Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dtb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.A N GLN 2.A OE1 no hydrogen 2.875 N/A ASP 8.A N GLN 2.A OE1 no hydrogen 3.163 N/A PHE 9.A N GLU 30.A OE1 no hydrogen 2.786 N/A SER 10.A N ASP 8.A OD1 no hydrogen 2.937 N/A SER 10.A OG ASP 8.A OD1 no hydrogen 2.673 N/A LYS 12.A N PHE 9.A O no hydrogen 2.964 N/A LYS 12.A NZ.B GLU 39.A O no hydrogen 3.246 N/A VAL 13.A N SER 10.A O no hydrogen 3.246 N/A ILE 14.A N ILE 41.A O no hydrogen 2.823 N/A GLN 15.A NE2 ILE 43.A O no hydrogen 2.979 N/A GLN 15.A NE2 GLU 50.A OE1 no hydrogen 2.760 N/A SER 17.A OG.A ASP 19.A OD2.B no hydrogen 1.983 N/A SER 17.A OG.B ASP 19.A OD2.B no hydrogen 3.261 N/A SER 17.A OG.B SER 20.A OG.B no hydrogen 2.586 N/A SER 20.A N SER 17.A O no hydrogen 3.196 N/A SER 20.A OG.A SER 17.A OG.B no hydrogen 2.580 N/A SER 20.A OG.B SER 17.A O no hydrogen 3.082 N/A SER 20.A OG.B SER 17.A OG.B no hydrogen 2.586 N/A LEU 21.A N LEU 18.A O no hydrogen 3.304 N/A ARG 26.A N PRO 22.A O no hydrogen 2.964 N/A ARG 26.A NE GLU 30.A OE2 no hydrogen 3.020 N/A ARG 26.A NH1 ASP 19.A OD1.A no hydrogen 2.960 N/A ARG 26.A NH2 GLU 30.A OE1 no hydrogen 3.083 N/A ARG 26.A NH2 GLU 30.A OE2 no hydrogen 3.570 N/A LYS 27.A N GLN 23.A O no hydrogen 3.044 N/A PHE 28.A N GLU 24.A O no hydrogen 3.082 N/A VAL 29.A N VAL 25.A O no hydrogen 2.911 N/A GLU 30.A N ARG 26.A O no hydrogen 2.805 N/A GLY 31.A N LYS 27.A O no hydrogen 2.924 N/A ASN 32.A N PHE 28.A O no hydrogen 3.193 N/A ASN 32.A ND2 PHE 28.A O no hydrogen 3.010 N/A ALA 33.A N VAL 29.A O no hydrogen 2.838 N/A GLN 34.A N GLU 30.A O no hydrogen 2.912 N/A GLN 34.A NE2 LEU 7.A O no hydrogen 2.898 N/A LEU 35.A N GLY 31.A O no hydrogen 3.193 N/A CYS 36.A N ASN 32.A O no hydrogen 2.810 N/A CYS 36.A SG PHE 128.A O no hydrogen 3.966 N/A GLN 37.A N ALA 33.A O no hydrogen 2.810 N/A GLU 39.A N ARG 135.A O no hydrogen 2.797 N/A TYR 40.A N ARG 135.A O no hydrogen 3.415 N/A ILE 41.A N LYS 12.A O no hydrogen 2.876 N/A HIS 42.A N MET 137.A O no hydrogen 2.907 N/A HIS 42.A NE2 GLU 50.A OE1 no hydrogen 2.874 N/A ILE 43.A N GLN 15.A O no hydrogen 2.938 N/A CYS 44.A N VAL 139.A O no hydrogen 2.855 N/A CYS 44.A SG VAL 139.A O no hydrogen 3.449 N/A ASP 45.A N GLU 50.A OE1 no hydrogen 2.914 N/A GLY 46.A N GLU 50.A OE2 no hydrogen 2.848 N/A SER 47.A N ASP 45.A OD1 no hydrogen 2.863 N/A SER 47.A OG ASP 45.A OD1 no hydrogen 2.735 N/A SER 47.A OG ASP 45.A OD2 no hydrogen 3.548 N/A GLU 50.A N SER 47.A OG no hydrogen 3.018 N/A TYR 51.A N SER 47.A O no hydrogen 3.139 N/A GLY 52.A N GLU 48.A O no hydrogen 2.907 N/A ARG 53.A N GLU 49.A O no hydrogen 2.993 N/A LEU 54.A N GLU 50.A O no hydrogen 2.963 N/A LEU 55.A N TYR 51.A O no hydrogen 2.983 N/A ALA 56.A N GLY 52.A O no hydrogen 2.990 N/A HIS 57.A N ARG 53.A O no hydrogen 2.961 N/A HIS 57.A ND1 GLU 60.A OE1.A no hydrogen 2.818 N/A MET 58.A N LEU 54.A O no hydrogen 2.941 N/A GLN 59.A N LEU 55.A O no hydrogen 2.887 N/A GLU 60.A N ALA 56.A O no hydrogen 2.892 N/A GLU 61.A N HIS 57.A O no hydrogen 3.019 N/A GLY 62.A N GLN 59.A O no hydrogen 3.091 N/A VAL 63.A N MET 58.A O no hydrogen 2.933 N/A ILE 64.A N MET 58.A O no hydrogen 3.478 N/A ARG 65.A N LEU 75.A O no hydrogen 2.918 N/A ARG 65.A NE GLU 360.A OE1 no hydrogen 2.804 N/A ARG 65.A NH2 GLU 360.A OE2 no hydrogen 2.900 N/A LEU 67.A N CYS 73.A O no hydrogen 2.868 N/A LYS 69.A N GLY 364.A O no hydrogen 3.047 N/A LYS 69.A NZ.A ASP 363.A OD1 no hydrogen 2.945 N/A LYS 69.A NZ.B ASP 363.A OD1 no hydrogen 2.982 N/A TYR 70.A N LEU 67.A O no hydrogen 3.198 N/A CYS 73.A SG ASP 71.A O no hydrogen 3.625 N/A CYS 73.A SG ILE 