Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2p2b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ ASP 503.A OD2 no hydrogen 3.261 N/A HIS 3.A N LEU 428.A O no hydrogen 2.845 N/A HIS 3.A NE2 GLU 392.A OE2 no hydrogen 3.004 N/A ILE 9.A N PRO 6.A O no hydrogen 3.044 N/A ALA 10.A N PRO 6.A O no hydrogen 2.943 N/A ASP 11.A N ALA 7.A O no hydrogen 2.868 N/A ARG 12.A N ILE 9.A O no hydrogen 3.157 N/A CYS 13.A SG ALA 10.A O no hydrogen 3.764 N/A CYS 13.A SG ILE 15.A O no hydrogen 3.532 N/A CYS 13.A SG GLY 424.A O no hydrogen 3.957 N/A LEU 14.A N ASP 290.A OD2 no hydrogen 2.772 N/A ASN 16.A N GLN 19.A OE1 no hydrogen 3.285 N/A GLN 19.A N ASN 16.A OD1 no hydrogen 2.862 N/A TYR 20.A N ASN 16.A O no hydrogen 2.859 N/A TYR 20.A OH PRO 436.A O no hydrogen 2.671 N/A GLU 21.A N PRO 17.A O no hydrogen 3.049 N/A THR 22.A N GLU 18.A O no hydrogen 3.033 N/A THR 22.A OG1 GLU 18.A O no hydrogen 3.050 N/A LYS 23.A N GLN 19.A O no hydrogen 3.032 N/A TYR 24.A N TYR 20.A O no hydrogen 2.798 N/A TYR 24.A OH VAL 440.A O no hydrogen 2.730 N/A LYS 25.A N GLU 21.A O no hydrogen 3.033 N/A GLN 26.A N THR 22.A O no hydrogen 3.026 N/A SER 27.A N LYS 23.A O no hydrogen 2.897 N/A SER 27.A OG LYS 23.A O no hydrogen 3.442 N/A SER 27.A OG TYR 24.A O no hydrogen 2.621 N/A ILE 28.A N TYR 24.A O no hydrogen 3.173 N/A ASN 29.A N LYS 25.A O no hydrogen 2.797 N/A ASP 30.A N GLN 26.A O no hydrogen 2.754 N/A THR 33.A N ASP 30.A OD1 no hydrogen 3.459 N/A THR 33.A OG1 ASP 30.A OD1 no hydrogen 3.364 N/A THR 33.A OG1 ASP 30.A OD2 no hydrogen 2.594 N/A PHE 34.A N ASP 30.A O no hydrogen 3.020 N/A TRP 35.A N PRO 31.A O no hydrogen 2.761 N/A GLY 36.A N ASP 32.A O no hydrogen 2.947 N/A GLU 37.A N THR 33.A O no hydrogen 2.939 N/A GLN 38.A N PHE 34.A O no hydrogen 2.943 N/A GLY 39.A N TRP 35.A O no hydrogen 2.963 N/A LYS 40.A N GLU 37.A O no hydrogen 3.219 N/A ILE 41.A N GLN 38.A O no hydrogen 3.308 N/A LEU 42.A N GLY 39.A O no hydrogen 3.355 N/A ASP 43.A N ASN 76.A OD1 no hydrogen 2.652 N/A TRP 44.A NE1 GLY 39.A O no hydrogen 2.790 N/A ILE 45.A N THR 70.A O no hydrogen 2.758 N/A THR 46.A N THR 70.A O no hydrogen 3.454 N/A THR 46.A N THR 70.A OG1 no hydrogen 3.267 N/A THR 46.A OG1 THR 70.A OG1 no hydrogen 2.737 N/A TYR 48.A OH GLY 36.A O no hydrogen 2.559 N/A GLN 49.A N ASP 68.A OD1 no hydrogen 3.335 N/A GLN 49.A N ASP 68.A OD2 no hydrogen 2.738 N/A LYS 50.A N ASP 68.A OD1 no hydrogen 3.179 N/A LYS 52.A N ASP 32.A OD2 no hydrogen 2.795 N/A LYS 52.A NZ THR 54.A OG1 no hydrogen 2.901 N/A LYS 52.A NZ ASP 464.A OD1 no hydrogen 3.008 N/A ASN 53.A N LYS 64.A O no hydrogen 3.009 N/A ASN 53.A ND2 GLU 67.A OE1 no hydrogen 2.779 N/A SER 55.A N SER 62.A O no hydrogen 