Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ikq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N SER 24.A O no hydrogen 2.889 N/A ASP 5.A N GLU 9.A OE2 no hydrogen 2.718 N/A LEU 6.A N SER 25.A OG no hydrogen 2.861 N/A ASN 8.A N ASP 5.A O no hydrogen 3.124 N/A ASN 8.A N ASP 5.A OD1 no hydrogen 3.220 N/A GLU 9.A N ASP 5.A O no hydrogen 2.825 N/A CYS 10.A N LEU 6.A O no hydrogen 2.973 N/A CYS 14.A N ILE 166.A O no hydrogen 2.845 N/A CYS 14.A SG ILE 166.A O no hydrogen 3.681 N/A LEU 16.A N LEU 164.A O no hydrogen 2.782 N/A LEU 18.A N PRO 162.A O no hydrogen 2.897 N/A LYS 19.A N ASP 17.A OD1 no hydrogen 3.461 N/A GLY 21.A N LEU 18.A O no hydrogen 3.286 N/A ARG 23.A N VAL 152.A O no hydrogen 2.880 N/A ARG 23.A NE GLU 2.A O no hydrogen 2.908 N/A ARG 23.A NH1 ASP 17.A O no hydrogen 3.075 N/A ARG 23.A NH2 ALA 3.A O no hydrogen 3.285 N/A SER 24.A N GLU 2.A O no hydrogen 3.050 N/A SER 25.A N PHE 150.A O no hydrogen 2.890 N/A SER 25.A OG PHE 4.A O no hydrogen 2.878 N/A MET 27.A N ALA 148.A O no hydrogen 2.724 N/A SER 28.A OG ASP 147.A OD1 no hydrogen 3.249 N/A VAL 29.A N ARG 146.A O no hydrogen 2.853 N/A ALA 32.A N ASP 30.A OD1 no hydrogen 2.729 N/A ILE 33.A N ASP 30.A O no hydrogen 2.845 N/A ASP 35.A N PRO 31.A O no hydrogen 3.183 N/A THR 36.A N ILE 33.A O no hydrogen 3.212 N/A GLY 38.A N THR 36.A OG1 no hydrogen 3.205 N/A GLN 39.A NE2 ARG 179.A O no hydrogen 3.307 N/A GLY 40.A N ILE 104.A O no hydrogen 3.048 N/A VAL 41.A N VAL 174.A O.A no hydrogen 2.899 N/A VAL 41.A N VAL 174.A O.B no hydrogen 2.936 N/A LEU 42.A N VAL 102.A O no hydrogen 2.785 N/A HIS 43.A N SER 172.A O no hydrogen 2.792 N/A HIS 43.A NE2 ASN 99.A OD1 no hydrogen 2.850 N/A TYR 44.A N TRP 100.A O no hydrogen 2.881 N/A SER 45.A N GLY 170.A O no hydrogen 3.061 N/A MET 46.A N LEU 98.A O no hydrogen 3.100 N/A VAL 47.A N SER 167.A O no hydrogen 2.822 N/A LEU 48.A N TRP 96.A O no hydrogen 2.816 N/A GLU 49.A N ALA 165.A O no hydrogen 2.880 N/A ASN 52.A N GLU 49.A O no hydrogen 2.884 N/A ASN 52.A ND2 LEU 48.A O no hydrogen 2.766 N/A ASN 52.A ND2 GLY 94.A O no hydrogen 2.852 N/A LEU 55.A N SER 67.A O no hydrogen 2.922 N/A LYS 56.A N ARG 153.A O no hydrogen 2.971 N/A LYS 56.A NZ THR 66.A OG1 no hydrogen 2.953 N/A LEU 57.A N ILE 65.A O no hydrogen 2.844 N/A ALA 58.A N PHE 151.A O no hydrogen 2.911 N/A ILE 59.A N LEU 63.A O no hydrogen 2.796 N/A ASP 60.A N THR 149.A O no hydrogen 2.871 N/A ALA 62.A N ILE 59.A O no hydrogen 2.935 N/A LEU 63.A N ILE 59.A O no hydrogen 3.251 N/A SER 64.A N GLU 75.A O no hydrogen 2.774 N/A ILE 65.A N LEU 57.A O no hydrogen 2.785 N/A THR 66.A N ARG 73.A O.A no hydrogen 2.847 N/A THR 66.A N ARG 73.A O.B no hydrogen 2.888 N/A SER 67.A N LEU 55.A O no hydrogen 2.835 N/A SER 67.A OG ASN 52.A O no hydrogen 2.527 N/A ASP 68.A N THR 71.A O no hydrogen 3.415 N/A LEU 70.A N ASP 68.A OD2 no hydrogen 2.892 N/A THR 71.A N ASP 68.A OD2 no hydrogen 2.929 N/A ILE 72.A N TYR 88.A O no hydrogen 2.777 N/A ARG 73.A N.A THR 66.A O no hydrogen 2.825 N/A ARG 73.A N.B THR 66.A O no hydrogen 2.810 N/A LEU 74.A N TYR 86.A O no hydrogen 2.940 N/A GLU 75.A