Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8s4g_J.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 GLN 4.A OE1 no hydrogen 3.372 N/A GLN 4.A N GLN 4.A OE1 no hydrogen 2.351 N/A GLN 8.A N GLN 8.A OE1 no hydrogen 2.961 N/A ALA 9.A N GLU 5.A O no hydrogen 2.960 N/A ALA 10.A N PRO 6.A O no hydrogen 2.858 N/A ILE 11.A N VAL 7.A O no hydrogen 2.889 N/A TRP 12.A N GLN 8.A O no hydrogen 2.924 N/A GLN 13.A N ALA 9.A O no hydrogen 2.903 N/A ALA 14.A N ALA 10.A O no hydrogen 2.888 N/A LEU 15.A N ILE 11.A O no hydrogen 2.916 N/A ASN 16.A N TRP 12.A O no hydrogen 2.899 N/A HIS 17.A N GLN 13.A O no hydrogen 2.895 N/A HIS 17.A ND1 GLN 13.A O no hydrogen 2.630 N/A TYR 18.A N LEU 15.A O no hydrogen 3.007 N/A ALA 19.A N ALA 14.A O no hydrogen 2.758 N/A ALA 23.A N ALA 19.A O no hydrogen 2.888 N/A VAL 24.A N TYR 20.A O no hydrogen 2.890 N/A PHE 25.A N ARG 21.A O no hydrogen 2.958 N/A LEU 26.A N ASP 22.A O no hydrogen 2.932 N/A ALA 27.A N ALA 23.A O no hydrogen 2.886 N/A GLU 28.A N VAL 24.A O no hydrogen 2.903 N/A ARG 29.A N PHE 25.A O no hydrogen 2.956 N/A LEU 30.A N LEU 26.A O no hydrogen 2.884 N/A TYR 31.A N ALA 27.A O no hydrogen 2.891 N/A ALA 32.A N GLU 28.A O no hydrogen 2.883 N/A GLU 33.A N ARG 29.A O no hydrogen 2.912 N/A VAL 34.A N LEU 30.A O no hydrogen 2.914 N/A HIS 35.A N TYR 31.A O no hydrogen 2.847 N/A SER 36.A OG GLU 38.A OE1 no hydrogen 2.508 N/A SER 36.A OG GLU 38.A OE2 no hydrogen 2.839 N/A GLU 37.A N SER 36.A OG no hydrogen 2.668 N/A GLU 38.A N GLU 38.A OE1 no hydrogen 2.400 N/A PHE 41.A N GLU 37.A O no hydrogen 2.891 N/A LEU 42.A N GLU 38.A O no hydrogen 2.899 N/A LEU 43.A N ALA 39.A O no hydrogen 2.913 N/A ALA 44.A N LEU 40.A O no hydrogen 2.921 N/A THR 45.A N PHE 41.A O no hydrogen 2.870 N/A THR 45.A OG1 PHE 41.A O no hydrogen 2.891 N/A CYS 46.A N LEU 42.A O no hydrogen 2.929 N/A CYS 46.A SG ALA 23.A O no hydrogen 3.713 N/A CYS 46.A SG LEU 42.A O no hydrogen 3.179 N/A TYR 47.A N LEU 43.A O no hydrogen 2.934 N/A TYR 48.A N ALA 44.A O no hydrogen 2.883 N/A TYR 48.A OH ASP 80.A OD2 no hydrogen 2.360 N/A ARG 49.A N THR 45.A O no hydrogen 2.906 N/A SER 50.A N CYS 46.A O no hydrogen 2.945 N/A SER 50.A OG CYS 46.A O no hydrogen 3.058 N/A GLY 51.A N TYR 48.A O no hydrogen 3.001 N/A LYS 55.A N LYS 52.A O no hydrogen 2.950 N/A TYR 57.A N ALA 53.A O no hydrogen 2.907 N/A ARG 58.A N TYR 54.A O no hydrogen 2.898 N/A LEU 59.A N LYS 55.A O no hydrogen 2.896 N/A LEU 60.A N ALA 56.A O no hydrogen 2.907 N/A LYS 61.A N TYR 57.A O no hydrogen 2.872 N/A GLY 62.A N ARG 58.A O no hydrogen 2.905 N/A HIS 63.A ND1 LEU 59.A O no hydrogen 3.098 N/A THR 66.A N GLU 37.A OE2 no hydrogen 2.552 N/A THR 66.A OG1 GLU 37.A OE1 no hydrogen 3.454 N/A THR 66.A OG1 GLU 37.A OE2 no hydrogen 3.210 N/A GLN 69.A N GLN 69.A OE1 no hydrogen 