A CYS 298.A SG TYR 168.A O no hydrogen 4.017 N/A CYS 298.A SG THR 274.A OG1 no hydrogen 3.353 N/A TRP 299.A N VAL 273.A O no hydrogen 2.965 N/A TRP 299.A NE1 TYR 390.A OH no hydrogen 2.867 N/A VAL 300.A N LEU 319.A O no hydrogen 3.030 N/A GLU 301.A N ARG 271.A O no hydrogen 2.979 N/A SER 302.A N GLN 317.A O no hydrogen 2.931 N/A SER 302.A OG THR 270.A OG1 no hydrogen 2.780 N/A TRP 303.A N PRO 269.A O no hydrogen 2.916 N/A TRP 303.A NE1 TYR 149.A O no hydrogen 2.903 N/A MET 304.A N GLY 315.A O no hydrogen 3.054 N/A THR 305.A N ALA 147.A O no hydrogen 2.988 N/A ARG 306.A NE ASP 308.A OD1 no hydrogen 2.868 N/A ARG 306.A NE ASP 308.A OD2 no hydrogen 3.396 N/A ARG 306.A NH1 GLN 317.A OE1 no hydrogen 2.826 N/A ARG 306.A NH1 PRO 327.A O no hydrogen 2.880 N/A ARG 306.A NH2 ASP 308.A OD2 no hydrogen 2.819 N/A ARG 306.A NH2 LYS 341.A O no hydrogen 3.026 N/A LEU 309.A N ARG 306.A O no hydrogen 3.132 N/A TYR 313.A OH ASP 337.A OD2 no hydrogen 2.788 N/A GLU 314.A N GLU 314.A OE2 no hydrogen 2.816 N/A GLY 315.A N MET 304.A O no hydrogen 2.780 N/A GLN 317.A N SER 302.A O no hydrogen 2.757 N/A GLN 317.A NE2 TYR 313.A O no hydrogen 3.102 N/A GLN 317.A NE2 GLY 315.A O no hydrogen 2.873 N/A ALA 318.A N VAL 328.A O no hydrogen 2.748 N/A LEU 319.A N VAL 300.A O no hydrogen 2.817 N/A ASP 320.A N CYS 325.A O no hydrogen 2.980 N/A THR 322.A N ASP 320.A OD1 no hydrogen 2.997 N/A CYS 324.A SG ARG 222.A O no hydrogen 3.598 N/A CYS 325.A N SER 225.A OG no hydrogen 3.137 N/A GLY 326.A N ASP 343.A OD2 no hydrogen 2.723 N/A VAL 328.A N ALA 318.A O no hydrogen 3.049 N/A VAL 330.A N TRP 316.A O no hydrogen 3.045 N/A ALA 332.A N PRO 329.A O no hydrogen 2.908 N/A ILE 333.A N PRO 329.A O no hydrogen 3.391 N/A LYS 334.A N VAL 330.A O no hydrogen 3.079 N/A LYS 334.A NZ HIS 388.A O no hydrogen 2.778 N/A GLU 335.A N ARG 331.A O no hydrogen 2.937 N/A GLY 336.A N ILE 333.A O no hydrogen 3.245 N/A ASP 337.A N ALA 332.A O no hydrogen 3.059 N/A THR 340.A N ASP 337.A O no hydrogen 3.437 N/A THR 340.A OG1 ASP 337.A O no hydrogen 2.858 N/A TYR 342.A N PRO 327.A O no hydrogen 2.905 N/A PHE 346.A N ASP 343.A O no hydrogen 3.154 N/A PHE 348.A N ALA 344.A O no hydrogen 2.909 N/A ALA 349.A N PRO 345.A O no hydrogen 2.954 N/A GLU 350.A N PHE 346.A O no hydrogen 3.331 N/A GLU 350.A N VAL 347.A O no hydrogen 3.050 N/A VAL 351.A N PHE 348.A O no hydrogen 3.256 N/A ASN 352.A ND2 PHE 348.A O no hydrogen 3.180 N/A ASP 354.A N ASN 510.A O no hydrogen 3.337 N/A VAL 356.A N TYR 512.A O no hydrogen 3.012 N/A ASP 357.A N SER 362.A O no hydrogen 2.618 N/A TRP 358.A