349.A O no hydrogen 3.809 N/A TRP 74.A N THR 353.A O no hydrogen 3.015 N/A LEU 75.A N ARG 65.A O no hydrogen 2.825 N/A ALA 76.A N PHE 355.A O no hydrogen 2.844 N/A THR 78.A N ASN 357.A OD1 no hydrogen 2.855 N/A THR 78.A OG1 ASP 79.A O no hydrogen 3.034 N/A THR 78.A OG1 ASP 82.A O no hydrogen 3.087 N/A ARG 81.A N ASP 79.A OD1 no hydrogen 2.920 N/A ARG 81.A NE ASP 79.A OD1 no hydrogen 3.075 N/A ARG 81.A NE ASP 79.A OD2 no hydrogen 3.343 N/A ARG 81.A NH2 ASP 79.A OD2 no hydrogen 2.888 N/A ASP 82.A N ASP 79.A O no hydrogen 2.927 N/A ARG 85.A N ALA 465.A O no hydrogen 3.155 N/A ARG 85.A NH1 GLU 87.A OE2 no hydrogen 2.908 N/A ARG 85.A NH2 SER 284.A OG no hydrogen 2.997 N/A GLU 87.A N GLU 467.A OE1 no hydrogen 2.822 N/A SER 88.A N GLU 467.A OE2 no hydrogen 2.996 N/A LYS 89.A N ILE 86.A O no hydrogen 3.105 N/A THR 90.A N GLU 87.A O no hydrogen 3.128 N/A THR 90.A OG1 ILE 86.A O no hydrogen 2.776 N/A VAL 91.A N ILE 217.A O no hydrogen 2.843 N/A ILE 92.A N ARG 113.A O no hydrogen 2.979 N/A ILE 93.A N HIS 219.A O no hydrogen 2.898 N/A THR 94.A OG1 GLU 96.A O no hydrogen 2.744 N/A THR 94.A OG1 THR 100.A OG1 no hydrogen 2.820 N/A ARG 98.A NE ASP 601.A OD1 no hydrogen 3.279 N/A ARG 98.A NE ASP 601.A OD2 no hydrogen 2.996 N/A ARG 98.A NH2 ASP 601.A OD1 no hydrogen 2.842 N/A ASP 99.A N GLU 96.A O no hydrogen 3.103 N/A THR 100.A N GLN 97.A O no hydrogen 2.862 N/A THR 100.A OG1 THR 94.A OG1 no hydrogen 2.820 N/A VAL 101.A N GLN 97.A O no hydrogen 3.054 N/A LYS 105.A N ASP 596.A O no hydrogen 2.854 N/A LYS 105.A NZ ASN 599.A OD1.A no hydrogen 2.392 N/A SER 106.A N ASP 596.A OD2 no hydrogen 2.646 N/A SER 106.A OG ASP 596.A OD1 no hydrogen 2.955 N/A SER 106.A OG ASP 596.A OD2 no hydrogen 3.145 N/A GLY 107.A N PRO 104.A O no hydrogen 3.150 N/A GLN 110.A N GLN 597.A OE1 no hydrogen 2.762 N/A LEU 111.A N SER 109.A OG no hydrogen 2.966 N/A TRP 114.A NE1 THR 94.A O no hydrogen 2.855 N/A MET 115.A N ILE 92.A O no hydrogen 3.133 N/A SER 116.A OG GLU 118.A OE1 no hydrogen 3.485 N/A GLU 118.A N GLU 118.A OE1 no hydrogen 3.071 N/A ASP 119.A N SER 116.A OG no hydrogen 3.154 N/A PHE 120.A N SER 116.A O no hydrogen 2.930 N/A GLU 121.A N GLU 117.A O no hydrogen 2.896 N/A LYS 122.A N GLU 118.A O no hydrogen 3.261 N/A ALA 123.A N ASP 119.A O no hydrogen 3.004 N/A PHE 124.A N PHE 120.A O no hydrogen 2.802 N/A ASN 125.A N GLU 121.A O no hydrogen 2.939 N/A ALA 126.A N LYS 122.A O no hydrogen 3.080 N/A ALA 126.A N ALA 123.A O no hydrogen 3.201 N/A ARG 127.A N PHE 124.A O no hydrogen 3.065 N/A ARG 127.A NE LEU 214.A O no hydrogen 2.779 N/A ARG 127.A NH1 ALA 123.A O no hydrogen 2.953 N/A ARG 127.A NH2 LEU 214.A O no hydrogen 3.564 N/A PHE 128.A N PHE 124.A O no hydrogen 2.989 N/A GLY 130.A N LEU 35.A O no hydrogen 2.924 N/A CYS 131.A N PHE 128.A O no hydrogen 2.938 N/A CYS 131.A SG PHE 128.A O no hydrogen 3.243 N/A CYS 131.A SG SER 193.A OG no hydrogen 3.340 N/A MET 132.A N CYS 36.A O no hydrogen 2.882 N/A LYS 133.A N GLY 130.A O no hydrogen 3.173 N/A ARG 135.A N MET 132.A O no hydrogen 2.916 N/A ARG 135.A NE CYS 196.A O no hydrogen 2.953 N/A ARG 135.A NH2 CYS 196.A O no hydrogen 2.838 N/A MET 137.A N TYR 40.A O no hydrogen 2.831 N/A TYR 138.A N THR 159.A O no hydrogen 2.745 N/A VAL 139.A N HIS 42.A O no hydrogen 2.844 N/A ILE 140.A N GLU 157.A O no hydrogen 2.808 N/A PHE 142.A N GLY 155.A O no hydrogen 2.919 N/A SER 143.A N ARG 173.A O no hydrogen 2.753 N/A SER 143.A OG GLY 145.A O no hydrogen 2.856 N/A MET 144.A N LYS 153.A O no hydrogen 2.846 N/A SER 149.A N PRO 146.A O no hydrogen 2.951 N/A LEU 151.A N SER 149.A OG no hydrogen 3.090 N/A ALA 152.A N SER 149.A O no