2.191 N/A CYS 70.A N THR 67.A OG1 no hydrogen 3.396 N/A CYS 70.A SG THR 67.A OG1 no hydrogen 2.789 N/A LYS 71.A N THR 67.A O no hydrogen 2.943 N/A LYS 71.A NZ CYS 65.A O no hydrogen 3.154 N/A LYS 71.A NZ THR 66.A O no hydrogen 3.267 N/A TYR 72.A N PRO 68.A O no hydrogen 2.870 N/A LEU 73.A N GLN 69.A O no hydrogen 2.907 N/A LEU 74.A N CYS 70.A O no hydrogen 2.934 N/A ALA 75.A N LYS 71.A O no hydrogen 2.912 N/A LYS 76.A N TYR 72.A O no hydrogen 2.886 N/A CYS 77.A N LEU 73.A O no hydrogen 2.917 N/A CYS 77.A SG ALA 53.A O no hydrogen 3.806 N/A CYS 77.A SG LEU 73.A O no hydrogen 3.168 N/A CYS 78.A N LEU 74.A O no hydrogen 2.929 N/A CYS 78.A SG LEU 74.A O no hydrogen 3.265 N/A VAL 79.A N ALA 75.A O no hydrogen 2.893 N/A ASP 80.A N LYS 76.A O no hydrogen 2.899 N/A LEU 81.A N CYS 77.A O no hydrogen 2.912 N/A SER 82.A N VAL 79.A O no hydrogen 3.012 N/A LYS 83.A N CYS 78.A O no hydrogen 2.552 N/A GLY 87.A N LYS 83.A O no hydrogen 2.940 N/A GLU 88.A N LEU 84.A O no hydrogen 2.870 N/A GLN 89.A N ALA 85.A O no hydrogen 2.932 N/A ILE 90.A N GLU 86.A O no hydrogen 2.899 N/A LEU 91.A N GLY 87.A O no hydrogen 2.930 N/A SER 92.A N GLU 88.A O no hydrogen 2.886 N/A SER 92.A OG GLU 88.A O no hydrogen 2.850 N/A GLY 93.A N GLN 89.A O no hydrogen 3.079 N/A GLY 94.A N SER 92.A OG no hydrogen 3.273 N/A LYS 98.A NZ GLN 99.A O no hydrogen 3.485 N/A GLN 99.A N GLN 99.A OE1 no hydrogen 2.643 N/A LYS 100.A N SER 92.A O no hydrogen 3.288 N/A LYS 100.A NZ LEU 91.A O no hydrogen 3.309 N/A SER 101.A N ASP 104.A OD2 no hydrogen 3.118 N/A ASP 104.A N SER 101.A OG no hydrogen 3.308 N/A ILE 105.A N SER 101.A O no hydrogen 2.901 N/A THR 107.A N ASP 103.A O no hydrogen 2.957 N/A THR 107.A OG1 ASP 103.A O no hydrogen 2.984 N/A THR 107.A OG1 ASP 104.A O no hydrogen 2.540 N/A GLU 108.A N ASP 104.A O no hydrogen 2.896 N/A PHE 109.A N ILE 105.A O no hydrogen 2.890 N/A GLY 110.A N VAL 106.A O no hydrogen 2.918 N/A SER 112.A N PHE 109.A O no hydrogen 3.155 N/A ALA 113.A N GLY 110.A O no hydrogen 3.185 N/A THR 116.A N SER 112.A O no hydrogen 2.932 N/A LEU 117.A N ALA 113.A O no hydrogen 2.887 N/A SER 118.A N CYS 114.A O no hydrogen 2.913 N/A LEU 119.A N PHE 115.A O no hydrogen 2.934 N/A LEU 120.A N THR 116.A O no hydrogen 2.881 N/A GLY 121.A N LEU 117.A O no hydrogen 2.869 N/A HIS 122.A N SER 118.A O no hydrogen 2.927 N/A VAL 123.A N LEU 119.A O no hydrogen 2.929 N/A TYR 124.A N LEU 120.A O no hydrogen 2.886 N/A CYS 125.A N GLY 121.A O no hydrogen 2.896 N/A CYS 125.A SG GLY 121.A O no hydrogen 3.194 N/A LYS 126.A N HIS 122.A O no hydrogen 2.937 N/A THR 127.A N VAL 123.A O no hydrogen 2.892 N/A THR 127.A OG1 VAL 123.A O no hydrogen 2.664 N/A THR 127.A OG1 TYR 124.A O no hydrogen 3.082 N/A ARG 129.A N TYR 124.A O no hydrogen 2.876 N/A GLY 133.A N ARG 129.A