N LEU 514.A O no hydrogen 2.812 N/A SER 362.A N ASP 357.A O no hydrogen 3.125 N/A ASN 364.A N VAL 355.A O no hydrogen 2.913 N/A ASN 364.A ND2 ASP 357.A OD1 no hydrogen 3.366 N/A ASN 364.A ND2 ASP 357.A OD2 no hydrogen 3.271 N/A ARG 365.A NH1 GLU 394.A OE1 no hydrogen 2.736 N/A SER 366.A N ASN 364.A OD1 no hydrogen 2.635 N/A SER 366.A OG ASN 364.A OD1 no hydrogen 2.547 N/A ILE 368.A N SER 278.A O no hydrogen 2.946 N/A LEU 371.A N TYR 276.A O no hydrogen 2.909 N/A ILE 373.A N THR 387.A OG1 no hydrogen 2.874 N/A SER 374.A N THR 274.A O no hydrogen 2.920 N/A SER 374.A OG LYS 372.A O no hydrogen 2.713 N/A THR 375.A N GLU 384.A O no hydrogen 2.933 N/A THR 375.A OG1 VAL 272.A O no hydrogen 2.564 N/A LYS 376.A NZ GLU 158.A OE1 no hydrogen 3.445 N/A LYS 376.A NZ GLU 158.A OE2 no hydrogen 3.390 N/A LYS 376.A NZ SER 377.A O no hydrogen 3.175 N/A LYS 376.A NZ ARG 380.A O no hydrogen 2.833 N/A SER 377.A N GLU 382.A O no hydrogen 2.696 N/A SER 377.A OG GLU 382.A O no hydrogen 3.255 N/A GLY 379.A N GLU 158.A OE1 no hydrogen 2.754 N/A GLU 384.A N THR 375.A O no hydrogen 2.626 N/A ILE 386.A N ILE 373.A O no hydrogen 2.729 N/A THR 387.A N ASP 385.A OD1 no hydrogen 2.906 N/A THR 387.A OG1 ASP 385.A OD1 no hydrogen 2.719 N/A THR 387.A OG1 ASP 385.A OD2 no hydrogen 3.448 N/A THR 389.A N ILE 386.A O no hydrogen 3.150 N/A THR 389.A OG1 ILE 386.A O no hydrogen 2.772 N/A TYR 390.A N THR 387.A O no hydrogen 3.058 N/A TYR 390.A OH GLU 301.A OE2 no hydrogen 2.616 N/A LYS 391.A N THR 387.A O no hydrogen 3.054 N/A LYS 391.A NZ VAL 351.A O no hydrogen 3.008 N/A TYR 392.A OH GLU 335.A OE2 no hydrogen 2.482 N/A GLY 395.A N GLU 399.A OE1 no hydrogen 3.282 N/A SER 396.A N PRO 393.A O no hydrogen 3.157 N/A SER 396.A OG PRO 393.A O no hydrogen 3.005 N/A GLU 398.A N GLU 398.A OE2 no hydrogen 2.873 N/A GLU 399.A N SER 396.A OG no hydrogen 3.024 N/A ARG 400.A N SER 396.A O no hydrogen 3.154 N/A GLU 401.A N SER 397.A O no hydrogen 2.917 N/A ALA 402.A N GLU 398.A O no hydrogen 3.068 N/A PHE 403.A N GLU 399.A O no hydrogen 2.975 N/A THR 404.A N ARG 400.A O no hydrogen 2.962 N/A THR 404.A OG1 ARG 400.A O no hydrogen 3.460 N/A ARG 405.A N GLU 401.A O no hydrogen 3.101 N/A ARG 405.A NH1 GLU 335.A O no hydrogen 2.564 N/A ARG 405.A NH2 GLU 401.A OE1 no hydrogen 3.493 N/A ALA 406.A N ALA 402.A O no hydrogen 3.048 N/A ASN 407.A N PHE 403.A O no hydrogen 3.054 N/A ASN 407.A N THR 404.A O no hydrogen 3.000 N/A ASN 407.A ND2 PHE 403.A O no hydrogen 2.731 N/A ALA 411.A N THR 433.A O no hydrogen 2.958 N/A ARG 413.A N HIS 431.A O no hydrogen 3.017 N/A