hydrogen 3.207 N/A LYS 153.A N MET 144.A O no hydrogen 3.137 N/A GLY 155.A N PHE 142.A O no hydrogen 2.847 N/A ILE 156.A N ILE 188.A O no hydrogen 3.040 N/A GLU 157.A N ILE 140.A O no hydrogen 2.862 N/A LEU 158.A N CYS 190.A O no hydrogen 2.830 N/A THR 159.A N TYR 138.A O no hydrogen 3.009 N/A THR 159.A OG1 HIS 192.A ND1 no hydrogen 2.761 N/A SER 161.A N THR 159.A OG1 no hydrogen 2.995 N/A TYR 163.A OH THR 356.A OG1 no hydrogen 2.628 N/A VAL 164.A N SER 161.A OG no hydrogen 3.202 N/A VAL 165.A N SER 161.A O no hydrogen 3.169 N/A ALA 166.A N PRO 162.A O no hydrogen 2.982 N/A SER 167.A N TYR 163.A O no hydrogen 2.975 N/A SER 167.A OG TYR 163.A O no hydrogen 2.965 N/A MET 168.A N VAL 164.A O no hydrogen 2.805 N/A ARG 169.A N VAL 165.A O no hydrogen 3.010 N/A ARG 169.A NE GLY 46.A O no hydrogen 3.045 N/A ARG 169.A NH2 GLY 46.A O no hydrogen 2.907 N/A ILE 170.A N ALA 166.A O no hydrogen 3.416 N/A MET 171.A N SER 167.A O no hydrogen 2.900 N/A THR 172.A N MET 168.A O no hydrogen 2.966 N/A THR 172.A OG1 MET 168.A O no hydrogen 2.775 N/A ARG 173.A N SER 143.A O no hydrogen 3.326 N/A ARG 173.A NH1 GLU 327.A O no hydrogen 3.077 N/A ARG 173.A NH2 GLU 419.A OE1 no hydrogen 2.925 N/A GLY 175.A N PRO 141.A O no hydrogen 2.928 N/A THR 176.A N ASP 45.A O no hydrogen 3.068 N/A VAL 178.A N GLY 175.A O no hydrogen 2.991 N/A LEU 179.A N GLY 175.A O no hydrogen 3.488 N/A GLU 180.A N THR 176.A O no hydrogen 3.079 N/A ALA 181.A N SER 177.A O no hydrogen 2.946 N/A LEU 182.A N VAL 178.A O no hydrogen 2.829 N/A GLY 183.A N LEU 179.A O no hydrogen 3.079 N/A GLY 185.A N LEU 182.A O no hydrogen 2.994 N/A ILE 188.A N ILE 154.A O no hydrogen 2.997 N/A LYS 189.A N ARG 224.A O no hydrogen 3.054 N/A CYS 190.A N ILE 156.A O no hydrogen 2.913 N/A CYS 190.A SG ILE 188.A O no hydrogen 3.971 N/A LEU 191.A N ILE 226.A O no hydrogen 2.859 N/A HIS 192.A N LEU 158.A O no hydrogen 2.786 N/A HIS 192.A ND1 THR 159.A OG1 no hydrogen 2.761 N/A HIS 192.A NE2 SER 231.A O no hydrogen 2.827 N/A SER 193.A N SER 228.A O no hydrogen 3.076 N/A SER 193.A OG ASP 160.A OD2 no hydrogen 2.733 N/A VAL 194.A N ASP 160.A OD1 no hydrogen 2.936 N/A GLY 195.A N SER 193.A OG no hydrogen 2.983 N/A CYS 196.A SG VAL 194.A O no hydrogen 3.901 N/A CYS 196.A SG CYS 210.A O no hydrogen 3.062 N/A LEU 198.A N LYS 133.A O no hydrogen 2.885 N/A TRP 208.A N VAL 205.A O no hydrogen 3.019 N/A TRP 208.A NE1 ASP 82.A OD2 no hydrogen 2.816 N/A CYS 210.A SG ASP 79.A OD2 no hydrogen 3.580 N/A CYS 210.A SG TRP 208.A O no hydrogen 3.794 N/A ASN 211.A N GLY 230.A O no hydrogen 2.756 N/A GLU 213.A N GLU 213.A OE2 no hydrogen 2.707 N/A LEU 214.A N ASN 211.A O no hydrogen 3.211 N/A THR 215.A N PRO 212.A O no hydrogen 3.238 N/A THR 215.A OG1 ASN 211.A O no hydrogen 2.895 N/A THR 215.A OG1 PRO 212.A O no hydrogen 3.474 N/A LEU 216.A N PHE 229.A O no hydrogen 2.973 N/A ILE 217.A N LYS 89.A O no hydrogen 2.825 N/A ALA 218.A N ILE 227.A O no hydrogen 2.800 N/A HIS 219.A N VAL 91.A O no hydrogen 2.970 N/A HIS 219.A ND1 VAL 91.A O no hydrogen 2.864 N/A LEU 220.A N GLU 225.A O no hydrogen 2.806 N/A ARG 223.A NH1 GLU 117.A OE1 no hydrogen 2.640 N/A ARG 224.A N PRO 221.A O no hydrogen 3.130 N/A ARG 224.A NH1 PHE 187.A O no hydrogen 2.815 N/A GLU 225.A N LEU 220.A O no hydrogen 3.083 N/A ILE 226.A N LYS 189.A O no hydrogen 2.868 N/A ILE 227.A N ALA 218.A O no hydrogen 2.876 N/A SER 228.A N LEU 191.A O no hydrogen 2.832 N/A SER 228.A OG ASN 236.A O no hydrogen 2.708 N/A PHE 229.A N LEU 216.A O no hydrogen 2.856 N/A GLY 230.A N SER 193.A O no hydrogen 2.774 N/A SER 231.A OG ASP 82.A OD1 no hydrogen 2.551 N/A SER 231.A OG ASN 