Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8d9f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N THR 1.A O no hydrogen 2.962 N/A ASP 6.A N ARG 2.A O no hydrogen 2.935 N/A ARG 7.A N GLU 3.A O no hydrogen 2.850 N/A ARG 7.A NE SER 53.A OG no hydrogen 2.950 N/A ARG 7.A NH2 THR 50.A OG1 no hydrogen 2.855 N/A LYS 8.A N ASP 4.A O no hydrogen 2.896 N/A GLU 9.A N ILE 5.A O no hydrogen 2.965 N/A ALA 10.A N ASP 6.A O no hydrogen 2.891 N/A GLU 11.A N ARG 7.A O no hydrogen 2.838 N/A ARG 12.A N LYS 8.A O no hydrogen 2.925 N/A ARG 12.A NH2 GLU 9.A OE1 no hydrogen 3.255 N/A LEU 13.A N GLU 9.A O no hydrogen 2.978 N/A LEU 14.A N ALA 10.A O no hydrogen 2.845 N/A ASP 15.A N GLU 11.A O no hydrogen 2.908 N/A GLU 16.A N ARG 12.A O no hydrogen 2.956 N/A ALA 17.A N LEU 13.A O no hydrogen 2.921 N/A PHE 18.A N LEU 14.A O no hydrogen 2.872 N/A ASN 19.A N GLU 16.A O no hydrogen 3.220 N/A ARG 21.A N ASN 19.A OD1 no hydrogen 3.096 N/A THR 22.A N ASN 19.A O no hydrogen 3.059 N/A THR 22.A OG1 GLU 16.A O no hydrogen 3.047 N/A THR 22.A OG1 ASN 19.A O no hydrogen 3.353 N/A ARG 27.A N LYS 23.A O no hydrogen 2.903 N/A ARG 27.A NE ALA 17.A O no hydrogen 2.990 N/A ARG 27.A NH1 GLN 338.A OE1 no hydrogen 2.718 N/A ARG 27.A NH2 ASN 19.A O no hydrogen 3.316 N/A LYS 28.A N PRO 24.A O no hydrogen 2.947 N/A LYS 29.A NZ VAL 25.A O no hydrogen 2.726 N/A LYS 29.A NZ ASP 26.A OD1 no hydrogen 3.372 N/A ILE 30.A N ASP 26.A O no hydrogen 2.966 N/A ILE 31.A N ARG 27.A O no hydrogen 2.949 N/A ASN 32.A N LYS 28.A O no hydrogen 2.925 N/A SER 33.A N LYS 29.A O no hydrogen 2.945 N/A SER 33.A OG ILE 30.A O no hydrogen 2.665 N/A ALA 34.A N ILE 30.A O no hydrogen 2.992 N/A LEU 35.A N ILE 31.A O no hydrogen 2.898 N/A LYS 36.A N ASN 32.A O no hydrogen 2.931 N/A ILE 37.A N SER 33.A O no hydrogen 3.019 N/A LEU 38.A N ALA 34.A O no hydrogen 2.963 N/A ILE 39.A N LEU 35.A O no hydrogen 2.806 N/A GLY 40.A N LYS 36.A O no hydrogen 2.967 N/A LEU 41.A N ILE 37.A O no hydrogen 3.011 N/A TYR 42.A N LEU 38.A O no hydrogen 2.891 N/A LYS 43.A N ILE 39.A O no hydrogen 2.840 N/A GLU 44.A N GLY 40.A O no hydrogen 3.005 N/A LYS 45.A N LEU 41.A O no hydrogen 3.114 N/A LYS 45.A NZ GLU 44.A OE1 no hydrogen 3.096 N/A LYS 45.A NZ GLU 44.A OE2 no hydrogen 2.543 N/A THR 50.A N GLU 3.A OE2 no hydrogen 2.597 N/A THR 50.A OG1 GLU 3.A OE2 no hydrogen 2.471 N/A SER 53.A N THR 50.A O no hydrogen 3.153 N/A SER 53.A OG GLU 3.A OE2 no hydrogen 3.161 N/A PHE 54.A N THR 50.A O no hydrogen 3.437 N/A ILE 55.A N SER 51.A O no hydrogen 2.923 N/A SER 56.A N ALA 52.A O no hydrogen 2.903 N/A SER 56.A OG GLU 11.A OE2 no hydrogen 2.203 N/A SER 56.A OG ALA 52.A O no hydrogen 3.103 N/A ILE 57.A N SER 53.A O no hydrogen 2.910 N/A ALA 58.A N PHE 54.A O no hydrogen 2.960 N/A ARG 59.A N ILE 55.A O no hydrogen 2.919 N/A ALA 60.A N SER 56.A O no hydrogen 2.888 N/A TYR 61.A N ILE 57.A O no hydrogen 2.935 N/A TYR 62.A N ALA 58.A O no hydrogen 2.940 N/A LEU 63.A N ARG 59.A O no hydrogen 3.011 N/A VAL 64.A N ALA 60.A O no hydrogen 2.902 N/A SER 65.A N TYR 61.A O no hydrogen 2.932 N/A SER 65.A OG TYR 62.A O no hydrogen 2.548 N/A ILE 66.A N TYR 62.A O no hydrogen 2.980 N/A THR 67.A N LEU 63.A O no hydrogen 2.962 N/A THR 67.A OG1 VAL 64.A O no hydrogen 2.802 N/A ILE 68.A N VAL 64.A O no hydrogen 3.255 N/A LYS 71.A NZ GLU 313.A OE1 no hydrogen 3.120 N/A LYS 71.A NZ GLU 313.A OE2 no hydrogen 2.899 N/A LYS 79.A NZ TYR 337.A OH no