N SER 64.A O no hydrogen 2.930 N/A GLY 76.A N VAL 84.A O no hydrogen 2.991 N/A GLY 77.A N ALA 62.A O no hydrogen 2.873 N/A VAL 78.A N GLU 135.A O no hydrogen 3.135 N/A VAL 84.A N GLY 76.A O no hydrogen 3.056 N/A ARG 85.A NE GLU 75.A OE1 no hydrogen 2.595 N/A TYR 86.A N LEU 74.A O no hydrogen 2.809 N/A TYR 86.A OH THR 133.A O no hydrogen 2.634 N/A TYR 86.A OH ARG 240.A O no hydrogen 3.329 N/A TYR 88.A N ILE 72.A O no hydrogen 2.832 N/A TYR 88.A OH GLU 118.A OE1 no hydrogen 2.471 N/A THR 89.A OG1 ASP 377.A OD1 no hydrogen 2.832 N/A ARG 90.A N LEU 70.A O no hydrogen 2.925 N/A ARG 90.A NE GLU 118.A OE2 no hydrogen 2.779 N/A ARG 90.A NH2 GLY 94.A O no hydrogen 3.004 N/A GLN 91.A N GLU 118.A OE1 no hydrogen 2.703 N/A GLN 91.A N GLU 118.A OE2 no hydrogen 3.224 N/A GLN 91.A NE2 TYR 88.A OH no hydrogen 2.936 N/A ALA 92.A N GLU 118.A OE2 no hydrogen 3.006 N/A SER 95.A OG GLU 49.A OE2 no hydrogen 3.464 N/A TRP 96.A N LEU 48.A O no hydrogen 3.043 N/A SER 97.A N HIS 117.A O no hydrogen 2.769 N/A LEU 98.A N MET 46.A O no hydrogen 2.842 N/A ASN 99.A N PHE 115.A O no hydrogen 3.003 N/A ASN 99.A ND2 SER 97.A OG no hydrogen 2.964 N/A ASN 99.A ND2 PHE 115.A O no hydrogen 3.318 N/A TRP 100.A N TYR 44.A O no hydrogen 2.964 N/A LEU 101.A N LYS 113.A O no hydrogen 2.774 N/A VAL 102.A N LEU 42.A O no hydrogen 2.896 N/A ILE 104.A N GLY 40.A O no hydrogen 2.933 N/A LYS 108.A NZ GLY 105.A O no hydrogen 2.932 N/A SER 110.A OG GLU 135.A OE1 no hydrogen 3.564 N/A SER 110.A OG GLU 135.A OE2 no hydrogen 2.575 N/A ASN 111.A ND2 GLU 263.A OE1 no hydrogen 2.823 N/A ILE 112.A N ILE 134.A O no hydrogen 2.991 N/A LYS 113.A N LEU 101.A O no hydrogen 3.165 N/A LYS 113.A NZ ASN 111.A OD1 no hydrogen 2.904 N/A LYS 113.A NZ THR 133.A OG1 no hydrogen 2.772 N/A LYS 113.A NZ GLU 263.A OE1 no hydrogen 3.452 N/A LYS 113.A NZ GLU 263.A OE2 no hydrogen 2.703 N/A VAL 114.A N TYR 132.A O no hydrogen 2.806 N/A PHE 115.A N ASN 99.A O no hydrogen 2.956 N/A ILE 116.A N SER 129.A OG no hydrogen 2.833 N/A HIS 117.A N SER 97.A O no hydrogen 3.088 N/A GLU 118.A N HIS 127.A O no hydrogen 2.724 N/A LEU 119.A N SER 95.A O no hydrogen 3.010 N/A ASN 120.A N GLN 124.A O no hydrogen 2.998 N/A ASN 120.A ND2 GLN 124.A OE1 no hydrogen 3.062 N/A ASN 123.A N ASN 120.A O no hydrogen 3.018 N/A GLN 124.A N ASN 120.A OD1 no hydrogen 2.777 N/A LEU 125.A N ASP 229.A O no hydrogen 2.993 N/A SER 126.A N GLU 118.A O no hydrogen 2.854 N/A SER 126.A OG GLU 118.A O no hydrogen 3.012 N/A SER 126.A OG HIS 127.A ND1 no hydrogen 2.849 N/A HIS 127.A N GLU 118.A O no hydrogen 3.331 N/A HIS 127.A ND1 SER 126.A OG no hydrogen 2.849 N/A SER 129.A N ILE 116.A O no hydrogen 2.851 N/A SER 129.A OG ILE 116.A O no hydrogen 3.456 N/A SER 129.A OG PRO 130.A O no hydrogen 2.690 N/A ILE 131.A N SER 238.A O no hydrogen 2.846 N/A TYR 132.A N VAL 114.A O no hydrogen 2.853 N/A ILE 134.A N ILE 112.A O no hydrogen 3.018 N/A MET 136.A N SER 110.A O no hydrogen 2.843 N/A GLY 137.A N SER 110.A O no hydrogen 2.908 N/A LEU 141.A N GLY 137.A O no hydrogen 3.166 N/A ALA 142.A N ASP 138.A O no hydrogen 3.056 N/A LYS 143.A N GLU 