O no hydrogen 2.978 N/A SER 134.A N LEU 130.A O no hydrogen 2.862 N/A SER 134.A OG LEU 130.A O no hydrogen 3.194 N/A SER 134.A OG ALA 131.A O no hydrogen 2.426 N/A SER 134.A OG GLU 135.A OE2 no hydrogen 2.520 N/A GLU 135.A N ALA 131.A O no hydrogen 2.947 N/A CYS 136.A N LYS 132.A O no hydrogen 2.923 N/A CYS 136.A SG HIS 102.A NE2 no hydrogen 3.011 N/A CYS 136.A SG LYS 132.A O no hydrogen 3.091 N/A TYR 137.A N GLY 133.A O no hydrogen 2.915 N/A GLN 138.A N SER 134.A O no hydrogen 2.883 N/A GLN 138.A NE2 SER 134.A O no hydrogen 3.247 N/A LYS 139.A N GLU 135.A O no hydrogen 2.910 N/A SER 140.A N CYS 136.A O no hydrogen 2.927 N/A SER 140.A OG CYS 136.A O no hydrogen 3.406 N/A SER 140.A OG TYR 137.A O no hydrogen 2.559 N/A LEU 141.A N TYR 137.A O no hydrogen 2.893 N/A SER 142.A N GLN 138.A O no hydrogen 2.890 N/A SER 142.A OG GLN 138.A O no hydrogen 3.426 N/A SER 142.A OG LYS 139.A O no hydrogen 2.550 N/A LEU 143.A N LYS 139.A O no hydrogen 2.912 N/A ASN 144.A N SER 140.A O no hydrogen 2.902 N/A LEU 147.A N ASN 144.A O no hydrogen 3.277 N/A GLU 152.A N TRP 148.A O no hydrogen 2.945 N/A SER 153.A N SER 149.A O no hydrogen 2.927 N/A SER 153.A OG SER 149.A O no hydrogen 3.188 N/A SER 153.A OG PRO 150.A O no hydrogen 3.019 N/A LEU 154.A N PRO 150.A O no hydrogen 2.823 N/A CYS 155.A N PHE 151.A O no hydrogen 2.931 N/A CYS 155.A SG PHE 151.A O no hydrogen 3.645 N/A GLU 156.A N GLU 152.A O no hydrogen 2.904 N/A ILE 157.A N SER 153.A O no hydrogen 2.907 N/A GLN 165.A N ASP 162.A O no hydrogen 3.018 N/A GLN 165.A NE2 ASP 162.A OD2 no hydrogen 2.894 N/A THR 166.A N ASP 162.A O no hydrogen 2.909 N/A THR 166.A OG1 ASP 162.A O no hydrogen 3.388 N/A THR 166.A OG1 PRO 163.A O no hydrogen 3.351 N/A PHE 167.A N PRO 163.A O no hydrogen 2.897 N/A LYS 168.A NZ GLN 165.A O no hydrogen 2.333 N/A THR 170.A N LYS 168.A O no hydrogen 2.813 N/A GLN 173.A N SER 171.A OG no hydrogen 3.134 N/A GLN 173.A NE2 LEU 143.A O no hydrogen 3.069 N/A GLN 180.A N THR 176.A O no hydrogen 3.029 N/A ALA 181.A N PRO 177.A O no hydrogen 2.919 N/A PHE 182.A N GLN 178.A O no hydrogen 2.903 N/A ASN 183.A N ILE 179.A O no hydrogen 2.896 N/A ASN 183.A ND2 GLN 180.A OE1 no hydrogen 3.598 N/A LYS 186.A N PHE 182.A O no hydrogen 2.950 N/A ALA 187.A N ASN 183.A O no hydrogen 2.884 N/A ALA 188.A N LEU 184.A O no hydrogen 2.914 N/A ALA 189.A N GLN 185.A O no hydrogen 2.926 N/A ALA 189.A N LYS 186.A O no hydrogen 3.233 N/A MET 193.A N ALA 189.A O no hydrogen 2.919 N/A SER 194.A N GLU 190.A O no hydrogen 2.878 N/A SER 194.A OG GLU 190.A O no hydrogen 3.355 N/A SER 194.A OG GLY 191.A O no hydrogen 2.862 N/A LEU 195.A N GLY 191.A O no hydrogen 2.981 N/A LEU 196.A N LEU 192.A O no hydrogen 2.883 N/A ARG 197.A N MET 193.A O no hydrogen 2.893 N/A ARG 197.A NE PHE 167.A O no