hydrogen 2.669 N/A LYS 80.A NZ ASP 122.A OD2 no hydrogen 2.713 N/A GLU 81.A N GLU 77.A O no hydrogen 2.919 N/A ALA 82.A N LYS 78.A O no hydrogen 2.937 N/A LEU 83.A N LYS 79.A O no hydrogen 2.959 N/A ARG 84.A N LYS 80.A O no hydrogen 2.882 N/A ARG 84.A NE GLU 81.A OE1 no hydrogen 3.393 N/A ARG 84.A NH2 GLU 81.A OE1 no hydrogen 2.675 N/A LYS 85.A N GLU 81.A O no hydrogen 2.906 N/A GLY 86.A N ALA 82.A O no hydrogen 2.991 N/A ILE 87.A N LEU 83.A O no hydrogen 2.921 N/A GLU 88.A N ARG 84.A O no hydrogen 2.899 N/A PHE 89.A N LYS 85.A O no hydrogen 2.935 N/A ILE 90.A N GLY 86.A O no hydrogen 2.979 N/A ASP 91.A N ILE 87.A O no hydrogen 2.847 N/A ARG 92.A N GLU 88.A O no hydrogen 2.931 N/A ARG 92.A NH2 TYR 42.A OH no hydrogen 3.252 N/A ALA 93.A N PHE 89.A O no hydrogen 2.956 N/A ILE 94.A N ILE 90.A O no hydrogen 2.887 N/A ASN 95.A N ASP 91.A O no hydrogen 2.877 N/A ASP 103.A N SER 100.A OG no hydrogen 3.121 N/A SER 104.A N SER 100.A O no hydrogen 3.007 N/A SER 104.A OG ILE 101.A O no hydrogen 2.520 N/A GLN 105.A N ILE 101.A O no hydrogen 2.893 N/A GLN 105.A NE2 LYS 141.A O no hydrogen 3.112 N/A ARG 106.A N LEU 102.A O no hydrogen 2.915 N/A ALA 107.A N ASP 103.A O no hydrogen 2.894 N/A PHE 108.A N SER 104.A O no hydrogen 2.898 N/A ARG 109.A N GLN 105.A O no hydrogen 2.861 N/A ARG 109.A NE ASP 152.A OD1 no hydrogen 3.100 N/A ILE 110.A N ARG 106.A O no hydrogen 2.969 N/A LYS 111.A N ALA 107.A O no hydrogen 2.912 N/A SER 112.A N PHE 108.A O no hydrogen 2.855 N/A SER 112.A OG PHE 108.A O no hydrogen 3.011 N/A SER 112.A OG ARG 109.A O no hydrogen 2.469 N/A VAL 113.A N ARG 109.A O no hydrogen 2.968 N/A LEU 114.A N ILE 110.A O no hydrogen 2.934 N/A SER 115.A N LYS 111.A O no hydrogen 2.889 N/A SER 115.A OG LYS 111.A O no hydrogen 3.419 N/A ILE 116.A N SER 112.A O no hydrogen 2.871 N/A GLU 117.A N VAL 113.A O no hydrogen 3.020 N/A PHE 118.A N LEU 114.A O no hydrogen 2.898 N/A ASN 119.A N SER 115.A O no hydrogen 2.848 N/A ARG 120.A N ILE 116.A O no hydrogen 2.947 N/A ARG 120.A NE GLU 117.A OE1 no hydrogen 3.509 N/A ARG 120.A NH2 GLU 117.A OE2 no hydrogen 2.264 N/A ILE 121.A N GLU 117.A O no hydrogen 2.984 N/A ASP 122.A N PHE 118.A O no hydrogen 2.870 N/A LYS 125.A N ASP 122.A OD1 no hydrogen 2.873 N/A ASN 128.A N ASP 127.A OD1 no hydrogen 2.575 N/A LYS 130.A NZ LYS 125.A O no hydrogen 2.894 N/A LEU 131.A N ASP 127.A O no hydrogen 3.257 N/A LYS 132.A N ASN 128.A O no hydrogen 2.860 N/A ASN 133.A N ILE 129.A O no hydrogen 2.953 N/A LEU 134.A N LYS 130.A O no hydrogen 2.921 N/A LEU 135.A N LEU 131.A O no hydrogen 2.885 N/A ASN 136.A N LYS 132.A O no hydrogen 2.920 N/A GLU 137.A N ASN 133.A O no hydrogen 2.969 N/A ALA 138.A N LEU 134.A O no hydrogen 2.877 N/A VAL 139.A N LEU 135.A O no hydrogen 2.930 N/A ASP 140.A N ASN 136.A O no hydrogen 2.924 N/A LYS 141.A N GLU 137.A O no hydrogen 2.767 N/A GLY 142.A N VAL 139.A O no hydrogen 3.090 N/A CYS 143.A N ALA 138.A O no hydrogen 3.015 N/A CYS 143.A SG GLN 105.A O no hydrogen 3.245 N/A THR 144.A OG1 THR 144.A O no hydrogen 2.461 N/A THR 144.A OG1 HIS 169.A ND1 no hydrogen 3.067 N/A THR 148.A N ASP 145.A O no hydrogen 3.502 N/A ASP 152.A N TYR 149.A O no hydrogen 3.083 N/A GLN 154.A N GLU 150.A O no hydrogen 2.962 N/A GLN 154.A NE2 GLU 150.A OE1 no hydrogen 2.334 N/A ILE 155.A N TRP 151.A O no hydrogen 2.912 N/A ALA 156.A N ASP 152.A O no hydrogen 2.946 N/A ILE 157.A N ILE 153.A O no hydrogen 2.892 