139.A O no hydrogen 3.054 N/A LYS 143.A NZ ASP 60.A OD1 no hydrogen 2.638 N/A LYS 143.A NZ ASP 147.A O no hydrogen 2.936 N/A LEU 144.A N LEU 140.A O no hydrogen 2.805 N/A ALA 145.A N LEU 141.A O no hydrogen 3.030 N/A ALA 145.A N ALA 142.A O no hydrogen 3.215 N/A ARG 146.A N LYS 143.A O no hydrogen 3.208 N/A ARG 146.A NH1 PRO 31.A O no hydrogen 3.006 N/A ARG 146.A NH1 ASP 35.A OD2 no hydrogen 2.754 N/A ARG 146.A NH2 ASP 35.A OD1 no hydrogen 2.621 N/A ARG 146.A NH2 ASP 35.A OD2 no hydrogen 2.854 N/A ASP 147.A N LYS 143.A O no hydrogen 2.937 N/A ALA 148.A N MET 27.A O no hydrogen 3.137 N/A THR 149.A N ASP 60.A OD2 no hydrogen 2.870 N/A PHE 150.A N SER 25.A O no hydrogen 2.782 N/A PHE 151.A N ALA 58.A O no hydrogen 2.746 N/A VAL 152.A N ARG 23.A O no hydrogen 2.837 N/A ARG 153.A N LYS 56.A O no hydrogen 2.976 N/A HIS 155.A N ALA 54.A O no hydrogen 2.931 N/A GLU 159.A N SER 157.A OG no hydrogen 3.026 N/A THR 163.A N GLU 159.A OE1 no hydrogen 3.206 N/A LEU 164.A N LEU 16.A O no hydrogen 2.963 N/A ALA 165.A N GLY 50.A O no hydrogen 2.862 N/A ILE 166.A N CYS 14.A O no hydrogen 2.889 N/A SER 167.A N VAL 47.A O no hydrogen 2.834 N/A SER 167.A OG GLU 49.A OE1 no hydrogen 2.912 N/A HIS 168.A N LYS 12.A O no hydrogen 3.410 N/A ALA 169.A N CYS 10.A O no hydrogen 2.997 N/A GLY 170.A N SER 45.A O no hydrogen 2.985 N/A VAL 171.A N ALA 222.A O no hydrogen 2.874 N/A SER 172.A N HIS 43.A O no hydrogen 2.989 N/A VAL 173.A N ARG 219.A O no hydrogen 2.826 N/A VAL 174.A N.A VAL 41.A O no hydrogen 2.878 N/A VAL 174.A N.B VAL 41.A O no hydrogen 2.893 N/A MET 175.A N ILE 217.A O no hydrogen 2.876 N/A ALA 176.A N GLN 39.A O no hydrogen 3.061 N/A GLN 177.A N THR 212.A O no hydrogen 2.769 N/A LYS 178.A NZ GLU 107.A OE2 no hydrogen 2.713 N/A ARG 179.A NE GLU 182.A OE2 no hydrogen 3.274 N/A TRP 183.A NE1 ASN 111.A OD1 no hydrogen 3.050 N/A SER 185.A N GLU 182.A O no hydrogen 2.937 N/A SER 185.A OG SER 181.A O no hydrogen 3.489 N/A SER 185.A OG GLU 182.A O no hydrogen 3.191 N/A LYS 187.A N SER 185.A OG no hydrogen 3.230 N/A LYS 187.A NZ CYS 207.A O no hydrogen 2.774 N/A LYS 187.A NZ ASN 208.A O.A no hydrogen 3.433 N/A LYS 187.A NZ ASN 208.A O.B no hydrogen 3.420 N/A VAL 188.A N SER 185.A O no hydrogen 3.094 N/A LEU 189.A N GLY 186.A O no hydrogen 3.220 N/A CYS 190.A N LYS 187.A O no hydrogen 2.755 N/A LEU 191.A N VAL 188.A O no hydrogen 3.051 N/A LEU 192.A N LEU 189.A O no hydrogen 3.096 N/A LEU 195.A N LEU 192.A O no hydrogen 2.679 N/A ASP 196.A N ASP 193.A O no hydrogen 2.884 N/A VAL 198.A N LEU 195.A O no hydrogen 2.948 N/A TYR 201.A N GLY 197.A O no hydrogen 3.105 N/A LEU 202.A N VAL 198.A O no hydrogen 2.966 N/A ALA 203.A N TYR 199.A O no hydrogen 2.763 N/A TRP 213.A NE1 ARG 179.A O no hydrogen 3.017 N/A GLU 214.A N.A ASP 210.A O no hydrogen 2.990 N/A GLU 214.A N.A ASP 211.A O no hydrogen 3.136 N/A GLU 214.A N.B ASP 210.A O no hydrogen 2.993 N/A GLY 215.A N ASP 211.A O no hydrogen 3.048 N/A LYS 216.A N TRP 213.A O no hydrogen 3.243 N/A ILE 217.A N MET 175.A O no hydrogen 2.971 N/A ARG 219.A N VAL 173.A O no hydrogen 2.980 N/A LEU 221.A N VAL 