ARG 415.A N PHE 429.A O no hydrogen 2.993 N/A ASN 421.A ND2 SER 419.A OG no hydrogen 2.875 N/A MET 422.A N GLU 522.A O no hydrogen 2.811 N/A GLY 423.A N TYR 488.A OH no hydrogen 3.068 N/A SER 424.A N ASN 421.A O no hydrogen 3.007 N/A SER 424.A OG ASN 421.A O no hydrogen 3.258 N/A PHE 426.A N ILE 483.A O no hydrogen 3.217 N/A VAL 428.A N LEU 481.A O no hydrogen 2.685 N/A PHE 429.A N ARG 415.A O no hydrogen 2.904 N/A ALA 430.A N VAL 479.A O no hydrogen 2.770 N/A HIS 431.A N ARG 413.A O no hydrogen 2.884 N/A HIS 431.A ND1 SER 478.A OG no hydrogen 3.342 N/A ILE 432.A N LYS 477.A O no hydrogen 2.797 N/A THR 433.A N ALA 411.A O no hydrogen 2.727 N/A ASN 434.A N SER 475.A O no hydrogen 2.826 N/A ASN 434.A ND2 GLU 438.A O no hydrogen 3.341 N/A ASN 434.A ND2 LEU 471.A O no hydrogen 3.548 N/A THR 436.A N ASN 434.A OD1 no hydrogen 3.181 N/A THR 436.A OG1 ASN 434.A OD1 no hydrogen 2.983 N/A THR 436.A OG1 GLU 438.A O no hydrogen 3.552 N/A GLU 438.A N THR 436.A OG1 no hydrogen 2.822 N/A TYR 440.A N LEU 471.A O no hydrogen 3.068 N/A CYS 442.A N LEU 469.A O no hydrogen 2.856 N/A ARG 443.A N VAL 505.A O no hydrogen 2.867 N/A ARG 443.A NH1 LEU 467.A O no hydrogen 3.540 N/A ARG 443.A NH2 GLU 291.A OE2 no hydrogen 2.537 N/A LEU 444.A N LEU 466.A O no hydrogen 2.958 N/A LEU 445.A N LEU 503.A O no hydrogen 3.028 N/A LEU 446.A N LYS 464.A O no hydrogen 2.921 N/A CYS 447.A N ARG 501.A O no hydrogen 2.899 N/A CYS 447.A SG ARG 501.A O no hydrogen 3.921 N/A ALA 448.A N GLY 462.A O no hydrogen 2.898 N/A ARG 449.A N LYS 499.A O no hydrogen 3.056 N/A ARG 449.A NE GLY 458.A O no hydrogen 2.935 N/A ARG 449.A NH2 GLY 458.A O no hydrogen 2.877 N/A THR 450.A OG1 CYS 491.A O no hydrogen 2.892 N/A VAL 451.A N LEU 497.A O no hydrogen 3.265 N/A SER 452.A N ILE 456.A O no hydrogen 2.850 N/A ASN 454.A N SER 452.A OG no hydrogen 3.018 N/A GLY 455.A N SER 452.A O no hydrogen 2.848 N/A ILE 456.A N ASN 454.A OD1 no hydrogen 2.706 N/A GLY 458.A N THR 450.A O no hydrogen 2.637 N/A CYS 461.A N ALA 448.A O no hydrogen 2.769 N/A CYS 461.A SG ALA 448.A O no hydrogen 3.606 N/A THR 463.A OG1 GLU 460.A OE2 no hydrogen 2.430 N/A LYS 464.A N LEU 446.A O no hydrogen 2.706 N/A LEU 466.A N LEU 444.A O no hydrogen 2.740 N/A LEU 469.A N CYS 442.A O no hydrogen 2.763 N/A LEU 471.A N TYR 440.A O no hydrogen 2.888 N/A PHE 474.A N THR 436.A O no hydrogen 2.971 N/A SER 475.A OG GLU 472.A O no hydrogen 2.659 N/A LYS 477.A N ILE 432.A O no hydrogen 2.994 N/A LYS 477.A NZ ASN 470.A O no hydrogen 2.989 N/A SER 478.A OG HIS 431.A ND1 no hydrogen 3.342 N/A VAL 479.A N