N/A ARG 158.A N GLN 154.A O no hydrogen 2.934 N/A LEU 159.A N ILE 155.A O no hydrogen 2.912 N/A CYS 160.A N ALA 156.A O no hydrogen 2.887 N/A CYS 160.A SG ALA 156.A O no hydrogen 3.047 N/A GLU 161.A N ILE 157.A O no hydrogen 2.927 N/A LEU 162.A N ARG 158.A O no hydrogen 2.917 N/A GLY 163.A N LEU 159.A O no hydrogen 3.001 N/A GLU 167.A N ASP 165.A OD1 no hydrogen 2.941 N/A HIS 169.A N MET 166.A O no hydrogen 3.188 N/A HIS 169.A ND1 THR 144.A OG1 no hydrogen 3.067 N/A PHE 170.A N GLU 167.A O no hydrogen 2.904 N/A LEU 173.A N HIS 169.A O no hydrogen 2.894 N/A ILE 174.A N PHE 170.A O no hydrogen 2.821 N/A ILE 174.A N ASP 171.A O no hydrogen 2.941 N/A LYS 175.A N ASP 171.A O no hydrogen 2.869 N/A LYS 178.A N SER 176.A OG no hydrogen 2.910 N/A ASN 180.A N GLN 183.A OE1 no hydrogen 2.970 N/A GLN 183.A NE2 GLU 150.A OE2 no hydrogen 2.832 N/A LYS 184.A N ASN 180.A O no hydrogen 2.914 N/A ALA 185.A N ASP 181.A O no hydrogen 2.903 N/A LYS 186.A N LEU 182.A O no hydrogen 2.887 N/A LYS 186.A NZ GLU 161.A OE2 no hydrogen 2.966 N/A ALA 187.A N GLN 183.A O no hydrogen 2.892 N/A TYR 188.A N LYS 184.A O no hydrogen 2.915 N/A TYR 189.A N ALA 185.A O no hydrogen 2.926 N/A TYR 189.A OH ASP 232.A OD2 no hydrogen 2.832 N/A PHE 190.A N LYS 186.A O no hydrogen 2.890 N/A ILE 191.A N ALA 187.A O no hydrogen 2.960 N/A ASP 194.A N TYR 188.A O no hydrogen 3.230 N/A LYS 197.A N ASP 194.A OD1 no hydrogen 2.663 N/A ALA 198.A N ASP 194.A O no hydrogen 2.989 N/A LYS 199.A N ASP 195.A O no hydrogen 2.871 N/A LYS 199.A NZ ASP 203.A OD2 no hydrogen 3.438 N/A GLU 200.A N HIS 196.A O no hydrogen 2.949 N/A HIS 201.A N LYS 197.A O no hydrogen 2.959 N/A MET 202.A N ALA 198.A O no hydrogen 2.859 N/A ASP 203.A N LYS 199.A O no hydrogen 2.896 N/A LYS 204.A N GLU 200.A O no hydrogen 3.032 N/A CYS 205.A N HIS 201.A O no hydrogen 2.876 N/A THR 206.A N MET 202.A O no hydrogen 2.951 N/A THR 206.A OG1 ASP 203.A O no hydrogen 2.789 N/A ALA 207.A N ASP 203.A O no hydrogen 2.935 N/A SER 208.A N LYS 204.A O no hydrogen 2.951 N/A SER 208.A OG LYS 204.A O no hydrogen 3.359 N/A SER 208.A OG CYS 205.A O no hydrogen 2.305 N/A LEU 209.A N CYS 205.A O no hydrogen 2.827 N/A LYS 210.A N THR 206.A O no hydrogen 3.025 N/A LYS 210.A N ALA 207.A O no hydrogen 3.381 N/A TYR 211.A N SER 208.A O no hydrogen 3.216 N/A THR 212.A N LEU 209.A O no hydrogen 3.042 N/A SER 215.A OG CYS 333.A O no hydrogen 2.416 N/A HIS 216.A N PRO 213.A O no hydrogen 3.039 N/A ARG 217.A NE GLU 221.A OE2 no hydrogen 2.761 N/A ARG 217.A NH2 GLU 221.A OE2 no hydrogen 2.998 N/A LEU 218.A N HIS 216.A ND1 no hydrogen 3.046 N/A TRP 219.A NE1 THR 212.A O no hydrogen 3.209 N/A GLU 221.A N ARG 217.A O no hydrogen 2.953 N/A THR 222.A N LEU 218.A O no hydrogen 2.856 N/A THR 222.A OG1 LEU 218.A O no hydrogen 2.619 N/A VAL 223.A N TRP 219.A O no hydrogen 2.937 N/A GLY 224.A N ASP 220.A O no hydrogen 2.932 N/A PHE 225.A N GLU 221.A O no hydrogen 2.853 N/A ILE 226.A N THR 222.A O no hydrogen 2.946 N/A GLU 227.A N VAL 223.A O no hydrogen 2.895 N/A ARG 228.A N GLY 224.A O no hydrogen 2.908 N/A ARG 228.A NE ASP 232.A OD1 no hydrogen 3.319 N/A ARG 228.A NE ASP 232.A OD2 no hydrogen 3.319 N/A ARG 228.A NH1 GLU 161.A O no hydrogen 3.301 N/A LEU 229.A N PHE 225.A O no hydrogen 2.895 N/A LYS 230.A N ILE 226.A O no hydrogen 2.900 N/A GLY 231.A N GLU 227.A O no hydrogen 2.906 N/A ASP 232.A N ARG 228.A O no hydrogen 2.898 N/A SER 233.A N