171.A O no hydrogen 2.783 N/A ALA 222.A N VAL 171.A O no hydrogen 3.194 N/A ASN 224.A N ALA 169.A O no hydrogen 2.944 N/A LYS 227.A NZ ASP 193.A OD1 no hydrogen 2.624 N/A ASP 231.A N LEU 125.A O no hydrogen 3.098 N/A LYS 233.A N SER 126.A O no hydrogen 3.128 N/A LYS 233.A NZ GLN 91.A OE1 no hydrogen 2.625 N/A THR 235.A N LYS 233.A O no hydrogen 2.604 N/A HIS 239.A N SER 362.A O no hydrogen 2.807 N/A HIS 239.A NE2 SER 185.A O no hydrogen 3.006 N/A ARG 240.A N ILE 131.A O no hydrogen 2.975 N/A ARG 240.A NE ASP 359.A OD2 no hydrogen 2.776 N/A ARG 240.A NH1 ASP 377.A O no hydrogen 2.951 N/A ARG 240.A NH2 ASP 359.A OD2 no hydrogen 3.245 N/A ARG 240.A NH2 ASP 380.A OD2 no hydrogen 2.813 N/A LEU 241.A N VAL 360.A O no hydrogen 2.858 N/A HIS 242.A N TYR 86.A OH no hydrogen 2.947 N/A HIS 242.A ND1 ASP 359.A OD1 no hydrogen 3.009 N/A GLY 246.A N PHE 243.A O no hydrogen 2.943 N/A GLY 247.A N ALA 356.A O no hydrogen 3.220 N/A GLY 247.A N ASN 357.A OD1 no hydrogen 3.007 N/A SER 248.A OG ALA 356.A O no hydrogen 3.240 N/A SER 248.A OG ALA 358.A O no hydrogen 2.552 N/A LEU 249.A N ALA 356.A O no hydrogen 3.506 N/A ALA 251.A N GLY 247.A O no hydrogen 3.066 N/A LEU 252.A N SER 248.A O no hydrogen 2.758 N/A THR 253.A N LEU 249.A O no hydrogen 2.926 N/A THR 253.A OG1 LEU 249.A O no hydrogen 2.861 N/A ALA 254.A N ALA 250.A O no hydrogen 3.026 N/A HIS 255.A N ALA 251.A O no hydrogen 2.882 N/A HIS 255.A ND1 LEU 260.A O no hydrogen 2.629 N/A HIS 255.A NE2 GLU 384.A OE2 no hydrogen 2.549 N/A GLN 256.A N LEU 252.A O no hydrogen 2.928 N/A GLN 256.A NE2 GLU 384.A OE2 no hydrogen 2.820 N/A ALA 257.A N THR 253.A O no hydrogen 2.784 N/A CYS 258.A N ALA 254.A O no hydrogen 3.006 N/A HIS 259.A N HIS 255.A O no hydrogen 2.897 N/A LEU 260.A N HIS 255.A O no hydrogen 3.224 N/A THR 264.A N PRO 261.A O no hydrogen 3.144 N/A THR 264.A OG1 PRO 261.A O no hydrogen 3.127 N/A PHE 265.A N LEU 262.A O no hydrogen 3.064 N/A THR 266.A N GLU 263.A O no hydrogen 3.197 N/A THR 266.A OG1 GLU 263.A O no hydrogen 3.018 N/A ARG 267.A N THR 264.A O no hydrogen 3.398 N/A ARG 267.A NE ARG 269.A O no hydrogen 2.921 N/A ARG 267.A NH2 ARG 269.A O no hydrogen 3.430 N/A HIS 268.A N GLU 135.A OE2 no hydrogen 2.836 N/A HIS 268.A ND1 GLU 79.A OE1 no hydrogen 3.165 N/A GLN 276.A NE2 CYS 258.A O no hydrogen 3.178 N/A GLU 278.A N TRP 274.A O no hydrogen 2.805 N/A GLN 279.A N GLU 275.A O no hydrogen 2.788 N/A CYS 280.A N GLN 276.A O no hydrogen 2.921 N/A CYS 280.A SG GLN 328.A OE1 no hydrogen 3.529 N/A GLY 281.A N GLN 276.A O no hydrogen 3.034 N/A TYR 282.A N LEU 277.A O no hydrogen 2.799 N/A VAL 284.A N CYS 280.A O no hydrogen 2.860 N/A GLN 285.A N GLY 281.A O no hydrogen 2.975 N/A ARG 286.A N TYR 282.A O no hydrogen 2.826 N/A LEU 287.A N PRO 283.A O no hydrogen 2.899 N/A VAL 288.A N VAL 284.A O no hydrogen 3.075 N/A ALA 289.A N GLN 285.A O no hydrogen 3.065 N/A LEU 290.A N ARG 286.A O no hydrogen 2.853 N/A TYR 291.A N LEU 287.A O no hydrogen 3.061 N/A TYR 291.A OH SER 297.A O no hydrogen 3.118 N/A LEU 292.A N VAL 288.A O no hydrogen 3.040 N/A ALA 293.A N ALA 289.A O no hydrogen 3.102 