2.780 N/A ALA 57.A N SER 55.A OG no hydrogen 3.136 N/A ASN 60.A N ALA 57.A O no hydrogen 2.959 N/A ASN 60.A ND2 PRO 58.A O no hydrogen 3.409 N/A VAL 61.A N GLU 481.A OE2 no hydrogen 2.776 N/A SER 62.A N SER 55.A O no hydrogen 3.026 N/A LYS 64.A N ASN 53.A O no hydrogen 2.975 N/A TRP 65.A N GLU 252.A OE2 no hydrogen 2.826 N/A TRP 65.A NE1 SER 465.A OG no hydrogen 3.248 N/A TYR 66.A N VAL 51.A O no hydrogen 2.918 N/A TYR 66.A OH TRP 35.A O no hydrogen 2.721 N/A GLY 69.A N TYR 66.A O no hydrogen 2.881 N/A THR 70.A N THR 46.A O no hydrogen 3.013 N/A THR 70.A OG1 THR 46.A OG1 no hydrogen 2.737 N/A LEU 71.A N MET 249.A O no hydrogen 2.779 N/A ASN 76.A N ASN 72.A O no hydrogen 3.111 N/A ASN 76.A ND2 ASP 43.A O no hydrogen 3.081 N/A ASN 76.A ND2 ASN 72.A O no hydrogen 2.911 N/A CYS 77.A N LEU 73.A O no hydrogen 2.942 N/A CYS 77.A N ALA 74.A O no hydrogen 3.199 N/A CYS 77.A SG LEU 73.A O no hydrogen 3.372 N/A CYS 77.A SG TYR 314.A O no hydrogen 3.766 N/A ARG 80.A N ALA 75.A O no hydrogen 3.079 N/A ARG 80.A NE ASN 76.A O no hydrogen 2.974 N/A ARG 80.A NH1 ILE 41.A O no hydrogen 2.949 N/A ARG 80.A NH1 ASP 43.A OD2 no hydrogen 2.980 N/A ARG 80.A NH2 ILE 41.A O no hydrogen 2.888 N/A ARG 80.A NH2 ALA 318.A O no hydrogen 2.796 N/A HIS 81.A N LEU 78.A O no hydrogen 3.008 N/A LEU 82.A N ASP 79.A O no hydrogen 3.062 N/A ASN 85.A N HIS 81.A O no hydrogen 2.846 N/A GLY 86.A N LEU 82.A O no hydrogen 3.021 N/A ARG 88.A N ASN 85.A O no hydrogen 3.073 N/A ARG 88.A NH1 GLY 320.A O no hydrogen 2.944 N/A ALA 90.A N ILE 104.A O no hydrogen 2.743 N/A ILE 91.A N ILE 104.A O no hydrogen 3.057 N/A ILE 92.A N THR 323.A O no hydrogen 2.914 N/A TRP 93.A N LYS 102.A O no hydrogen 2.794 N/A TRP 93.A NE1 MET 137.A O no hydrogen 2.907 N/A GLU 94.A N MET 325.A O no hydrogen 2.994 N/A GLY 95.A N GLN 100.A O no hydrogen 2.758 N/A ASP 96.A N GLU 327.A OE1 no hydrogen 2.923 N/A THR 98.A OG1 GLU 94.A OE2 no hydrogen 3.321 N/A SER 99.A N ASP 97.A OD1 no hydrogen 2.932 N/A SER 99.A OG ASP 97.A OD1 no hydrogen 2.594 N/A GLN 100.A N ASP 97.A O no hydrogen 2.963 N/A LYS 102.A N TRP 93.A O no hydrogen 2.820 N/A ILE 104.A N ILE 91.A O no hydrogen 2.923 N/A SER 105.A N GLU 108.A OE1 no hydrogen 2.934 N/A SER 105.A OG GLY 86.A O no hydrogen 3.419 N/A TYR 106.A N ARG 88.A O no hydrogen 2.937 N/A TYR 106.A OH ALA 321.A O no hydrogen 2.598 N/A ARG 107.A N GLY 86.A O no hydrogen 2.923 N/A GLU 108.A N SER 105.A OG no hydrogen 3.004 N/A LEU 109.A N SER 105.A O no hydrogen 2.915 N/A HIS 110.A N TYR 106.A O no hydrogen 2.924 N/A ARG 111.A N ARG 107.A O no hydrogen 3.092 N/A ASP 112.A N GLU 108.A O no hydrogen 3.104 N/A VAL 113.A N LEU 109.A O no hydrogen 2.851 N/A CYS 114.A