LYS 230.A O no hydrogen 3.025 N/A SER 234.A N LEU 229.A O no hydrogen 3.104 N/A LEU 236.A N SER 234.A OG no hydrogen 3.420 N/A TRP 237.A N SER 234.A O no hydrogen 3.352 N/A PHE 240.A N LEU 236.A O no hydrogen 3.229 N/A ALA 241.A N TRP 237.A O no hydrogen 2.809 N/A ILE 242.A N ARG 238.A O no hydrogen 3.188 N/A LYS 243.A N ASP 239.A O no hydrogen 2.947 N/A THR 244.A N PHE 240.A O no hydrogen 2.765 N/A THR 244.A OG1 PHE 240.A O no hydrogen 3.098 N/A TYR 245.A N ALA 241.A O no hydrogen 2.659 N/A ARG 246.A N ILE 242.A O no hydrogen 2.909 N/A SER 247.A N LYS 243.A O no hydrogen 3.172 N/A SER 247.A OG THR 206.A O no hydrogen 3.169 N/A CYS 248.A N THR 244.A O no hydrogen 2.980 N/A CYS 248.A SG HIS 267.A NE2 no hydrogen 3.877 N/A CYS 248.A SG TYR 271.A OH no hydrogen 3.847 N/A ARG 249.A N TYR 245.A O no hydrogen 3.186 N/A ARG 249.A NE SER 300.A OG no hydrogen 3.065 N/A VAL 250.A N ARG 246.A O no hydrogen 3.252 N/A GLN 251.A N SER 247.A O no hydrogen 2.871 N/A GLN 251.A NE2 LYS 210.A O no hydrogen 3.018 N/A GLU 252.A N CYS 248.A O no hydrogen 2.797 N/A LYS 253.A N VAL 250.A O no hydrogen 2.954 N/A ARG 259.A NH1 SER 303.A O no hydrogen 3.131 N/A ARG 259.A NH1 SER 477.A OG no hydrogen 2.563 N/A ARG 261.A NE GLU 252.A OE1 no hydrogen 2.936 N/A ARG 261.A NH1 LEU 301.A O no hydrogen 3.414 N/A ARG 261.A NH2 GLU 252.A OE1 no hydrogen 2.756 N/A ARG 261.A NH2 GLU 252.A OE2 no hydrogen 2.910 N/A ARG 261.A NH2 SER 300.A O no hydrogen 3.361 N/A ARG 266.A NE ASP 220.A OD1 no hydrogen 3.328 N/A HIS 267.A N TRP 264.A O no hydrogen 3.012 N/A ARG 268.A NE ASP 272.A OD1 no hydrogen 3.326 N/A ARG 268.A NH1 LEU 361.A O no hydrogen 2.927 N/A LEU 270.A N ARG 266.A O no hydrogen 2.905 N/A TYR 271.A N HIS 267.A O no hydrogen 3.259 N/A ASP 272.A N ARG 268.A O no hydrogen 2.863 N/A MET 273.A N VAL 269.A O no hydrogen 2.869 N/A ALA 274.A N LEU 270.A O no hydrogen 2.917 N/A PHE 275.A N TYR 271.A O no hydrogen 2.771 N/A LEU 276.A N ASP 272.A O no hydrogen 3.000 N/A ALA 277.A N MET 273.A O no hydrogen 2.858 N/A VAL 278.A N ALA 274.A O no hydrogen 3.096 N/A LYS 279.A N PHE 275.A O no hydrogen 2.955 N/A GLU 280.A N LEU 276.A O no hydrogen 2.697 N/A GLN 281.A N ALA 277.A O no hydrogen 2.746 N/A ALA 282.A N VAL 278.A O no hydrogen 2.641 N/A ALA 282.A N LYS 279.A O no hydrogen 2.915 N/A ASP 283.A N LYS 279.A O no hydrogen 3.380 N/A LYS 287.A N VAL 284.A O no hydrogen 2.891 N/A GLN 288.A N VAL 284.A O no hydrogen 3.378 N/A GLN 288.A NE2 TRP 380.A O no hydrogen 3.164 N/A ALA 289.A N ASN 285.A O no hydrogen 2.940 N/A LYS 290.A N VAL 286.A O no hydrogen 2.903 N/A LYS 290.A NZ GLN 281.A O no hydrogen 3.542 N/A LYS 290.A NZ GLN 281.A OE1 no hydrogen 3.197 N/A ILE 291.A N LYS 287.A O no hydrogen 2.955 N/A LYS 292.A N GLN 288.A O no hydrogen 2.919 N/A LYS 293.A N ALA 289.A O no hydrogen 2.890 N/A LEU 294.A N LYS 290.A O no hydrogen 2.917 N/A ALA 295.A N ILE 291.A O no hydrogen 2.999 N/A GLU 296.A N LYS 292.A O no hydrogen 2.888 N/A ILE 297.A N LYS 293.A O no hydrogen 2.889 N/A SER 298.A N LEU 294.A O no hydrogen 3.010 N/A SER 298.A OG ALA 295.A O no hydrogen 2.488 N/A ASP 299.A N ALA 295.A O no hydrogen 2.908 N/A SER 300.A N GLU 296.A O no hydrogen 2.887 N/A SER 300.A OG GLU 296.A O no hydrogen 3.209 N/A LEU 301.A N ILE 297.A O no hydrogen 2.974 N/A LYS 302.A N SER 298.A O no hydrogen 2.954 N/A LYS 302.A NZ PHE 359.A O no hydrogen 3.185 N/A LYS 302.A NZ VAL 441.A O no hydrogen 