N/A ALA 294.A N LEU 290.A O no hydrogen 3.209 N/A ARG 295.A N LEU 292.A O no hydrogen 3.088 N/A SER 297.A OG ASN 299.A OD1 no hydrogen 2.541 N/A TRP 298.A N GLU 352.A OE1 no hydrogen 3.458 N/A GLN 300.A N SER 297.A O no hydrogen 2.962 N/A GLN 300.A NE2 SER 297.A OG no hydrogen 2.886 N/A VAL 301.A N TRP 298.A O no hydrogen 3.174 N/A GLN 303.A NE2 ASN 307.A OD1 no hydrogen 2.827 N/A VAL 304.A N GLN 300.A O no hydrogen 2.849 N/A ILE 305.A N VAL 301.A O no hydrogen 2.890 N/A ARG 306.A N ASP 302.A O no hydrogen 2.866 N/A ARG 306.A NH2 GLN 303.A OE1 no hydrogen 2.915 N/A ASN 307.A N GLN 303.A O no hydrogen 2.816 N/A ALA 308.A N VAL 304.A O no hydrogen 3.162 N/A LEU 309.A N ILE 305.A O no hydrogen 3.012 N/A ALA 310.A N ARG 306.A O no hydrogen 2.800 N/A SER 311.A N ASN 307.A O no hydrogen 3.279 N/A SER 314.A N SER 311.A O no hydrogen 3.207 N/A SER 314.A OG ASN 307.A O no hydrogen 3.406 N/A SER 314.A OG SER 311.A O no hydrogen 2.487 N/A GLY 319.A N GLY 315.A O no hydrogen 3.117 N/A GLU 320.A N GLY 316.A O no hydrogen 3.046 N/A ALA 321.A N ASP 317.A O no hydrogen 3.022 N/A ILE 322.A N LEU 318.A O no hydrogen 3.083 N/A ARG 323.A N GLY 319.A O no hydrogen 3.095 N/A ARG 323.A NE GLU 320.A OE1 no hydrogen 3.426 N/A ARG 323.A NH1 ALA 308.A O no hydrogen 2.752 N/A ARG 323.A NH1 SER 314.A O no hydrogen 2.826 N/A ARG 323.A NH2 SER 314.A O no hydrogen 2.897 N/A ARG 323.A NH2 GLU 320.A OE1 no hydrogen 3.053 N/A GLU 324.A N GLU 320.A O no hydrogen 3.058 N/A GLN 325.A N ILE 322.A O no hydrogen 3.219 N/A GLN 328.A NE2 GLN 279.A O no hydrogen 3.180 N/A ALA 329.A N GLN 325.A O no hydrogen 2.848 N/A ARG 330.A N PRO 326.A O no hydrogen 2.897 N/A LEU 331.A N GLU 327.A O no hydrogen 2.936 N/A ALA 332.A N GLN 328.A O no hydrogen 2.890 N/A LEU 333.A N ALA 329.A O no hydrogen 2.909 N/A THR 334.A N ARG 330.A O no hydrogen 3.095 N/A THR 334.A OG1 ARG 330.A O no hydrogen 2.539 N/A THR 334.A OG1 LEU 331.A O no hydrogen 3.147 N/A LEU 335.A N.A LEU 331.A O no hydrogen 3.043 N/A LEU 335.A N.B LEU 331.A O no hydrogen 3.031 N/A ALA 336.A N ALA 332.A O no hydrogen 2.955 N/A ALA 337.A N LEU 333.A O no hydrogen 2.886 N/A ALA 338.A N THR 334.A O no hydrogen 3.146 N/A GLU 339.A N LEU 335.A O.A no hydrogen 3.156 N/A GLU 339.A N LEU 335.A O.B no hydrogen 3.107 N/A SER 340.A N ALA 336.A O no hydrogen 2.878 N/A GLU 341.A N ALA 337.A O no hydrogen 3.035 N/A ARG 342.A N ALA 338.A O no hydrogen 3.078 N/A ARG 342.A NE GLU 339.A OE1 no hydrogen 3.379 N/A ARG 342.A NE GLU 339.A OE2 no hydrogen 3.140 N/A ARG 342.A NH2 GLU 339.A OE2 no hydrogen 2.848 N/A ARG 342.A NH2 ALA 381.A O no hydrogen 2.993 N/A PHE 343.A N GLU 339.A O no hydrogen 2.913 N/A VAL 344.A N SER 340.A O no hydrogen 2.905 N/A ARG 345.A N GLU 341.A O no hydrogen 3.113 N/A GLN 346.A N PHE 343.A O no hydrogen 2.972 N/A ASN 350.A N GLY 347.A O no hydrogen 3.340 N/A ASN 350.A ND2 PHE 343.A O no hydrogen 2.995 N/A ASN 350.A ND2 GLY 379.A O no hydrogen 2.809 N/A GLY 354.A N ASP 351.A OD1 no hydrogen 2.630 N/A ALA 355.A N ASP 351.A O no hydrogen 3.101 N/A ALA 356.A N ALA 353.A O no hydrogen 3.411 N/A ASN 357.A N GLY 