hydrogen 3.043 N/A ARG 197.A NH2 PHE 167.A O no hydrogen 3.220 N/A ARG 197.A NH2 GLU 190.A OE2 no hydrogen 3.363 N/A GLU 198.A N SER 194.A O no hydrogen 2.935 N/A MET 199.A N LEU 195.A O no hydrogen 2.974 N/A GLY 200.A N LEU 196.A O no hydrogen 2.818 N/A LYS 201.A N ARG 197.A O no hydrogen 2.930 N/A LYS 201.A NZ ASP 164.A OD1 no hydrogen 2.590 N/A LYS 201.A NZ ASP 164.A OD2 no hydrogen 2.966 N/A GLY 202.A N GLU 198.A O no hydrogen 2.988 N/A TYR 203.A N MET 199.A O no hydrogen 2.849 N/A LEU 204.A N GLY 200.A O no hydrogen 2.884 N/A ALA 205.A N LYS 201.A O no hydrogen 2.942 N/A LEU 206.A N GLY 202.A O no hydrogen 2.916 N/A CYS 207.A N TYR 203.A O no hydrogen 2.889 N/A CYS 207.A SG TYR 203.A O no hydrogen 3.415 N/A SER 208.A N LEU 204.A O no hydrogen 2.903 N/A SER 208.A OG LEU 204.A O no hydrogen 2.498 N/A SER 208.A OG ALA 205.A O no hydrogen 2.826 N/A TYR 209.A N LEU 206.A O no hydrogen 2.840 N/A ASN 210.A N ALA 205.A O no hydrogen 2.884 N/A CYS 211.A SG TYR 209.A O no hydrogen 3.467 N/A ALA 214.A N ASN 210.A O no hydrogen 2.886 N/A ILE 215.A N CYS 211.A O no hydrogen 2.886 N/A ASN 216.A N LYS 212.A O no hydrogen 2.941 N/A ILE 217.A N GLU 213.A O no hydrogen 2.889 N/A LEU 218.A N ALA 214.A O no hydrogen 2.890 N/A SER 219.A N ILE 215.A O no hydrogen 2.923 N/A SER 219.A OG ILE 215.A O no hydrogen 3.037 N/A HIS 220.A N ILE 217.A O no hydrogen 3.127 N/A TYR 226.A N PRO 222.A O no hydrogen 2.863 N/A ASN 227.A N SER 223.A O no hydrogen 2.914 N/A THR 228.A N HIS 225.A O no hydrogen 3.220 N/A THR 228.A OG1 HIS 225.A O no hydrogen 2.314 N/A LEU 232.A N THR 228.A O no hydrogen 2.960 N/A CYS 233.A N GLY 229.A O no hydrogen 2.871 N/A CYS 233.A SG GLY 229.A O no hydrogen 3.117 N/A GLN 234.A N TRP 230.A O no hydrogen 2.935 N/A GLN 234.A NE2 TRP 230.A O no hydrogen 3.618 N/A ILE 235.A N VAL 231.A O no hydrogen 2.954 N/A GLY 236.A N LEU 232.A O no hydrogen 2.862 N/A ARG 237.A N CYS 233.A O no hydrogen 2.884 N/A ALA 238.A N GLN 234.A O no hydrogen 2.942 N/A TYR 239.A N ILE 235.A O no hydrogen 2.939 N/A PHE 240.A N GLY 236.A O no hydrogen 2.864 N/A GLU 241.A N ARG 237.A O no hydrogen 2.894 N/A LEU 242.A N ALA 238.A O no hydrogen 2.946 N/A SER 243.A N PHE 240.A O no hydrogen 2.972 N/A GLU 244.A N TYR 239.A O no hydrogen 3.126 N/A ALA 248.A N GLU 244.A O no hydrogen 2.916 N/A GLU 249.A N TYR 245.A O no hydrogen 2.860 N/A ARG 250.A N MET 246.A O no hydrogen 2.947 N/A ILE 251.A N GLN 247.A O no hydrogen 2.919 N/A PHE 252.A N ALA 248.A O no hydrogen 2.908 N/A SER 253.A N GLU 249.A O no hydrogen 2.851 N/A SER 253.A OG GLU 249.A O no hydrogen 2.644 N/A SER 253.A OG TYR 269.A OH no hydrogen 2.349 N/A GLU 254.A N ARG 250.A O no hydrogen 2.943 N/A VAL 255.A N ILE 251.A O no hydrogen 2.933 N/A ARG 256.A N PHE 252.A O no hydrogen 2.853 