2.842 N/A SER 303.A OG ASP 299.A O no hydrogen 2.546 N/A ARG 304.A NH1 GLU 252.A OE2 no hydrogen 3.394 N/A ARG 304.A NH2 GLU 254.A O no hydrogen 3.538 N/A PHE 305.A N ARG 259.A O no hydrogen 3.369 N/A SER 306.A N GLU 595.A OE1 no hydrogen 2.898 N/A SER 306.A OG GLU 595.A OE1 no hydrogen 2.736 N/A SER 310.A N LYS 71.A O no hydrogen 3.359 N/A ASP 311.A N ARG 308.A O no hydrogen 3.147 N/A MET 312.A N ARG 308.A O no hydrogen 2.868 N/A GLU 313.A N LEU 309.A O no hydrogen 2.880 N/A SER 318.A OG SER 322.A OG no hydrogen 2.743 N/A SER 322.A OG SER 318.A OG no hydrogen 2.743 N/A SER 322.A OG ASP 319.A O no hydrogen 2.576 N/A ASN 323.A N ASP 319.A O no hydrogen 2.949 N/A ASN 323.A ND2 SER 318.A O no hydrogen 2.497 N/A HIS 324.A N ASP 320.A O no hydrogen 3.016 N/A GLU 325.A N GLU 321.A O no hydrogen 2.907 N/A PHE 326.A N SER 322.A O no hydrogen 2.935 N/A LYS 327.A N ASN 323.A O no hydrogen 2.879 N/A LYS 328.A N HIS 324.A O no hydrogen 2.914 N/A PHE 329.A N GLU 325.A O no hydrogen 2.957 N/A LEU 330.A N PHE 326.A O no hydrogen 2.913 N/A ASP 331.A N LYS 327.A O no hydrogen 2.895 N/A LYS 332.A N LYS 328.A O no hydrogen 2.948 N/A CYS 333.A N PHE 329.A O no hydrogen 2.960 N/A VAL 334.A N LEU 330.A O no hydrogen 2.967 N/A THR 335.A N ASP 331.A O no hydrogen 2.913 N/A THR 335.A OG1 ASP 331.A O no hydrogen 2.965 N/A ALA 336.A N LYS 332.A O no hydrogen 2.948 N/A TYR 337.A N CYS 333.A O no hydrogen 2.940 N/A GLN 338.A N VAL 334.A O no hydrogen 3.023 N/A GLN 338.A NE2 THR 67.A O no hydrogen 3.511 N/A ASP 339.A N THR 335.A O no hydrogen 2.867 N/A GLY 340.A N ALA 336.A O no hydrogen 2.996 N/A TYR 341.A N GLN 338.A O no hydrogen 3.003 N/A VAL 342.A N GLN 338.A O no hydrogen 3.034 N/A ILE 343.A N ASP 339.A O no hydrogen 3.067 N/A GLU 346.A N GLU 346.A OE1 no hydrogen 2.741 N/A GLU 346.A N GLN 349.A OE1 no hydrogen 2.629 N/A GLN 349.A N GLU 346.A O no hydrogen 3.337 N/A VAL 350.A N THR 348.A O no hydrogen 2.712 N/A TRP 354.A N PRO 351.A O no hydrogen 3.244 N/A VAL 355.A N ASP 437.A O no hydrogen 2.881 N/A VAL 356.A N PHE 373.A O no hydrogen 2.978 N/A VAL 357.A N LEU 439.A O no hydrogen 2.928 N/A HIS 358.A N ILE 371.A O no hydrogen 2.887 N/A PHE 359.A N VAL 441.A O no hydrogen 3.179 N/A TYR 360.A N ASN 369.A O no hydrogen 2.921 N/A TYR 360.A OH ASP 272.A OD1 no hydrogen 2.410 N/A LEU 361.A N HIS 443.A ND1 no hydrogen 2.930 N/A ASN 362.A N MET 367.A O no hydrogen 2.854 N/A LEU 364.A N ASP 272.A OD2 no hydrogen 3.176 N/A MET 367.A N ASN 362.A O no hydrogen 2.962 N/A GLY 368.A N PHE 385.A O no hydrogen 2.905 N/A ASN 369.A N TYR 360.A O no hydrogen 2.859 N/A ALA 370.A N LYS 383.A O no hydrogen 2.874 N/A ILE 371.A N HIS 358.A O no hydrogen 2.850 N/A VAL 372.A N GLN 381.A O no hydrogen 2.839 N/A PHE 373.A N VAL 356.A O no hydrogen 2.870 N/A ASP 374.A N SER 379.A O no hydrogen 2.897 N/A CYS 376.A N ASP 374.A OD1 no hydrogen 3.191 N/A CYS 376.A SG GLU 352.A OE2 no hydrogen 3.124 N/A ASN 378.A N LYS 375.A O no hydrogen 3.037 N/A SER 379.A N ASP 374.A O no hydrogen 2.943 N/A TRP 380.A N GLN 288.A OE1 no hydrogen 2.824 N/A GLN 381.A N VAL 372.A O no hydrogen 2.992 N/A GLN 381.A NE2 ASN 430.A O no hydrogen 3.295 N/A LYS 383.A N ALA 370.A O no hydrogen 2.897 N/A PHE 385.A N GLY 368.A O no hydrogen 2.898 N/A LYS 388.A NZ GLY 366.A O no hydrogen 3.569 N/A PHE 391.A N TYR 387.A O no hydrogen 3.074 N/A GLU 392.A N LYS 388.A O no hydrogen 2.955 N/A VAL 393.A N