354.A O no hydrogen 3.089 N/A ALA 358.A N GLY 354.A O no hydrogen 3.016 N/A VAL 360.A N LEU 241.A O no hydrogen 2.933 N/A VAL 361.A N LEU 382.A O no hydrogen 2.870 N/A SER 362.A N HIS 239.A O no hydrogen 3.008 N/A SER 362.A OG GLU 384.A OE1 no hydrogen 3.249 N/A LEU 363.A N GLU 384.A O no hydrogen 2.811 N/A THR 364.A N ILE 237.A O no hydrogen 2.946 N/A CYS 365.A N ASN 386.A O no hydrogen 2.872 N/A CYS 365.A SG LEU 363.A O no hydrogen 3.792 N/A SER 378.A N PRO 375.A O no hydrogen 2.937 N/A SER 378.A OG PRO 375.A O no hydrogen 2.565 N/A ALA 381.A N SER 378.A O no hydrogen 2.998 N/A LEU 382.A N ASP 359.A O no hydrogen 2.789 N/A LEU 383.A N GLU 339.A OE2 no hydrogen 3.010 N/A GLU 384.A N VAL 361.A O no hydrogen 2.888 N/A ARG 385.A NE GLU 555.A OE2 no hydrogen 2.773 N/A ARG 385.A NH2 GLU 555.A OE1 no hydrogen 2.906 N/A ASN 386.A N LEU 363.A O no hydrogen 2.835 N/A ASN 386.A ND2 GLU 384.A OE1 no hydrogen 2.989 N/A THR 389.A OG1 VAL 444.A O no hydrogen 3.560 N/A THR 389.A OG1 PHE 445.A O no hydrogen 2.867 N/A ALA 391.A N THR 389.A OG1 no hydrogen 3.199 N/A GLU 392.A N THR 389.A O no hydrogen 3.029 N/A PHE 393.A N GLY 390.A O no hydrogen 2.905 N/A ASP 396.A N GLN 417.A OE1 no hydrogen 3.280 N/A ARG 405.A N SER 403.A OG no hydrogen 2.929 N/A GLY 406.A N SER 403.A O no hydrogen 2.987 N/A GLN 408.A N SER 401.A O no hydrogen 2.906 N/A GLN 408.A NE2 GLY 406.A O no hydrogen 3.284 N/A ASN 409.A ND2 ASP 399.A O no hydrogen 2.863 N/A ARG 414.A N THR 411.A OG1 no hydrogen 3.129 N/A ARG 414.A NE LEU 394.A O no hydrogen 2.734 N/A ARG 414.A NH1 GLY 398.A O no hydrogen 2.865 N/A ARG 414.A NH1 ASN 409.A O no hydrogen 2.736 N/A ARG 414.A NH2 GLY 395.A O no hydrogen 2.974 N/A ARG 414.A NH2 GLY 398.A O no hydrogen 3.008 N/A LEU 415.A N THR 411.A O no hydrogen 2.913 N/A LEU 416.A N VAL 412.A O no hydrogen 2.879 N/A GLN 417.A N GLU 413.A O no hydrogen 3.207 N/A GLN 417.A NE2 ASP 396.A OD2 no hydrogen 3.381 N/A ALA 418.A N ARG 414.A O no hydrogen 2.932 N/A HIS 419.A N LEU 415.A O no hydrogen 2.818 N/A HIS 419.A ND1 TYR 495.A OH no hydrogen 2.666 N/A ARG 420.A N LEU 416.A O no hydrogen 3.078 N/A GLN 421.A N GLN 417.A O no hydrogen 2.967 N/A LEU 422.A N ALA 418.A O no hydrogen 2.848 N/A GLU 423.A N HIS 419.A O no hydrogen 2.916 N/A GLU 424.A N ARG 420.A O no hydrogen 2.891 N/A ARG 425.A N GLN 421.A O no hydrogen 3.066 N/A ARG 425.A N LEU 422.A O no hydrogen 3.202 N/A ARG 425.A NH2 GLU 392.A OE1 no hydrogen 3.427 N/A GLY 426.A N GLU 423.A O no hydrogen 2.975 N/A TYR 427.A N LEU 422.A O no hydrogen 2.846 N/A VAL 428.A N VAL 496.A O no hydrogen 2.828 N/A VAL 430.A N VAL 494.A O no hydrogen 2.897 N/A TYR 432.A N ALA 465.A O no hydrogen 2.749 N/A TYR 432.A OH GLU 584.A OE1 no hydrogen 2.655 N/A TYR 432.A OH SER 588.A OG no hydrogen 3.275 N/A HIS 433.A N LEU 492.A O no hydrogen 2.880 N/A HIS 433.A ND1 TYR 463.A O no hydrogen 2.756 N/A THR 435.A N ALA 490.A O no hydrogen 3.072 N/A PHE 436.A N THR 435.A OG1 no hydrogen 2.706 N/A ALA 440.A N PHE 436.A O no hydrogen 3.038 N/A GLN 441.A N LEU 437.A O no hydrogen 3.204 N/A SER 442.A N GLU 438.A O no hydrogen 