N/A ARG 256.A NE ASP 288.A OD2 no hydrogen 3.267 N/A ARG 256.A NH2 ASP 288.A OD2 no hydrogen 2.765 N/A ARG 257.A N SER 253.A O no hydrogen 2.884 N/A ARG 257.A NE GLU 254.A OE1 no hydrogen 2.928 N/A ARG 257.A NH2 GLU 254.A OE1 no hydrogen 3.148 N/A ILE 258.A N GLU 254.A O no hydrogen 2.941 N/A GLU 259.A N VAL 255.A O no hydrogen 2.884 N/A ARG 262.A N GLU 259.A O no hydrogen 3.377 N/A TYR 269.A N GLY 265.A O no hydrogen 2.968 N/A SER 270.A N MET 266.A O no hydrogen 2.844 N/A SER 270.A OG GLU 267.A O no hydrogen 2.646 N/A THR 271.A N GLU 267.A O no hydrogen 2.932 N/A THR 271.A OG1 GLU 267.A O no hydrogen 3.075 N/A THR 271.A OG1 TYR 332.A OH no hydrogen 3.326 N/A THR 272.A N ILE 268.A O no hydrogen 2.893 N/A THR 272.A OG1 ILE 268.A O no hydrogen 2.972 N/A LEU 273.A N TYR 269.A O no hydrogen 2.988 N/A TRP 274.A N SER 270.A O no hydrogen 2.874 N/A HIS 275.A N THR 271.A O no hydrogen 2.910 N/A LEU 276.A N THR 272.A O no hydrogen 2.916 N/A GLN 277.A N TRP 274.A O no hydrogen 3.303 N/A LYS 278.A N LEU 273.A O no hydrogen 3.115 N/A LYS 278.A NZ GLU 249.A OE1 no hydrogen 3.017 N/A LYS 278.A NZ GLU 249.A OE2 no hydrogen 3.142 N/A LEU 282.A N LYS 278.A O no hydrogen 2.928 N/A SER 283.A N ASP 279.A O no hydrogen 2.901 N/A VAL 284.A N VAL 280.A O no hydrogen 2.918 N/A LEU 285.A N ALA 281.A O no hydrogen 2.901 N/A SER 286.A N LEU 282.A O no hydrogen 2.933 N/A SER 286.A OG LEU 282.A O no hydrogen 2.967 N/A SER 286.A OG ALA 302.A O no hydrogen 2.939 N/A LYS 287.A N SER 283.A O no hydrogen 2.926 N/A ASP 288.A N VAL 284.A O no hydrogen 2.990 N/A LEU 289.A N LEU 285.A O no hydrogen 2.970 N/A THR 290.A N SER 286.A O no hydrogen 2.956 N/A THR 290.A OG1 SER 286.A O no hydrogen 2.724 N/A THR 290.A OG1 LYS 287.A O no hydrogen 2.980 N/A ASP 291.A N LYS 287.A O no hydrogen 2.928 N/A MET 292.A N ASP 288.A O no hydrogen 2.867 N/A ASP 293.A N LEU 289.A O no hydrogen 2.947 N/A ASN 295.A N ASP 293.A OD1 no hydrogen 3.292 N/A TRP 300.A NE1 LYS 294.A O no hydrogen 2.945 N/A CYS 301.A N PRO 297.A O no hydrogen 2.887 N/A CYS 301.A SG PRO 297.A O no hydrogen 3.231 N/A ALA 302.A N GLU 298.A O no hydrogen 2.907 N/A ALA 303.A N ALA 299.A O no hydrogen 2.948 N/A GLY 304.A N TRP 300.A O no hydrogen 2.862 N/A ASN 305.A N CYS 301.A O no hydrogen 2.901 N/A ASN 305.A ND2 SER 270.A OG no hydrogen 2.786 N/A ASN 305.A ND2 THR 271.A OG1 no hydrogen 3.199 N/A CYS 306.A N ALA 302.A O no hydrogen 2.908 N/A PHE 307.A N ALA 303.A O no hydrogen 2.955 N/A SER 308.A N GLY 304.A O no hydrogen 2.866 N/A SER 308.A OG GLY 304.A O no hydrogen 3.211 N/A SER 308.A OG ASN 305.A O no hydrogen 2.931 N/A LEU 309.A N ASN 305.A O no hydrogen 2.929 N/A GLN 310.A N PHE 307.A O no hydrogen 2.948 N/A GLN 310.A NE2 ASP 279.A OD1 no hydrogen 2.266 N/A GLN 310.A NE2 CYS 306.A O no hydrogen 