GLU 389.A O no hydrogen 2.932 N/A PHE 394.A N LEU 390.A O no hydrogen 2.906 N/A LEU 395.A N PHE 391.A O no hydrogen 2.878 N/A THR 396.A N GLU 392.A O no hydrogen 2.949 N/A THR 396.A OG1 GLU 392.A O no hydrogen 3.079 N/A TRP 397.A N VAL 393.A O no hydrogen 2.936 N/A GLN 398.A N PHE 394.A O no hydrogen 2.860 N/A GLN 398.A NE2 LEU 589.A O no hydrogen 3.392 N/A ALA 399.A N LEU 395.A O no hydrogen 2.930 N/A ASN 400.A N THR 396.A O no hydrogen 2.985 N/A ASN 400.A ND2 THR 396.A O no hydrogen 2.874 N/A TYR 401.A N TRP 397.A O no hydrogen 2.866 N/A TYR 401.A OH THR 583.A OG1 no hydrogen 3.422 N/A ASN 402.A N GLN 398.A O no hydrogen 2.931 N/A ASN 402.A ND2 GLN 398.A O no hydrogen 3.335 N/A LEU 403.A N ALA 399.A O no hydrogen 3.040 N/A TYR 404.A N ASN 400.A O no hydrogen 2.845 N/A LEU 412.A N ALA 408.A O no hydrogen 2.977 N/A VAL 413.A N ALA 409.A O no hydrogen 2.911 N/A THR 414.A N GLU 410.A O no hydrogen 2.929 N/A THR 414.A OG1 GLU 410.A O no hydrogen 3.038 N/A LEU 415.A N HIS 411.A O no hydrogen 2.884 N/A CYS 416.A N LEU 412.A O no hydrogen 2.924 N/A CYS 416.A SG LEU 412.A O no hydrogen 3.554 N/A CYS 416.A SG GLY 453.A O no hydrogen 3.161 N/A LYS 417.A N VAL 413.A O no hydrogen 2.949 N/A LYS 418.A N THR 414.A O no hydrogen 2.905 N/A LYS 418.A NZ GLU 389.A OE1 no hydrogen 3.107 N/A LYS 418.A NZ GLU 421.A OE2 no hydrogen 2.883 N/A ILE 419.A N LEU 415.A O no hydrogen 2.897 N/A GLY 420.A N CYS 416.A O no hydrogen 2.923 N/A GLU 421.A N LYS 417.A O no hydrogen 2.953 N/A THR 422.A N LYS 418.A O no hydrogen 2.886 N/A THR 422.A OG1 LYS 418.A O no hydrogen 2.948 N/A THR 422.A OG1 GLU 421.A OE2 no hydrogen 3.094 N/A MET 423.A N ILE 419.A O no hydrogen 3.178 N/A LEU 426.A N MET 423.A O no hydrogen 3.193 N/A PHE 427.A N PRO 424.A O no hydrogen 2.913 N/A CYS 428.A N PHE 425.A O no hydrogen 3.170 N/A ILE 432.A N CYS 428.A O no hydrogen 3.126 N/A VAL 438.A N SER 469.A O no hydrogen 2.746 N/A LEU 439.A N VAL 355.A O no hydrogen 2.951 N/A PHE 440.A N CYS 471.A O no hydrogen 2.861 N/A VAL 441.A N VAL 357.A O no hydrogen 2.870 N/A PHE 445.A N ASP 444.A OD1 no hydrogen 2.626 N/A HIS 447.A N ASP 444.A O no hydrogen 3.004 N/A HIS 447.A ND1 ASP 444.A O no hydrogen 3.024 N/A HIS 447.A NE2 PRO 474.A O no hydrogen 3.271 N/A ARG 448.A N PHE 445.A O no hydrogen 2.910 N/A ARG 448.A NE ASP 594.A OD2 no hydrogen 2.755 N/A ARG 448.A NH2 ASP 594.A OD2 no hydrogen 3.205 N/A LEU 449.A N LEU 446.A O no hydrogen 3.356 N/A LEU 451.A N LEU 449.A O no hydrogen 2.986 N/A HIS 452.A N TYR 472.A OH no hydrogen 3.015 N/A HIS 452.A ND1 TYR 472.A OH no hydrogen 2.586 N/A HIS 452.A NE2 ILE 661.A O no hydrogen 2.971 N/A GLY 453.A N PRO 450.A O no hydrogen 2.652 N/A SER 454.A N LEU 451.A O no hydrogen 2.988 N/A SER 454.A OG LEU 451.A O no hydrogen 2.430 N/A GLU 456.A N LYS 462.A O no hydrogen 3.281 N/A LEU 463.A N GLU 466.A OE1 no hydrogen 2.920 N/A PHE 464.A N SER 454.A O no hydrogen 2.738 N/A LEU 465.A N HIS 452.A O no hydrogen 3.124 N/A GLU 466.A N LEU 463.A O no hydrogen 3.241 N/A ASN 467.A N PHE 464.A O no hydrogen 3.225 N/A HIS 468.A N PHE 464.A O no hydrogen 3.189 N/A HIS 468.A NE2 PRO 433.A O no hydrogen 2.947 N/A CYS 470.A SG HIS 468.A O no hydrogen 3.416 N/A CYS 471.A N VAL 438.A O no hydrogen 2.934 N/A TYR 472.A N SER 665.A O no hydrogen 2.904 N/A TYR 472.A OH HIS 452.A ND1 no hydrogen 2.586 N/A LEU 473.A N PHE 440.A O no hydrogen 3.122 N/A TRP 476.A NE1 LEU 345.A O