236.A OD1 no hydrogen 2.857 N/A GLY 232.A N ASP 82.A OD2 no hydrogen 2.742 N/A TYR 233.A N SER 231.A OG no hydrogen 3.180 N/A ASN 236.A N TYR 233.A O no hydrogen 2.834 N/A SER 237.A N TYR 233.A O no hydrogen 2.962 N/A SER 237.A N GLY 234.A O no hydrogen 3.289 N/A SER 237.A OG GLY 232.A O no hydrogen 2.831 N/A SER 237.A OG TYR 233.A O no hydrogen 3.135 N/A LEU 238.A N GLY 234.A O no hydrogen 2.930 N/A LEU 239.A N GLU 157.A OE1 no hydrogen 3.056 N/A LYS 241.A N LEU 238.A O no hydrogen 3.148 N/A LYS 241.A NZ ASP 309.A OD2 no hydrogen 2.749 N/A LYS 241.A NZ GLU 327.A OE1 no hydrogen 3.021 N/A LYS 241.A NZ GLU 327.A OE2 no hydrogen 2.760 N/A LYS 242.A NZ ASP 309.A OD1 no hydrogen 3.185 N/A LYS 242.A NZ ASP 309.A OD2 no hydrogen 2.848 N/A CYS 243.A SG HIS 219.A NE2 no hydrogen 3.389 N/A PHE 244.A N LEU 239.A O no hydrogen 2.998 N/A ALA 245.A N GLY 240.A O no hydrogen 3.015 N/A ALA 245.A N LYS 241.A O no hydrogen 2.960 N/A LEU 246.A N LYS 242.A O no hydrogen 3.230 N/A ARG 247.A N LYS 242.A O no hydrogen 2.951 N/A ARG 247.A NE PRO 482.A O no hydrogen 2.990 N/A ARG 247.A NH1 HIS 219.A NE2 no hydrogen 3.042 N/A ARG 247.A NH2 PRO 482.A O no hydrogen 2.972 N/A ILE 248.A N CYS 243.A O no hydrogen 2.984 N/A ALA 249.A N PHE 244.A O no hydrogen 2.838 N/A SER 250.A N LEU 246.A O no hydrogen 2.794 N/A SER 250.A OG LEU 246.A O no hydrogen 2.850 N/A SER 250.A OG ARG 247.A O no hydrogen 3.155 N/A ARG 251.A NH2 ASP 222.A OD1.B no hydrogen 3.560 N/A LEU 252.A N ILE 248.A O no hydrogen 3.130 N/A ALA 253.A N ALA 249.A O no hydrogen 2.782 N/A LYS 254.A N SER 250.A O no hydrogen 3.053 N/A GLU 255.A N ARG 251.A O no hydrogen 3.193 N/A GLU 256.A N LEU 252.A O no hydrogen 2.879 N/A GLU 256.A N ALA 253.A O no hydrogen 3.247 N/A GLY 257.A N ALA 253.A O no hydrogen 2.817 N/A TRP 258.A N ALA 253.A O no hydrogen 2.946 N/A TRP 258.A NE1 GLU 256.A OE1 no hydrogen 2.848 N/A LEU 259.A N MET 313.A O no hydrogen 2.832 N/A GLU 261.A N ALA 311.A O no hydrogen 2.862 N/A HIS 262.A ND1 ALA 479.A O no hydrogen 2.807 N/A LEU 264.A N ALA 280.A O no hydrogen 2.977 N/A ILE 265.A N GLY 307.A O no hydrogen 2.961 N/A LEU 266.A N LEU 278.A O no hydrogen 2.953 N/A GLY 267.A N GLU 304.A O no hydrogen 2.833 N/A ILE 268.A N LYS 276.A O no hydrogen 2.770 N/A THR 269.A N LYS 302.A O no hydrogen 2.851 N/A ASN 270.A N LYS 274.A O no hydrogen 2.911 N/A GLU 272.A N ASN 270.A OD1 no hydrogen 2.928 N/A GLY 273.A N ASN 270.A O no hydrogen 3.034 N/A LYS 274.A N ASN 270.A OD1 no hydrogen 2.974 N/A LYS 274.A NZ GLU 272.A O no hydrogen 3.006 N/A LYS 275.A NZ TYR 277.A OH no hydrogen 3.197 N/A LYS 275.A NZ GLU 304.A OE1 no hydrogen 2.906 N/A LYS 275.A NZ ASP 415.A OD1 no hydrogen 2.702 N/A LYS 276.A N ILE 268.A O no hydrogen 2.870 N/A LYS 276.A NZ GLU 427.A OE1 no hydrogen 2.821 N/A TYR 277.A OH ASP 415.A OD1 no hydrogen 3.226 N/A TYR 277.A OH ASP 415.A OD2 no hydrogen 2.651 N/A LEU 278.A N LEU 266.A O no hydrogen 2.903 N/A ALA 279.A N GLY 428.A O no hydrogen 2.983 N/A ALA 280.A N LEU 264.A O no hydrogen 3.120 N/A ALA 281.A N ILE 430.A O no hydrogen 2.847 N/A CYS 286.A SG SER 284.A O no hydrogen 3.590 N/A CYS 286.A SG SER 460.A OG no hydrogen 3.519 N/A LYS 288.A NZ PHE 282.A O no hydrogen 2.857 N/A THR 289.A OG1 ASP 308.A OD2 no hydrogen 2.616 N/A LEU 291.A N GLY 287.A O no hydrogen 3.038 N/A ALA 292.A N LYS 288.A O no hydrogen 2.799 N/A MET 293.A N THR 289.A O no hydrogen 3.182 N/A MET 294.A N LEU 291.A O no hydrogen 3.164 N/A THR 297.A N GLY 529.A O no hydrogen 3.177 N/A THR 297.A OG1.A GLY 529.A O no hydrogen 3.235 N/A THR 297.A OG1.A GLU 530.A OE1 no hydrogen 2.775 N/A THR 297.A OG1.B GLU 