3.142 N/A ARG 311.A N SER 308.A O no hydrogen 2.947 N/A HIS 313.A ND1 GLU 340.A OE2 no hydrogen 2.497 N/A ALA 316.A N GLU 312.A O no hydrogen 3.031 N/A ILE 317.A N HIS 313.A O no hydrogen 2.845 N/A LYS 318.A N ASP 314.A O no hydrogen 2.940 N/A PHE 319.A N ILE 315.A O no hydrogen 2.932 N/A PHE 320.A N ALA 316.A O no hydrogen 2.953 N/A GLN 321.A N ILE 317.A O no hydrogen 2.894 N/A ARG 322.A N LYS 318.A O no hydrogen 2.888 N/A ALA 323.A N PHE 319.A O no hydrogen 2.920 N/A ILE 324.A N PHE 320.A O no hydrogen 2.941 N/A GLN 325.A N GLN 321.A O no hydrogen 2.862 N/A VAL 326.A N ARG 322.A O no hydrogen 2.913 N/A ASP 327.A N ALA 323.A O no hydrogen 2.942 N/A ASN 329.A N ASP 327.A OD1 no hydrogen 3.158 N/A TYR 330.A N ASP 327.A O no hydrogen 3.317 N/A TYR 332.A OH THR 271.A OG1 no hydrogen 3.326 N/A THR 335.A N ALA 331.A O no hydrogen 2.937 N/A THR 335.A OG1 ALA 331.A O no hydrogen 3.095 N/A THR 335.A OG1 HIS 364.A NE2 no hydrogen 2.861 N/A LEU 336.A N TYR 332.A O no hydrogen 2.931 N/A LEU 337.A N ALA 333.A O no hydrogen 2.887 N/A GLY 338.A N TYR 334.A O no hydrogen 2.896 N/A HIS 339.A N THR 335.A O no hydrogen 2.931 N/A GLU 340.A N LEU 336.A O no hydrogen 2.910 N/A PHE 341.A N LEU 337.A O no hydrogen 2.900 N/A VAL 342.A N GLY 338.A O no hydrogen 2.914 N/A LEU 343.A N HIS 339.A O no hydrogen 2.937 N/A THR 344.A N GLU 340.A O no hydrogen 2.931 N/A THR 344.A N PHE 341.A O no hydrogen 3.076 N/A THR 344.A OG1 GLU 340.A O no hydrogen 2.390 N/A GLU 345.A N VAL 342.A O no hydrogen 3.003 N/A GLU 346.A N PHE 341.A O no hydrogen 2.934 N/A LYS 349.A N ASP 348.A OD1 no hydrogen 2.888 N/A ALA 350.A N GLU 346.A O no hydrogen 2.924 N/A LEU 351.A N LEU 347.A O no hydrogen 2.891 N/A ALA 352.A N ASP 348.A O no hydrogen 2.918 N/A CYS 353.A N LYS 349.A O no hydrogen 2.923 N/A CYS 353.A SG LYS 349.A O no hydrogen 3.184 N/A PHE 354.A N ALA 350.A O no hydrogen 2.887 N/A ARG 355.A N LEU 351.A O no hydrogen 2.894 N/A ASN 356.A N ALA 352.A O no hydrogen 2.927 N/A ALA 357.A N CYS 353.A O no hydrogen 2.927 N/A ILE 358.A N PHE 354.A O no hydrogen 2.899 N/A ARG 359.A N ARG 355.A O no hydrogen 2.915 N/A ARG 359.A NH2 LYS 126.A O no hydrogen 3.505 N/A VAL 360.A N ASN 356.A O no hydrogen 2.913 N/A ASN 361.A N ALA 357.A O no hydrogen 2.919 N/A ARG 363.A N ASN 361.A OD1 no hydrogen 3.310 N/A HIS 364.A N ASN 361.A O no hydrogen 3.272 N/A TYR 365.A OH GLU 241.A OE1 no hydrogen 2.824 N/A ALA 367.A N HIS 364.A O no hydrogen 3.217 N/A TYR 369.A N TYR 365.A O no hydrogen 2.912 N/A GLY 370.A N ASN 366.A O no hydrogen 2.872 N/A LEU 371.A N ALA 367.A O no hydrogen 2.932 N/A GLY 372.A N TRP 368.A O no hydrogen 2.921 N/A MET 373.A N TYR 369.A O no hydrogen 2.852 N/A ILE 374.A N GLY 370.A O no hydrogen 2.899 N/A TYR 375.A N LEU 371.A O no hydrogen 2.951 N/A TYR 