3.132 N/A SER 442.A OG GLN 256.A O no hydrogen 2.752 N/A ILE 443.A N ALA 439.A O no hydrogen 2.820 N/A VAL 444.A N ALA 440.A O no hydrogen 2.927 N/A PHE 445.A N GLN 441.A O no hydrogen 3.170 N/A GLY 447.A N SER 442.A O no hydrogen 2.932 N/A ARG 449.A NH1 ARG 385.A O no hydrogen 2.745 N/A ARG 449.A NH2 ASN 386.A OD1 no hydrogen 2.821 N/A ARG 449.A NH2 GLY 446.A O no hydrogen 2.967 N/A ARG 451.A NE THR 334.A OG1 no hydrogen 2.814 N/A ARG 451.A NH2 THR 334.A OG1 no hydrogen 3.374 N/A SER 452.A N THR 334.A O no hydrogen 2.857 N/A GLN 453.A NE2 GLY 461.A O no hydrogen 2.825 N/A LEU 455.A N GLN 453.A O no hydrogen 3.033 N/A TRP 459.A N ASP 456.A O no hydrogen 2.940 N/A ARG 460.A N ALA 457.A O no hydrogen 3.145 N/A ARG 460.A NH1 GLU 341.A OE2 no hydrogen 2.557 N/A GLY 461.A N GLN 453.A OE1 no hydrogen 3.126 N/A PHE 462.A N LEU 549.A O no hydrogen 2.821 N/A TYR 463.A OH TRP 459.A O no hydrogen 2.676 N/A ILE 464.A N THR 547.A O no hydrogen 2.861 N/A ALA 465.A N TYR 432.A O no hydrogen 2.784 N/A ALA 469.A N ASP 467.A OD1 no hydrogen 2.926 N/A LEU 470.A N ASP 467.A O no hydrogen 2.973 N/A ALA 471.A N ASP 467.A O no hydrogen 3.261 N/A TYR 472.A N PRO 468.A O no hydrogen 2.789 N/A GLY 473.A N LEU 470.A O no hydrogen 3.199 N/A TYR 474.A N ALA 471.A O no hydrogen 2.903 N/A ALA 475.A N TYR 472.A O no hydrogen 3.039 N/A GLN 476.A N TYR 474.A O no hydrogen 2.893 N/A ASP 477.A N ARG 487.A O no hydrogen 3.108 N/A GLN 478.A N GLU 327.A OE2 no hydrogen 3.063 N/A ARG 483.A N ASP 481.A OD1 no hydrogen 2.848 N/A GLY 484.A N ASP 481.A O no hydrogen 2.643 N/A ARG 487.A NE ASP 477.A OD1 no hydrogen 2.516 N/A ARG 487.A NE ASP 477.A OD2 no hydrogen 3.357 N/A ARG 487.A NH1 GLU 438.A OE2 no hydrogen 2.908 N/A ARG 487.A NH2 GLU 438.A OE1 no hydrogen 2.757 N/A ARG 487.A NH2 GLU 438.A OE2 no hydrogen 3.219 N/A ARG 487.A NH2 ASP 477.A OD1 no hydrogen 3.327 N/A ARG 487.A NH2 ASP 477.A OD2 no hydrogen 2.973 N/A ASN 488.A ND2 THR 404.A O no hydrogen 2.907 N/A ASN 488.A ND2 THR 566.A OG1 no hydrogen 2.944 N/A GLY 489.A N ALA 475.A O no hydrogen 2.673 N/A ALA 490.A N THR 435.A O no hydrogen 2.935 N/A LEU 492.A N HIS 433.A O no hydrogen 2.772 N/A ARG 493.A N ILE 560.A O no hydrogen 2.732 N/A ARG 493.A NE TYR 495.A OH no hydrogen 3.007 N/A ARG 493.A NH1 GLU 584.A OE1 no hydrogen 2.917 N/A ARG 493.A NH1 SER 588.A OG no hydrogen 2.815 N/A ARG 493.A NH2 TYR 495.A OH no hydrogen 3.046 N/A ARG 493.A NH2 ILE 587.A O no hydrogen 3.002 N/A VAL 494.A N GLY 431.A O no hydrogen 2.746 N/A TYR 495.A N VAL 558.A O no hydrogen 2.853 N/A TYR 495.A OH HIS 419.A ND1 no hydrogen 2.666 N/A VAL 496.A N VAL 428.A O no hydrogen 2.964 N/A ARG 498.A N GLY 426.A O no hydrogen 2.730 N/A SER 500.A N PRO 497.A O no hydrogen 2.796 N/A LEU 501.A N ARG 498.A O no hydrogen 2.944 N/A GLY 503.A N SER 500.A O no hydrogen 2.989 N/A PHE 504.A N LEU 501.A O no hydrogen 2.924 N/A TYR 505.A N ALA 534.A O no hydrogen 2.906 N/A ARG 506.A N ALA 594.A O no hydrogen 2.779 N/A ARG 506.A NE TYR 593.A O no hydrogen 3.199 N/A THR 507.A N THR 536.A O no hydrogen 2.951 N/A LEU 509.A N THR 507.A OG1 no hydrogen 