530.A OE1 no hydrogen 3.456 N/A TRP 301.A N LEU 298.A O no hydrogen 3.400 N/A LYS 302.A N THR 269.A O no hydrogen 3.008 N/A GLU 304.A N GLY 267.A O no hydrogen 2.786 N/A CYS 305.A N ILE 413.A O no hydrogen 2.899 N/A VAL 306.A N ILE 265.A O no hydrogen 2.930 N/A GLY 307.A N ILE 265.A O no hydrogen 3.123 N/A ALA 311.A N GLU 261.A O no hydrogen 2.903 N/A TRP 312.A N ILE 324.A O no hydrogen 2.900 N/A TRP 312.A NE1 ALA 245.A O no hydrogen 2.919 N/A MET 313.A N LEU 259.A O no hydrogen 2.826 N/A LYS 314.A N ARG 322.A O no hydrogen 2.955 N/A ASP 316.A N ASN 320.A O no hydrogen 2.889 N/A GLN 318.A N ASP 316.A OD1 no hydrogen 2.937 N/A GLY 319.A N ASP 316.A O no hydrogen 2.869 N/A ASN 320.A N ASP 316.A OD1 no hydrogen 2.999 N/A ARG 322.A N LYS 314.A O no hydrogen 2.813 N/A ARG 322.A NE.B GLU 422.A O no hydrogen 2.553 N/A ARG 322.A NH1.A GLY 423.A O no hydrogen 2.942 N/A ARG 322.A NH2.B GLY 423.A O no hydrogen 2.856 N/A ALA 323.A N VAL 424.A O no hydrogen 2.824 N/A ILE 324.A N TRP 312.A O no hydrogen 2.824 N/A ASN 325.A ND2 VAL 306.A O no hydrogen 2.954 N/A GLU 327.A N ASN 325.A OD1 no hydrogen 2.912 N/A ASN 328.A N MET 171.A O no hydrogen 2.933 N/A ASN 328.A ND2 THR 172.A O no hydrogen 2.989 N/A PHE 330.A N THR 406.A O no hydrogen 2.881 N/A GLY 332.A N PHE 404.A O no hydrogen 2.894 N/A ALA 334.A N SER 402.A O no hydrogen 2.887 N/A GLY 336.A N GLU 369.A O no hydrogen 2.819 N/A THR 337.A N ALA 334.A O no hydrogen 2.964 N/A THR 337.A OG1 VAL 333.A O no hydrogen 3.406 N/A THR 337.A OG1 ALA 334.A O no hydrogen 2.804 N/A SER 338.A N THR 341.A OG1 no hydrogen 2.980 N/A SER 338.A OG.A THR 341.A OG1 no hydrogen 3.064 N/A THR 341.A N SER 338.A OG.A no hydrogen 3.110 N/A THR 341.A OG1 GLY 336.A O no hydrogen 2.787 N/A THR 341.A OG1 SER 338.A O no hydrogen 3.473 N/A THR 341.A OG1 SER 338.A OG.A no hydrogen 3.064 N/A ASN 342.A N SER 338.A O no hydrogen 2.850 N/A ASN 344.A ND2 MET 293.A O no hydrogen 2.948 N/A ALA 345.A N ASN 342.A OD1 no hydrogen 3.053 N/A ILE 346.A N ASN 342.A O no hydrogen 3.137 N/A LYS 347.A N PRO 343.A O no hydrogen 3.092 N/A THR 348.A N ASN 344.A O no hydrogen 3.068 N/A THR 348.A OG1 ASN 344.A O no hydrogen 2.707 N/A ILE 349.A N ALA 345.A O no hydrogen 3.001 N/A ASN 352.A N ASP 71.A O no hydrogen 2.897 N/A ASN 352.A ND2 GLN 410.A OE1 no hydrogen 2.844 N/A THR 353.A OG1 LYS 351.A O no hydrogen 2.794 N/A THR 353.A OG1 THR 406.A OG1 no hydrogen 2.829 N/A ILE 354.A N CYS 405.A O no hydrogen 3.054 N/A PHE 355.A N TRP 74.A O no hydrogen 2.799 N/A THR 356.A N ARG 403.A O no hydrogen 2.877 N/A THR 356.A OG1 TYR 163.A OH no hydrogen 2.628 N/A ASN 357.A N ALA 76.A O no hydrogen 2.853 N/A ASN 357.A ND2 THR 78.A OG1 no hydrogen 2.891 N/A ALA 359.A N TYR 367.A O no hydrogen 2.971 N/A GLU 360.A N THR 382.A O no hydrogen 2.873 N/A THR 361.A N GLY 365.A O no hydrogen 2.889 N/A THR 361.A OG1 ASP 363.A OD2 no hydrogen 2.659 N/A SER 362.A N THR 380.A O no hydrogen 2.853 N/A SER 362.A OG.B THR 380.A O no hydrogen 3.018 N/A SER 362.A OG.B THR 380.A OG1.A no hydrogen 2.165 N/A GLY 364.A N THR 361.A O no hydrogen 2.861 N/A GLY 365.A N THR 361.A OG1 no hydrogen 2.878 N/A VAL 366.A N TYR 70.A OH no hydrogen 3.155 N/A TYR 367.A N ALA 359.A O no hydrogen 2.889 N/A TYR 367.A OH GLU 373.A O no hydrogen 2.826 N/A TRP 368.A NE1 THR 337.A O no hydrogen 2.829 N/A ILE 371.A N TRP 368.A O no hydrogen 3.090 N/A VAL 379.A N ALA 376.A O no hydrogen 3.037 N/A THR 380.A N SER 362.A OG.A no hydrogen 2.910 N/A THR 380.A N SER 362.A OG.B no hydrogen 2.970 N/A THR 380.A OG1.A SER 362.A OG.B no hydrogen 2.165 N/A THR 380.A OG1.B GLU 388.A OE2 no hydrogen 2.685 N/A THR 