ALA 430.A O no hydrogen 2.983 N/A LEU 481.A N VAL 428.A O no hydrogen 2.646 N/A ILE 483.A N PHE 426.A O no hydrogen 2.806 N/A TYR 485.A N ASP 425.A OD1 no hydrogen 2.900 N/A LYS 487.A N LEU 484.A O no hydrogen 2.834 N/A TYR 488.A N LEU 484.A O no hydrogen 2.998 N/A TYR 488.A OH SER 424.A O no hydrogen 2.957 N/A ARG 489.A N TYR 485.A O no hydrogen 2.598 N/A CYS 491.A N TYR 488.A O no hydrogen 2.921 N/A CYS 491.A SG PRO 459.A O no hydrogen 3.932 N/A CYS 491.A SG LYS 487.A O no hydrogen 3.501 N/A CYS 491.A SG TYR 488.A O no hydrogen 3.770 N/A THR 493.A OG1 VAL 451.A O no hydrogen 3.144 N/A SER 495.A N THR 493.A OG1 no hydrogen 3.004 N/A SER 495.A OG VAL 451.A O no hydrogen 2.838 N/A SER 495.A OG THR 493.A OG1 no hydrogen 2.687 N/A LEU 497.A N SER 495.A OG no hydrogen 3.210 N/A ILE 498.A N LEU 519.A O no hydrogen 2.777 N/A LYS 499.A N ARG 449.A O no hydrogen 2.626 N/A LYS 499.A NZ GLU 516.A OE2 no hydrogen 2.965 N/A LYS 499.A NZ ASP 518.A OD1 no hydrogen 3.386 N/A LYS 499.A NZ ASP 518.A OD2 no hydrogen 2.873 N/A VAL 500.A N ARG 517.A O no hydrogen 2.796 N/A ARG 501.A N CYS 447.A O no hydrogen 2.838 N/A ARG 501.A NH2 GLU 286.A OE2 no hydrogen 3.412 N/A ALA 502.A N ALA 515.A O no hydrogen 2.970 N/A LEU 503.A N LEU 445.A O no hydrogen 2.790 N/A LEU 504.A N LEU 513.A O no hydrogen 2.776 N/A VAL 505.A N ARG 443.A O no hydrogen 2.852 N/A GLU 506.A N SER 511.A O no hydrogen 2.891 N/A VAL 508.A N GLU 506.A OE1 no hydrogen 2.466 N/A ASN 510.A N GLU 506.A O no hydrogen 2.995 N/A ASN 510.A ND2 ASN 352.A O no hydrogen 2.696 N/A SER 511.A N GLU 506.A O no hydrogen 2.871 N/A TYR 512.A N ASP 354.A O no hydrogen 2.795 N/A TYR 512.A OH ASN 510.A OD1 no hydrogen 2.589 N/A LEU 513.A N LEU 504.A O no hydrogen 2.818 N/A LEU 514.A N VAL 356.A O no hydrogen 2.992 N/A ALA 515.A N ALA 502.A O no hydrogen 3.177 N/A GLU 516.A N TRP 358.A O no hydrogen 3.021 N/A ARG 517.A N VAL 500.A O no hydrogen 2.944 N/A ARG 517.A NH1 ILE 414.A O no hydrogen 3.084 N/A LEU 519.A N ILE 498.A O no hydrogen 2.656 N/A LEU 521.A N ASN 496.A O no hydrogen 2.572 N/A GLU 522.A N MET 420.A O no hydrogen 3.005 N/A LYS 527.A N SER 545.A O no hydrogen 3.093 N/A ARG 529.A N GLU 543.A O no hydrogen 2.554 N/A LEU 531.A N VAL 541.A O no hydrogen 2.577 N/A LEU 540.A N LEU 591.A O no hydrogen 2.988 N/A VAL 541.A N LEU 531.A O no hydrogen 3.145 N/A ALA 542.A N MET 589.A O no hydrogen 3.123 N/A GLU 543.A N ARG 529.A O no hydrogen 2.689 N/A VAL 544.A N VAL 587.A O no hydrogen 3.040 N/A SER 545.A N LYS 527.A O no hydrogen 2.919 N/A SER 545.A OG GLU 584.A OE2 no hydrogen 