3.104 N/A THR 510.A OG1 PRO 538.A O no hydrogen 3.381 N/A LEU 511.A N PRO 538.A O no hydrogen 3.243 N/A ALA 513.A N THR 510.A O no hydrogen 2.742 N/A ALA 516.A N ALA 513.A O no hydrogen 3.218 N/A GLU 519.A N GLU 515.A O no hydrogen 3.172 N/A VAL 520.A N ALA 516.A O no hydrogen 2.938 N/A GLU 521.A N ALA 517.A O no hydrogen 2.982 N/A ARG 522.A N GLY 518.A O no hydrogen 2.954 N/A ARG 522.A NE GLU 519.A OE2 no hydrogen 2.929 N/A ARG 522.A NH2 GLU 519.A OE1 no hydrogen 2.787 N/A ARG 522.A NH2 GLU 519.A OE2 no hydrogen 3.516 N/A LEU 523.A N GLU 519.A O no hydrogen 2.929 N/A ILE 524.A N VAL 520.A O no hydrogen 2.851 N/A HIS 526.A ND1 PRO 527.A O no hydrogen 2.627 N/A HIS 526.A NE2 ASP 533.A OD2 no hydrogen 2.744 N/A LEU 528.A N GLU 521.A OE2 no hydrogen 2.839 N/A ARG 531.A N ASP 533.A OD1 no hydrogen 2.718 N/A ALA 534.A N GLY 503.A O no hydrogen 2.859 N/A ILE 535.A N ILE 548.A O no hydrogen 3.064 N/A THR 536.A N TYR 505.A O no hydrogen 2.906 N/A THR 536.A OG1 THR 547.A OG1 no hydrogen 2.579 N/A GLY 537.A N GLU 546.A O no hydrogen 3.062 N/A GLU 539.A N ARG 544.A O no hydrogen 2.902 N/A GLY 543.A N GLU 540.A O no hydrogen 2.827 N/A GLU 546.A N GLY 537.A O no hydrogen 2.955 N/A THR 547.A N ILE 464.A O no hydrogen 2.844 N/A THR 547.A OG1 THR 536.A OG1 no hydrogen 2.579 N/A ILE 548.A N ILE 535.A O no hydrogen 2.855 N/A LEU 549.A N PHE 462.A O no hydrogen 2.857 N/A GLY 550.A N ASP 533.A O no hydrogen 2.913 N/A ALA 554.A N GLY 550.A O no hydrogen 2.821 N/A GLU 555.A N TRP 551.A O no hydrogen 2.905 N/A ARG 556.A N LEU 553.A O no hydrogen 2.996 N/A ARG 556.A NE TYR 387.A OH no hydrogen 3.468 N/A ARG 556.A NH1 ALA 369.A O no hydrogen 2.934 N/A ARG 556.A NH2 GLY 370.A O no hydrogen 2.902 N/A ARG 556.A NH2 TYR 387.A OH no hydrogen 2.913 N/A THR 557.A N ALA 554.A O no hydrogen 3.184 N/A THR 557.A OG1 ALA 554.A O no hydrogen 2.726 N/A VAL 558.A N TYR 495.A O no hydrogen 2.971 N/A ILE 560.A N ARG 493.A O no hydrogen 3.007 N/A SER 562.A N LEU 491.A O no hydrogen 2.985 N/A SER 562.A OG GLU 584.A OE1 no hydrogen 2.698 N/A SER 562.A OG GLU 584.A OE2 no hydrogen 3.262 N/A ALA 563.A N GLU 584.A OE2 no hydrogen 2.804 N/A ILE 564.A N SER 562.A OG no hydrogen 2.915 N/A THR 566.A OG1 GLY 489.A O no hydrogen 2.633 N/A ASP 567.A N TYR 472.A OH no hydrogen 3.176 N/A ARG 569.A N ASP 567.A OD2 no hydrogen 3.077 N/A ASN 570.A N ASP 567.A O no hydrogen 3.044 N/A ASN 570.A ND2 ASP 567.A OD1 no hydrogen 2.890 N/A GLY 573.A N ASN 570.A O no hydrogen 2.906 N/A SER 578.A N ASP 576.A OD2 no hydrogen 3.259 N/A SER 578.A OG ASP 576.A OD2 no hydrogen 2.839 N/A SER 579.A N ASP 576.A O no hydrogen 2.737 N/A SER 579.A OG ASP 576.A O no hydrogen 2.602 N/A ILE 580.A N PRO 577.A O no hydrogen 3.068 N/A GLU 584.A N PRO 581.A O no hydrogen 2.947 N/A GLN 585.A N PRO 581.A O no hydrogen 3.012 N/A ALA 586.A N ASP 582.A O no hydrogen 3.024 N/A ILE 587.A N GLU 584.A O no hydrogen 2.926 N/A SER 588.A N GLN 585.A O no hydrogen 3.020 N/A SER 588.A OG TYR 432.A OH no hydrogen 3.275 N/A SER 588.A OG GLU 584.A O no hydrogen 2.645 N/A ALA 594.A N PHE 504.A O no hydrogen 3.002 N/A