376.A N GLY 372.A O no hydrogen 2.894 N/A LYS 377.A N MET 373.A O no hydrogen 2.885 N/A GLN 378.A N ILE 374.A O no hydrogen 2.913 N/A GLU 379.A N TYR 376.A O no hydrogen 3.066 N/A LYS 380.A N TYR 375.A O no hydrogen 2.767 N/A ALA 384.A N LYS 380.A O no hydrogen 2.987 N/A GLU 385.A N PHE 381.A O no hydrogen 2.801 N/A MET 386.A N SER 382.A O no hydrogen 3.010 N/A HIS 387.A N LEU 383.A O no hydrogen 3.012 N/A PHE 388.A N ALA 384.A O no hydrogen 2.879 N/A GLN 389.A N GLU 385.A O no hydrogen 2.879 N/A GLN 389.A NE2 ASP 393.A OD1 no hydrogen 2.534 N/A GLN 389.A NE2 ASP 393.A OD2 no hydrogen 3.370 N/A LYS 390.A N MET 386.A O no hydrogen 2.879 N/A ALA 391.A N HIS 387.A O no hydrogen 2.924 N/A LEU 392.A N PHE 388.A O no hydrogen 2.883 N/A ASP 393.A N GLN 389.A O no hydrogen 2.891 N/A ILE 394.A N LYS 390.A O no hydrogen 2.931 N/A ASN 395.A N ALA 391.A O no hydrogen 2.882 N/A SER 398.A OG ASN 395.A O no hydrogen 3.479 N/A LEU 402.A N SER 398.A O no hydrogen 2.947 N/A CYS 403.A N SER 399.A O no hydrogen 2.857 N/A CYS 403.A SG LEU 434.A O no hydrogen 3.860 N/A HIS 404.A N VAL 400.A O no hydrogen 2.920 N/A ILE 405.A N LEU 401.A O no hydrogen 2.877 N/A GLY 406.A N LEU 402.A O no hydrogen 2.897 N/A VAL 407.A N CYS 403.A O no hydrogen 2.917 N/A VAL 408.A N HIS 404.A O no hydrogen 2.980 N/A GLN 409.A N ILE 405.A O no hydrogen 2.892 N/A HIS 410.A N GLY 406.A O no hydrogen 2.903 N/A ALA 411.A N VAL 407.A O no hydrogen 2.909 N/A LEU 412.A N GLN 409.A O no hydrogen 2.858 N/A LYS 413.A N HIS 410.A O no hydrogen 3.033 N/A LYS 414.A N GLN 409.A O no hydrogen 3.294 N/A SER 415.A OG ASN 446.A OD1 no hydrogen 3.239 N/A ALA 418.A N LYS 414.A O no hydrogen 2.921 N/A LEU 419.A N SER 415.A O no hydrogen 2.870 N/A ASP 420.A N GLU 416.A O no hydrogen 2.986 N/A THR 421.A OG1 GLN 409.A OE1 no hydrogen 3.333 N/A THR 421.A OG1 ALA 418.A O no hydrogen 2.705 N/A LEU 422.A N ALA 418.A O no hydrogen 2.937 N/A ASN 423.A N LEU 419.A O no hydrogen 2.890 N/A LYS 424.A N ASP 420.A O no hydrogen 2.900 N/A ALA 425.A N THR 421.A O no hydrogen 2.899 N/A ILE 426.A N LEU 422.A O no hydrogen 2.930 N/A VAL 427.A N ASN 423.A O no hydrogen 2.905 N/A ILE 428.A N LYS 424.A O no hydrogen 2.929 N/A ASP 429.A N ALA 425.A O no hydrogen 2.934 N/A CYS 435.A N ASN 432.A OD1 no hydrogen 2.651 N/A CYS 435.A SG ASN 432.A O no hydrogen 3.196 N/A CYS 435.A SG ASN 432.A OD1 no hydrogen 3.347 N/A LYS 436.A N ASN 432.A O no hydrogen 3.006 N/A LYS 436.A NZ GLU 458.A OE2 no hydrogen 2.971 N/A PHE 437.A N PRO 433.A O no hydrogen 2.839 N/A HIS 438.A N LEU 434.A O no hydrogen 2.946 N/A ARG 439.A N CYS 435.A O no hydrogen 2.899 N/A ALA 440.A N LYS 436.A O no hydrogen 2.933 N/A SER 441.A N PHE 437.A O no hydrogen 2.885 N/A VAL 442.A N HIS 438.A O no hydrogen 2.905 N/A LEU 443.A N ARG 