3.362 N/A LEU 546.A N VAL 585.A O no hydrogen 3.205 N/A ASN 548.A N GLU 583.A O no hydrogen 2.868 N/A ASN 548.A ND2 VAL 552.A O no hydrogen 3.168 N/A ASN 548.A ND2 VAL 579.A O no hydrogen 3.190 N/A ASN 548.A ND2 GLU 580.A O no hydrogen 3.304 N/A LEU 550.A N ASN 548.A OD1 no hydrogen 2.838 N/A LEU 554.A N VAL 579.A O no hydrogen 2.800 N/A GLU 555.A N ASP 608.A OD2 no hydrogen 2.664 N/A CYS 557.A SG LEU 554.A O no hydrogen 3.703 N/A THR 558.A N GLU 606.A O no hydrogen 3.143 N/A PHE 559.A N VAL 573.A O no hydrogen 3.063 N/A THR 560.A N ASN 604.A O no hydrogen 2.748 N/A THR 560.A OG1 PHE 559.A O no hydrogen 3.001 N/A VAL 561.A N LYS 571.A O no hydrogen 3.188 N/A GLU 562.A N VAL 602.A O no hydrogen 3.065 N/A LEU 566.A N GLY 563.A O no hydrogen 2.845 N/A THR 567.A N GLY 563.A O no hydrogen 3.126 N/A THR 567.A OG1 GLU 569.A O no hydrogen 2.602 N/A GLU 569.A N THR 567.A OG1 no hydrogen 3.245 N/A GLN 570.A NE2 GLU 562.A OE2 no hydrogen 2.743 N/A LYS 571.A N VAL 561.A O no hydrogen 3.255 N/A THR 572.A OG1 GLN 570.A OE1 no hydrogen 3.494 N/A VAL 573.A N PHE 559.A O no hydrogen 3.060 N/A ILE 575.A N CYS 557.A O no hydrogen 2.549 N/A VAL 579.A N LEU 554.A O no hydrogen 2.944 N/A GLU 580.A N GLU 583.A OE1 no hydrogen 2.718 N/A GLY 582.A N ASN 548.A O no hydrogen 3.154 N/A GLU 583.A N GLU 580.A O no hydrogen 2.761 N/A VAL 585.A N LEU 546.A O no hydrogen 3.135 N/A VAL 587.A N VAL 544.A O no hydrogen 3.089 N/A ARG 588.A NE GLU 543.A OE1 no hydrogen 2.895 N/A MET 589.A N ALA 542.A O no hydrogen 3.100 N/A LEU 591.A N LEU 540.A O no hydrogen 2.537 N/A LEU 592.A N LEU 566.A O no hydrogen 2.976 N/A LEU 594.A N GLY 565.A O no hydrogen 2.936 N/A HIS 599.A N VAL 619.A O no hydrogen 3.216 N/A LYS 600.A NZ ASN 618.A OD1 no hydrogen 2.965 N/A LEU 601.A N ARG 617.A O no hydrogen 2.845 N/A VAL 602.A N GLU 562.A O no hydrogen 2.868 N/A VAL 603.A N GLY 615.A O no hydrogen 2.967 N/A ASN 604.A N THR 560.A O no hydrogen 2.842 N/A PHE 605.A N VAL 613.A O no hydrogen 2.842 N/A GLU 606.A N THR 558.A O no hydrogen 2.943 N/A SER 607.A N GLU 606.A OE1 no hydrogen 3.218 N/A SER 607.A OG GLU 555.A O no hydrogen 3.480 N/A SER 607.A OG ASP 608.A OD2 no hydrogen 3.155 N/A ASP 608.A N GLU 555.A O no hydrogen 2.772 N/A LYS 609.A NZ ALA 553.A O no hydrogen 2.688 N/A ALA 612.A N GLU 606.A OE1 no hydrogen 3.332 N/A ALA 612.A N GLU 606.A OE2 no hydrogen 2.548 N/A LYS 614.A NZ ASN 604.A OD1 no hydrogen 2.879 N/A GLY 615.A N VAL 603.A O no hydrogen 3.158 N/A ARG 617.A N LEU 601.A O no hydrogen 3.126 N/A VAL 619.A N HIS 599.A O no hydrogen 2.887 N/A