no hydrogen 3.155 N/A SER 477.A N ASP 299.A OD1 no hydrogen 3.161 N/A PHE 478.A N ALA 475.A O no hydrogen 2.837 N/A ALA 479.A N TRP 476.A O no hydrogen 3.051 N/A LYS 482.A NZ GLU 483.A O no hydrogen 2.853 N/A THR 486.A OG1 SER 487.A O no hydrogen 3.337 N/A THR 486.A OG1 ASN 530.A O no hydrogen 2.317 N/A SER 487.A N ASN 530.A O no hydrogen 3.120 N/A VAL 491.A N LEU 533.A O no hydrogen 2.884 N/A LEU 492.A N SER 514.A OG no hydrogen 3.065 N/A LEU 493.A N THR 535.A O no hydrogen 3.202 N/A LYS 494.A N VAL 515.A O no hydrogen 3.286 N/A LYS 494.A NZ PHE 496.A O no hydrogen 2.951 N/A ASN 495.A N LEU 537.A O no hydrogen 3.103 N/A ASN 495.A ND2 LYS 553.A O no hydrogen 3.308 N/A GLN 505.A N PHE 501.A O no hydrogen 3.037 N/A GLN 505.A N GLU 502.A O no hydrogen 3.345 N/A ASN 506.A N THR 503.A O no hydrogen 3.043 N/A ASN 507.A ND2 GLU 628.A OE2 no hydrogen 2.628 N/A TRP 510.A NE1 LEU 504.A O no hydrogen 3.035 N/A GLY 511.A N TYR 490.A O no hydrogen 2.519 N/A GLN 513.A N GLU 489.A OE1 no hydrogen 3.457 N/A GLN 513.A NE2 GLU 489.A OE2 no hydrogen 2.609 N/A GLN 513.A NE2 ARG 528.A O no hydrogen 3.576 N/A SER 514.A N GLY 511.A O no hydrogen 3.170 N/A SER 514.A OG GLY 511.A O no hydrogen 2.953 N/A VAL 515.A N LEU 492.A O no hydrogen 2.771 N/A LYS 516.A NZ GLN 505.A O no hydrogen 2.753 N/A SER 520.A N ASP 523.A OD2 no hydrogen 2.550 N/A SER 520.A OG ASP 523.A OD2 no hydrogen 2.471 N/A SER 521.A N ALA 555.A O no hydrogen 3.230 N/A LEU 524.A N SER 520.A O no hydrogen 3.389 N/A GLU 525.A N SER 521.A O no hydrogen 2.901 N/A ASN 526.A N ASP 522.A O no hydrogen 2.925 N/A ILE 527.A N LEU 524.A O no hydrogen 3.334 N/A ARG 528.A N GLN 513.A OE1 no hydrogen 3.243 N/A ASN 530.A ND2 SER 485.A O no hydrogen 3.443 N/A ARG 532.A N GLU 489.A O no hydrogen 2.772 N/A ARG 532.A NH2 GLU 635.A OE2 no hydrogen 2.212 N/A LEU 533.A N GLU 489.A O no hydrogen 3.466 N/A LEU 534.A N GLN 575.A O no hydrogen 2.874 N/A THR 535.A N VAL 491.A O no hydrogen 2.948 N/A LEU 537.A N LEU 493.A O no hydrogen 2.892 N/A CYS 538.A SG HIS 539.A O no hydrogen 3.740 N/A GLU 541.A N MET 551.A O no hydrogen 2.999 N/A ASN 543.A N SER 550.A OG no hydrogen 3.276 N/A SER 545.A OG ASP 311.A OD1 no hydrogen 2.954 N/A ASN 546.A N ASN 543.A OD1 no hydrogen 3.394 N/A PHE 548.A N ASN 546.A OD1 no hydrogen 2.871 N/A ARG 549.A N ASN 546.A O no hydrogen 3.296 N/A ARG 549.A NE ASN 543.A OD1 no hydrogen 3.312 N/A SER 550.A OG LEU 585.A O no hydrogen 3.360 N/A SER 550.A OG HIS 596.A NE2 no hydrogen 3.387 N/A MET 551.A N GLU 541.A O no hydrogen 2.743 N/A LEU 552.A N ILE 559.A O no hydrogen 2.869 N/A LYS 553.A N HIS 539.A O no hydrogen 2.761 N/A LYS 553.A NZ GLU 541.A OE2 no hydrogen 2.671 N/A LEU 554.A N LEU 552.A O no hydrogen 2.563 N/A ALA 555.A N ALA 519.A O no hydrogen 2.823 N/A ILE 559.A N LEU 552.A O no hydrogen 3.308 N/A THR 560.A N GLU 563.A OE1 no hydrogen 3.263 N/A TYR 561.A N SER 550.A O no hydrogen 3.119 N/A LEU 562.A N PHE 548.A O no hydrogen 3.270 N/A GLU 563.A N THR 560.A OG1 no hydrogen 3.346 N/A ILE 564.A N THR 560.A O no hydrogen 2.847 N/A LEU 565.A N TYR 561.A O no hydrogen 2.986 N/A ASN 566.A N LEU 562.A O no hydrogen 2.887 N/A ASN 566.A N GLU 563.A O no hydrogen 3.185 N/A SER 567.A N GLU 563.A O no hydrogen 2.900 N/A LYS 569.A NZ ASN 566.A O no hydrogen 2.689 N/A LYS 569.A NZ SER 567.A O no hydrogen 3.243 N/A LYS 572.A NZ LYS 569.A O no hydrogen 3.029 N/A GLY 573.A N GLY 607.A O no