N HIS 110.A O no hydrogen 2.878 N/A CYS 114.A SG HIS 110.A O no hydrogen 3.271 N/A ARG 115.A N ARG 111.A O no hydrogen 2.894 N/A ARG 115.A NE ASP 112.A OD1 no hydrogen 3.174 N/A ARG 115.A NH2 ASP 112.A OD1 no hydrogen 2.494 N/A PHE 116.A N ASP 112.A O no hydrogen 2.847 N/A ALA 117.A N VAL 113.A O no hydrogen 2.727 N/A ASN 118.A N CYS 114.A O no hydrogen 3.207 N/A ASN 118.A ND2 SER 241.A O no hydrogen 2.698 N/A ASN 118.A ND2 GLU 243.A O no hydrogen 2.931 N/A THR 119.A N ARG 115.A O no hydrogen 2.921 N/A THR 119.A OG1 ARG 115.A O no hydrogen 3.314 N/A THR 119.A OG1 LEU 236.A O no hydrogen 3.532 N/A LEU 120.A N PHE 116.A O no hydrogen 2.873 N/A LEU 121.A N ALA 117.A O no hydrogen 2.874 N/A ASP 122.A N ASN 118.A O no hydrogen 2.778 N/A LEU 123.A N THR 119.A O no hydrogen 2.974 N/A GLY 124.A N LEU 121.A O no hydrogen 3.008 N/A ILE 125.A N LEU 120.A O no hydrogen 3.126 N/A LYS 126.A N ASP 129.A OD2 no hydrogen 2.876 N/A LYS 127.A NZ ASP 253.A OD2 no hydrogen 2.759 N/A GLY 128.A N GLY 152.A O no hydrogen 2.800 N/A ASP 129.A N LYS 126.A O no hydrogen 2.930 N/A VAL 131.A N VAL 154.A O no hydrogen 3.055 N/A ALA 132.A N LEU 178.A O no hydrogen 2.820 N/A ILE 133.A N SER 156.A O no hydrogen 2.926 N/A TYR 134.A N ILE 180.A O no hydrogen 2.812 N/A TYR 134.A OH GLY 160.A O no hydrogen 3.329 N/A TYR 134.A OH PHE 162.A O no hydrogen 2.685 N/A VAL 138.A N PRO 136.A O no hydrogen 2.912 N/A GLU 140.A N GLU 140.A OE1 no hydrogen 2.876 N/A ALA 141.A N VAL 138.A O no hydrogen 3.077 N/A VAL 143.A N PRO 139.A O no hydrogen 3.109 N/A ALA 144.A N GLU 140.A O no hydrogen 2.969 N/A MET 145.A N ALA 141.A O no hydrogen 3.006 N/A LEU 146.A N ALA 142.A O no hydrogen 2.963 N/A ALA 147.A N VAL 143.A O no hydrogen 2.888 N/A CYS 148.A N ALA 144.A O no hydrogen 3.169 N/A CYS 148.A SG ALA 144.A O no hydrogen 3.341 N/A ALA 149.A N MET 145.A O no hydrogen 3.088 N/A ARG 150.A N LEU 146.A O no hydrogen 2.804 N/A ARG 150.A NE HIS 244.A ND1 no hydrogen 2.930 N/A ARG 150.A NH1 ASP 79.A OD1 no hydrogen 3.483 N/A ARG 150.A NH1 ASP 79.A OD2 no hydrogen 2.740 N/A ARG 150.A NH2 ASP 79.A OD1 no hydrogen 2.804 N/A ARG 150.A NH2 HIS 244.A O no hydrogen 2.937 N/A ILE 151.A N ALA 147.A O no hydrogen 3.157 N/A ILE 151.A N CYS 148.A O no hydrogen 3.177 N/A GLY 152.A N ALA 149.A O no hydrogen 3.058 N/A ALA 153.A N CYS 148.A O no hydrogen 2.866 N/A VAL 154.A N ASP 129.A O no hydrogen 2.756 N/A HIS 155.A NE2 TYR 314.A OH no hydrogen 2.762 N/A SER 156.A N VAL 131.A O no hydrogen 2.774 N/A ILE 158.A N ILE 133.A O no hydrogen 2.684 N/A PHE 162.A N PHE 159.A O no hydrogen 3.062 N/A SER 163.A N ILE 583.A O no hydrogen 2.924 N/A SER 163.A OG LYS 581.A O no hydrogen 2.644 N/A ALA 