382.A N GLU 360.A O no hydrogen 2.807 N/A THR 382.A OG1 GLU 388.A OE1 no hydrogen 2.922 N/A SER 383.A N LYS 387.A O no hydrogen 2.797 N/A SER 383.A OG LYS 387.A O no hydrogen 3.392 N/A TRP 384.A N CYS 397.A O no hydrogen 2.893 N/A LYS 385.A N SER 383.A OG no hydrogen 3.030 N/A LYS 385.A NZ GLU 395.A OE1.B no hydrogen 2.797 N/A ASN 386.A N SER 383.A O no hydrogen 2.861 N/A TRP 389.A N ILE 381.A O no hydrogen 2.960 N/A TRP 389.A NE1 GLU 395.A O no hydrogen 2.737 N/A ARG 390.A N ASP 393.A OD2 no hydrogen 2.890 N/A ASP 393.A N ARG 390.A O no hydrogen 2.789 N/A CYS 397.A N GLU 369.A OE1 no hydrogen 2.830 N/A CYS 397.A SG GLU 369.A OE1 no hydrogen 3.537 N/A CYS 397.A SG GLU 369.A OE2 no hydrogen 3.708 N/A ALA 398.A N GLU 369.A OE2 no hydrogen 3.179 N/A HIS 399.A N ASN 357.A O no hydrogen 3.009 N/A ASN 401.A N HIS 399.A ND1 no hydrogen 2.870 N/A ASN 401.A ND2 VAL 83.A O no hydrogen 3.004 N/A ASN 401.A ND2 TYR 233.A OH no hydrogen 2.981 N/A SER 402.A N HIS 399.A O no hydrogen 2.937 N/A SER 402.A OG HIS 399.A O no hydrogen 2.723 N/A ARG 403.A N THR 356.A O no hydrogen 3.032 N/A ARG 403.A NE ASN 401.A OD1 no hydrogen 3.349 N/A ARG 403.A NH1 PHE 331.A O no hydrogen 2.848 N/A ARG 403.A NH2 ASN 401.A OD1 no hydrogen 2.921 N/A PHE 404.A N GLY 332.A O no hydrogen 2.930 N/A CYS 405.A N ILE 354.A O no hydrogen 2.781 N/A THR 406.A N PHE 330.A O no hydrogen 3.004 N/A THR 406.A OG1 THR 348.A O no hydrogen 3.281 N/A THR 406.A OG1 THR 353.A OG1 no hydrogen 2.829 N/A ALA 408.A N ASN 328.A O no hydrogen 3.072 N/A GLN 410.A N PRO 407.A O no hydrogen 3.219 N/A GLN 410.A NE2 THR 348.A O no hydrogen 2.905 N/A GLN 410.A NE2 LYS 351.A O no hydrogen 2.927 N/A CYS 411.A N ALA 408.A O no hydrogen 3.006 N/A ILE 414.A N CYS 411.A O no hydrogen 3.081 N/A ASP 415.A N CYS 305.A O no hydrogen 2.846 N/A ALA 417.A N ASP 415.A OD2 no hydrogen 2.925 N/A TRP 418.A N ASP 415.A O no hydrogen 3.021 N/A SER 420.A N ALA 417.A O no hydrogen 3.036 N/A SER 420.A OG.A ALA 417.A O no hydrogen 3.143 N/A GLU 422.A N SER 420.A OG.B no hydrogen 3.112 N/A GLY 423.A N SER 420.A O no hydrogen 3.075 N/A VAL 424.A N ALA 323.A O no hydrogen 2.898 N/A ILE 426.A N LEU 321.A O no hydrogen 2.758 N/A GLU 427.A N TYR 277.A O no hydrogen 2.948 N/A ILE 429.A N LYS 508.A O no hydrogen 2.814 N/A ILE 430.A N ALA 279.A O no hydrogen 2.819 N/A PHE 431.A N PHE 510.A O no hydrogen 2.845 N/A GLY 432.A N ALA 281.A O no hydrogen 3.330 N/A ARG 434.A N SER 460.A OG no hydrogen 2.880 N/A ARG 434.A NE ALA 285.A O no hydrogen 3.102 N/A ARG 434.A NH1 ALA 285.A O no hydrogen 2.893 N/A ARG 435.A NH1 GLU 586.A OE2 no hydrogen 2.894 N/A ARG 435.A NH2 GLU 586.A OE1 no hydrogen 2.890 N/A TYR 443.A N HIS 511.A O no hydrogen 2.921 N/A GLU 444.A N TYR 555.A O no hydrogen 2.755 N/A ALA 445.A N ILE 509.A O no hydrogen 2.861 N/A LEU 446.A N HIS 450.A ND1 no hydrogen 2.850 N/A SER 447.A OG GLN 449.A OE1.A no hydrogen 3.538 N/A TRP 448.A NE1 TRP 495.A O no hydrogen 2.948 N/A HIS 450.A N SER 447.A OG no hydrogen 2.951 N/A GLY 451.A N SER 447.A O no hydrogen 2.858 N/A VAL 452.A N TRP 448.A O no hydrogen 2.841 N/A PHE 453.A N GLN 449.A O no hydrogen 3.010 N/A VAL 454.A N HIS 450.A O no hydrogen 2.818 N/A GLY 455.A N GLY 451.A O no hydrogen 2.993 N/A ALA 456.A N VAL 452.A O no hydrogen 2.886 N/A ALA 457.A N PHE 453.A O no hydrogen 2.852 N/A ALA 457.A N VAL 454.A O no hydrogen 3.224 N/A MET 458.A N GLY 455.A O no hydrogen 3.322 N/A ARG 459.A NH1 GLU 586.A OE2 no hydrogen 3.002 N/A SER 460.A N MET 474.A O no hydrogen 2.835 N/A GLU 461.A N ARG 434.A O no hydrogen 2.876 N/A ALA 462.A N VAL 472.A O no hydrogen 2.802 N/A THR 463.A