439.A O no hydrogen 2.913 N/A PHE 444.A N ALA 440.A O no hydrogen 2.898 N/A ALA 445.A N SER 441.A O no hydrogen 2.913 N/A ASN 446.A N VAL 442.A O no hydrogen 2.904 N/A ASN 446.A N LEU 443.A O no hydrogen 2.945 N/A GLU 447.A N PHE 444.A O no hydrogen 3.120 N/A LYS 448.A N LEU 443.A O no hydrogen 3.057 N/A LYS 448.A NZ ASN 446.A O no hydrogen 3.298 N/A TYR 449.A N GLU 447.A O no hydrogen 2.742 N/A ALA 452.A N LYS 448.A O no hydrogen 2.904 N/A LEU 453.A N TYR 449.A O no hydrogen 2.872 N/A GLN 454.A N LYS 450.A O no hydrogen 2.944 N/A GLU 455.A N SER 451.A O no hydrogen 2.922 N/A LEU 456.A N ALA 452.A O no hydrogen 2.850 N/A GLU 457.A N LEU 453.A O no hydrogen 2.924 N/A LEU 459.A N GLU 455.A O no hydrogen 2.918 N/A LYS 460.A N LEU 456.A O no hydrogen 2.837 N/A LYS 460.A NZ GLU 457.A OE1 no hydrogen 3.015 N/A LYS 460.A NZ GLU 457.A OE2 no hydrogen 3.536 N/A GLN 461.A N GLU 457.A O no hydrogen 2.928 N/A ILE 462.A N GLU 458.A O no hydrogen 2.881 N/A VAL 463.A N LEU 459.A O no hydrogen 2.909 N/A SER 467.A OG ALA 493.A O no hydrogen 2.836 N/A SER 467.A OG ASP 497.A OD2 no hydrogen 3.033 N/A PHE 471.A N SER 467.A O no hydrogen 2.930 N/A LEU 472.A N LEU 468.A O no hydrogen 2.895 N/A ILE 473.A N VAL 469.A O no hydrogen 2.924 N/A GLY 474.A N TYR 470.A O no hydrogen 2.879 N/A LYS 475.A N PHE 471.A O no hydrogen 2.965 N/A VAL 476.A N LEU 472.A O no hydrogen 2.929 N/A TYR 477.A N ILE 473.A O no hydrogen 2.900 N/A LYS 478.A N GLY 474.A O no hydrogen 2.894 N/A LYS 479.A N LYS 475.A O no hydrogen 2.942 N/A LEU 480.A N VAL 476.A O no hydrogen 2.899 N/A GLY 481.A N TYR 477.A O no hydrogen 2.976 N/A GLY 481.A N LYS 478.A O no hydrogen 3.261 N/A THR 483.A N GLY 481.A O no hydrogen 2.684 N/A ALA 486.A N GLN 482.A O no hydrogen 2.947 N/A LEU 487.A N THR 483.A O no hydrogen 2.881 N/A MET 488.A N HIS 484.A O no hydrogen 2.928 N/A ASN 489.A N LEU 485.A O no hydrogen 2.904 N/A ASN 489.A ND2 LEU 485.A O no hydrogen 2.578 N/A PHE 490.A N ALA 486.A O no hydrogen 2.901 N/A SER 491.A N LEU 487.A O no hydrogen 2.933 N/A TRP 492.A N MET 488.A O no hydrogen 2.936 N/A ALA 493.A N ASN 489.A O no hydrogen 2.875 N/A MET 494.A N PHE 490.A O no hydrogen 2.909 N/A ASP 495.A N SER 491.A O no hydrogen 2.887 N/A LEU 496.A N TRP 492.A O no hydrogen 2.940 N/A LEU 496.A N ALA 493.A O no hydrogen 3.195 N/A GLY 500.A N ASP 497.A O no hydrogen 2.853 N/A ASN 503.A N GLY 500.A O no hydrogen 3.271 N/A GLN 504.A NE2 GLU 507.A OE1 no hydrogen 3.220 N/A LYS 506.A N ASN 502.A O no hydrogen 2.924 N/A GLU 507.A N ASN 503.A O no hydrogen 2.873 N/A ALA 508.A N GLN 504.A O no hydrogen 2.882 N/A ILE 509.A N ILE 505.A O no hydrogen 2.929 N/A ASP 510.A N LYS 506.A O no hydrogen 3.064 N/A LYS 511.A N GLU 507.A O no hydrogen 2.897 N/A ARG 512.A N ALA 508.A O no hydrogen 3.045 N/A