hydrogen 2.866 N/A SER 574.A N LEU 571.A O no hydrogen 3.054 N/A SER 574.A OG LEU 571.A O no hydrogen 2.682 N/A GLN 575.A N ARG 532.A O no hydrogen 3.232 N/A GLN 575.A NE2 ALA 609.A O no hydrogen 3.614 N/A VAL 576.A N GLY 610.A O no hydrogen 3.004 N/A ILE 577.A N LEU 534.A O no hydrogen 2.850 N/A LEU 578.A N VAL 612.A O no hydrogen 2.957 N/A GLY 579.A N ILE 536.A O no hydrogen 2.923 N/A CYS 581.A SG ASP 584.A OD2 no hydrogen 3.815 N/A THR 583.A OG1 TYR 401.A OH no hydrogen 3.422 N/A LEU 589.A N GLN 398.A OE1 no hydrogen 2.850 N/A HIS 596.A N ASP 594.A OD1 no hydrogen 3.052 N/A THR 601.A N SER 598.A O no hydrogen 2.955 N/A THR 601.A OG1 SER 598.A O no hydrogen 3.134 N/A LEU 603.A N VAL 599.A O no hydrogen 2.933 N/A LEU 604.A N ALA 600.A O no hydrogen 2.904 N/A LEU 605.A N THR 601.A O no hydrogen 2.906 N/A ILE 606.A N ALA 602.A O no hydrogen 2.917 N/A GLY 607.A N LEU 604.A O no hydrogen 3.212 N/A ALA 608.A N LEU 603.A O no hydrogen 2.985 N/A ALA 609.A N SER 574.A O no hydrogen 2.554 N/A VAL 611.A N ILE 666.A O no hydrogen 2.885 N/A VAL 612.A N VAL 576.A O no hydrogen 2.843 N/A GLY 613.A N ARG 664.A O no hydrogen 2.946 N/A THR 614.A OG1 ALA 580.A O no hydrogen 2.881 N/A THR 614.A OG1 TRP 616.A O no hydrogen 3.390 N/A MET 615.A N ALA 662.A O no hydrogen 2.594 N/A TRP 616.A NE1 TYR 658.A O no hydrogen 3.063 N/A LYS 617.A N TYR 401.A OH no hydrogen 2.740 N/A ARG 619.A NH1 ASN 621.A OD1 no hydrogen 3.320 N/A LYS 622.A N ARG 619.A O no hydrogen 2.992 N/A THR 623.A N ARG 619.A O no hydrogen 3.478 N/A LYS 624.A N SER 620.A O no hydrogen 2.918 N/A SER 625.A N ASN 621.A O no hydrogen 2.879 N/A LEU 626.A N LYS 622.A O no hydrogen 2.958 N/A ILE 627.A N THR 623.A O no hydrogen 2.914 N/A GLU 628.A N LYS 624.A O no hydrogen 2.903 N/A TRP 629.A N SER 625.A O no hydrogen 2.925 N/A LYS 630.A N LEU 626.A O no hydrogen 2.908 N/A LYS 630.A NZ ILE 634.A O no hydrogen 3.096 N/A LEU 631.A N ILE 627.A O no hydrogen 2.858 N/A GLU 632.A N GLU 628.A O no hydrogen 2.961 N/A GLU 635.A N ASN 633.A OD1 no hydrogen 3.326 N/A GLU 635.A N GLU 635.A OE1 no hydrogen 2.729 N/A TYR 636.A N ILE 634.A O no hydrogen 2.519 N/A ASN 639.A ND2 LEU 465.A O no hydrogen 3.621 N/A GLU 640.A N LYS 637.A O no hydrogen 3.229 N/A GLN 642.A N LEU 638.A O no hydrogen 2.947 N/A GLN 642.A NE2 PHE 663.A O no hydrogen 2.860 N/A LYS 643.A N ASN 639.A O no hydrogen 2.848 N/A LYS 643.A NZ GLU 640.A OE2 no hydrogen 2.502 N/A GLU 644.A N GLU 640.A O no hydrogen 3.005 N/A GLU 644.A N GLU 644.A OE1 no hydrogen 2.851 N/A THR 645.A N TRP 641.A O no hydrogen 3.170 N/A THR 645.A OG1 TRP 641.A O no hydrogen 3.153 N/A TYR 650.A OH GLY 461.A O no hydrogen 2.596 N/A HIS 653.A N ALA 649.A O no hydrogen 3.297 N/A HIS 653.A N ASP 652.A OD1 no hydrogen 2.339 N/A THR 656.A OG1 HIS 653.A O no hydrogen 2.681 N/A TYR 658.A N PRO 654.A O no hydrogen 2.851 N/A TYR 658.A OH LYS 617.A O no hydrogen 2.592 N/A ARG 659.A N PRO 655.A O no hydrogen 2.925 N/A SER 660.A N THR 656.A O no hydrogen 2.856 N/A SER 660.A OG THR 645.A O no hydrogen 2.973 N/A SER 660.A OG GLY 646.A O no hydrogen 3.284 N/A SER 660.A OG THR 656.A O no hydrogen 2.538 N/A ILE 661.A N PHE 657.A O no hydrogen 2.994 N/A ARG 664.A N GLY 613.A O no hydrogen 2.907 N/A ARG 664.A NH1 HIS 447.A O no hydrogen 2.875 N/A ILE 666.A N VAL 611.A O no hydrogen 2.854 N/A GLY 667.A N TYR 472.A O no hydrogen 2.704 N/A LEU 670.A N SER 480.A O no hydrogen 3.387 N/A