OG1 SER 284.A O no hydrogen 3.251 N/A ALA 465.A N THR 463.A OG1 no hydrogen 3.247 N/A GLU 467.A N GLU 467.A OE1 no hydrogen 2.795 N/A HIS 468.A NE2 GLU 87.A OE1 no hydrogen 2.727 N/A LYS 469.A NZ GLU 467.A O no hydrogen 3.481 N/A MET 474.A N SER 460.A O no hydrogen 2.902 N/A HIS 475.A NE2 GLU 589.A OE1 no hydrogen 2.711 N/A ASP 476.A N MET 458.A O no hydrogen 2.924 N/A PHE 478.A N GLY 455.A O no hydrogen 2.941 N/A ALA 479.A N ASP 476.A O no hydrogen 2.942 N/A MET 480.A N PRO 477.A O no hydrogen 2.847 N/A ARG 481.A N ASP 476.A OD1 no hydrogen 2.884 N/A ARG 481.A NH1 HIS 475.A O no hydrogen 2.950 N/A ARG 481.A NH2 GLU 87.A OE1 no hydrogen 3.037 N/A ARG 481.A NH2 GLU 87.A OE2 no hydrogen 3.270 N/A PHE 483.A N MET 480.A O no hydrogen 2.819 N/A PHE 484.A N MET 480.A O no hydrogen 3.203 N/A GLY 485.A N SER 250.A OG no hydrogen 2.944 N/A ASN 487.A N ASP 99.A O no hydrogen 2.989 N/A ASN 487.A ND2 ARG 98.A O no hydrogen 2.849 N/A ASN 487.A ND2 ASP 601.A OD2 no hydrogen 2.913 N/A LYS 490.A N ASN 487.A OD1 no hydrogen 3.174 N/A TYR 491.A N ASN 487.A O no hydrogen 3.022 N/A TYR 491.A OH GLU 261.A OE1 no hydrogen 2.569 N/A TYR 491.A OH GLU 261.A OE2 no hydrogen 3.374 N/A LEU 492.A N PHE 488.A O no hydrogen 2.932 N/A ALA 493.A N GLY 489.A O no hydrogen 3.045 N/A HIS 494.A N LYS 490.A O no hydrogen 2.877 N/A HIS 494.A NE2 TRP 258.A O no hydrogen 2.784 N/A TRP 495.A N TYR 491.A O no hydrogen 2.953 N/A TRP 495.A NE1 GLU 261.A OE2 no hydrogen 2.876 N/A LEU 496.A N LEU 492.A O no hydrogen 2.916 N/A SER 497.A N ALA 493.A O no hydrogen 2.928 N/A SER 497.A OG.A HIS 494.A O no hydrogen 2.714 N/A SER 497.A OG.B ALA 493.A O no hydrogen 2.612 N/A MET 498.A N TRP 495.A O no hydrogen 3.178 N/A ALA 499.A N LEU 496.A O no hydrogen 3.182 N/A HIS 500.A N SER 497.A O no hydrogen 3.102 N/A ARG 501.A N MET 498.A O no hydrogen 3.166 N/A ARG 501.A NH1.B GLY 257.A O no hydrogen 2.810 N/A ALA 504.A N ARG 501.A O no hydrogen 3.102 N/A LYS 505.A N GLY 319.A O no hydrogen 2.773 N/A LYS 505.A NZ GLN 318.A O no hydrogen 3.367 N/A LYS 508.A N GLU 427.A O no hydrogen 3.176 N/A LYS 508.A NZ.A GLU 444.A OE2 no hydrogen 2.707 N/A LYS 508.A NZ.B GLU 444.A OE2 no hydrogen 2.724 N/A PHE 510.A N ILE 429.A O no hydrogen 2.905 N/A HIS 511.A N TYR 443.A O no hydrogen 2.831 N/A VAL 512.A N PHE 431.A O no hydrogen 2.833 N/A ASN 513.A N LEU 441.A O no hydrogen 2.857 N/A ASN 513.A ND2 GLY 433.A O no hydrogen 3.273 N/A ARG 516.A NH1 LEU 575.A O no hydrogen 2.977 N/A ARG 516.A NH1 GLY 577.A O no hydrogen 3.006 N/A ARG 516.A NH2 GLY 577.A O no hydrogen 3.163 N/A LYS 517.A N PRO 436.A O no hydrogen 2.832 N/A ASP 518.A N LYS 522.A O no hydrogen 2.826 N/A ASN 520.A N ASP 518.A OD2 no hydrogen 2.808 N/A GLY 521.A N ASP 518.A O no hydrogen 2.996 N/A LYS 522.A N ASP 518.A OD2 no hydrogen 3.001 N/A LEU 524.A N ARG 516.A O no hydrogen 2.928 N/A TRP 525.A NE1 ASN 531.A OD1 no hydrogen 2.685 N/A GLU 530.A N GLY 527.A O no hydrogen 2.978 N/A ASN 531.A N PHE 528.A O no hydrogen 2.848 N/A SER 532.A N GLY 529.A O no hydrogen 3.112 N/A SER 532.A OG GLY 529.A O no hydrogen 2.820 N/A ARG 533.A N GLU 530.A O no hydrogen 2.987 N/A ARG 533.A NE GLU 530.A OE1 no hydrogen 2.748 N/A ARG 533.A NH1 ASN 563.A O no hydrogen 2.836 N/A ARG 533.A NH1 LYS 565.A O no hydrogen 2.921 N/A ARG 533.A NH2 GLU 530.A OE1 no hydrogen 3.020 N/A ARG 533.A NH2 LYS 565.A O no hydrogen 2.970 N/A VAL 534.A N ASN 531.A O no hydrogen 2.944 N/A LEU 535.A N ASN 531.A O no hydrogen 3.051 N/A GLU 536.A N SER 532.A O no hydrogen 2.902 N/A TRP 537.A N ARG 533.A O no hydrogen 3.402 N/A TRP 537.A NE1 SER 547.A O no hydrogen 2.965 N/A MET 538.A N VAL 534.A O no hydrogen 3.042 N/A PHE 539.A N LEU 535.A O no hydrogen 2.844 N/A GLY 540.A N GLU 536.A O no hydrogen 3.055 N/A ARG 541.A N TRP 537.A O no hydrogen 2.954 N/A ARG 541.A NE GLU 444.A OE1 no hydrogen 2.741 N/A ARG 541.A NH1 GLU 545.A O no hydrogen 3.124 N/A ARG 541.A NH2 GLU 444.A OE1 no hydrogen 3.379 N/A ARG 541.A NH2 GLU 444.A OE2 no hydrogen 2.820 N/A ILE 542.A N MET 538.A O no hydrogen 2.866 N/A GLU 543.A N PHE 539.A O no hydrogen 3.065 N/A GLY 544.A N ARG 541.A O no hydrogen 2.979 N/A GLU 545.A N GLY 540.A O no hydrogen 2.932 N/A LYS 549.A N VAL 556.A O no hydrogen 2.808 N/A THR 551.A N GLY 554.A O no hydrogen 2.942 N/A THR 551.A OG1 GLY 554.A O no hydrogen 2.785 N/A ILE 553.A N THR 551.A OG1 no hydrogen 3.170 N/A GLY 554.A N THR 551.A O no hydrogen 3.141 N/A TYR 555.A N GLU 444.A O no hydrogen 2.946 N/A VAL 556.A N LYS 549.A O no hydrogen 2.895 N/A LYS 558.A N SER 547.A O no hydrogen 2.973 N/A LYS 558.A NZ ASP 546.A O no hydrogen 2.614 N/A ALA 561.A N LYS 558.A O no hydrogen 2.936 N/A LYS 565.A N ASN 563.A OD1 no hydrogen 2.803 N/A LEU 567.A N LEU 564.A O no hydrogen 2.805 N/A VAL 570.A N LEU 567.A O no hydrogen 3.084 N/A GLU 574.A N ASN 571.A OD1 no hydrogen 3.078 N/A LEU 575.A N ASN 571.A O no hydrogen 3.000 N/A PHE 576.A N VAL 572.A O no hydrogen 2.855 N/A GLY 577.A N GLU 574.A O no hydrogen 3.311 N/A LYS 580.A NZ SER 618.A O no hydrogen 3.490 N/A LYS 580.A NZ MET 620.A O no hydrogen 2.825 N/A PHE 582.A N SER 579.A OG no hydrogen 3.086 N/A TRP 583.A N SER 579.A O no hydrogen 3.012 N/A TRP 583.A NE1 GLY 438.A O no hydrogen 3.218 N/A GLU 584.A N LYS 580.A O no hydrogen 2.816 N/A LYS 585.A N GLU 581.A O no hydrogen 3.178 N/A GLU 586.A N PHE 582.A O no hydrogen 2.862 N/A VAL 587.A N TRP 583.A O no hydrogen 2.885 N/A GLU 588.A N GLU 584.A O no hydrogen 3.174 N/A GLU 589.A N LYS 585.A O no hydrogen 2.979 N/A ILE 590.A N GLU 586.A O no hydrogen 2.904 N/A ASP 591.A N VAL 587.A O no hydrogen 2.904 N/A LYS 592.A N GLU 588.A O no hydrogen 2.984 N/A TYR 593.A N GLU 589.A O no hydrogen 2.974 N/A LEU 594.A N ILE 590.A O no hydrogen 2.880 N/A GLU 595.A N ASP 591.A O no hydrogen 2.944 N/A ASP 596.A N LYS 592.A O no hydrogen 2.956 N/A GLN 597.A N TYR 593.A O no hydrogen 2.808 N/A GLN 597.A NE2 GLN 108.A O no hydrogen 3.058 N/A GLN 597.A NE2 ASP 596.A OD1 no hydrogen 3.021 N/A VAL 598.A N LEU 594.A O no hydrogen 2.946 N/A ASN 599.A N LEU 594.A O no hydrogen 3.001 N/A ASN 599.A ND2.A ILE 103.A O no hydrogen 3.266 N/A ASP 601.A N VAL 598.A O no hydrogen 2.931 N/A LEU 602.A N ASN 599.A O no hydrogen 2.967 N/A GLU 605.A N GLU 605.A OE2.A no hydrogen 2.705 N/A ILE 606.A N PRO 603.A O no hydrogen 2.938 N/A GLU 607.A N PRO 603.A O no hydrogen 3.192 N/A ARG 608.A N TYR 604.A O no hydrogen 2.892 N/A GLU 609.A N GLU 605.A O no hydrogen 3.076 N/A LEU 610.A N ILE 606.A O no hydrogen 2.987 N/A ARG 611.A N GLU 607.A O no hydrogen 2.957 N/A ARG 611.A NE GLU 607.A OE2 no hydrogen 2.759 N/A ALA 612.A N ARG 608.A O no hydrogen 2.864 N/A LEU 613.A N GLU 609.A O no hydrogen 2.914 N/A LYS 614.A N LEU 610.A O no hydrogen 2.960 N/A LYS 614.A NZ ASP 591.A OD2 no hydrogen 2.896 N/A GLN 615.A N ARG 611.A O no hydrogen 3.041 N/A ARG 616.A N ALA 612.A O no hydrogen 2.935 N/A ARG 616.A NE PRO 552.A O no hydrogen 2.753 N/A ARG 616.A NH2 PRO 552.A O no hydrogen 3.356 N/A ILE 617.A N LEU 613.A O no hydrogen 2.965 N/A SER 618.A N LYS 614.A O no hydrogen 2.954 N/A SER 618.A OG GLN 615.A O no hydrogen 2.730 N/A GLN 619.A N GLN 615.A O no hydrogen 3.216 N/A GLN 619.A N ARG 616.A O no hydrogen 3.175 N/A MET 620.A N ILE 617.A O no hydrogen 3.020 N/A