166.A N SER 163.A OG no hydrogen 3.287 N/A VAL 167.A N SER 163.A O no hydrogen 2.876 N/A ALA 168.A N PRO 164.A O no hydrogen 2.834 N/A GLY 169.A N GLU 165.A O no hydrogen 2.988 N/A ARG 170.A N ALA 166.A O no hydrogen 3.282 N/A ARG 170.A NH1 ALA 166.A O no hydrogen 3.057 N/A ILE 171.A N VAL 167.A O no hydrogen 2.995 N/A ILE 172.A N ALA 168.A O no hydrogen 2.822 N/A ASP 173.A N GLY 169.A O no hydrogen 2.997 N/A SER 174.A N ARG 170.A O no hydrogen 3.107 N/A SER 174.A OG ARG 170.A O no hydrogen 2.711 N/A SER 174.A OG ILE 171.A O no hydrogen 3.489 N/A SER 174.A OG SER 176.A OG no hydrogen 2.705 N/A SER 175.A N ILE 172.A O no hydrogen 3.305 N/A SER 176.A N ILE 171.A O no hydrogen 3.214 N/A SER 176.A OG SER 174.A OG no hydrogen 2.705 N/A ARG 177.A N VAL 130.A O no hydrogen 2.978 N/A ARG 177.A NH1 GLY 124.A O no hydrogen 2.817 N/A ARG 177.A NH1 ASP 129.A OD2 no hydrogen 3.015 N/A ARG 177.A NH2 GLU 211.A OE1 no hydrogen 3.555 N/A ARG 177.A NH2 GLU 211.A OE2 no hydrogen 2.897 N/A VAL 179.A N HIS 212.A O no hydrogen 3.080 N/A ILE 180.A N ALA 132.A O no hydrogen 2.795 N/A THR 181.A N ILE 214.A O no hydrogen 2.835 N/A THR 181.A OG1 TYR 134.A O no hydrogen 2.708 N/A THR 181.A OG1 ALA 182.A O no hydrogen 3.549 N/A ASP 183.A N LEU 216.A O no hydrogen 2.966 N/A GLU 184.A N ASP 183.A OD1 no hydrogen 2.690 N/A GLY 185.A N ILE 192.A O no hydrogen 2.899 N/A ARG 187.A N ARG 190.A O no hydrogen 2.832 N/A ALA 188.A N ASP 96.A OD1 no hydrogen 2.802 N/A GLY 189.A N ASP 96.A OD2 no hydrogen 2.627 N/A ARG 190.A N ARG 187.A O no hydrogen 2.956 N/A ILE 192.A N GLY 185.A O no hydrogen 2.799 N/A LEU 194.A N ASP 183.A O no hydrogen 3.265 N/A LYS 195.A N ASP 183.A O no hydrogen 3.148 N/A LYS 195.A NZ ASP 199.A OD1 no hydrogen 2.685 N/A LYS 195.A NZ ASP 199.A OD2 no hydrogen 3.197 N/A LYS 195.A NZ ASP 224.A O no hydrogen 2.740 N/A LYS 195.A NZ ASP 230.A OD2 no hydrogen 2.745 N/A ASN 197.A ND2 TYR 134.A OH no hydrogen 2.979 N/A VAL 198.A N LEU 194.A O no hydrogen 3.075 N/A ASP 199.A N LYS 195.A O no hydrogen 2.888 N/A ASP 200.A N LYS 196.A O no hydrogen 2.946 N/A ALA 201.A N ASN 197.A O no hydrogen 2.871 N/A LEU 202.A N VAL 198.A O no hydrogen 2.915 N/A LYS 203.A N ASP 200.A O no hydrogen 3.198 N/A ASN 204.A N ALA 201.A O no hydrogen 3.239 N/A ASN 206.A N ASN 204.A OD1 no hydrogen 2.706 N/A ASN 206.A ND2 ASN 204.A OD1 no hydrogen 3.503 N/A VAL 207.A N ASN 204.A O no hydrogen 3.165 N/A SER 209.A OG SER 176.A O no hydrogen 2.537 N/A GLU 211.A N ARG 177.A O no hydrogen 2.860 N/A HIS 212.A ND1 ARG 229.A O no hydrogen 3.034 N/A VAL 213.A N ARG 229.A O no hydrogen 3.060 N/A ILE 214.A N VAL 179.A O no hydrogen 2.860 N/A VAL 215.A N LEU 231.A O no hydrogen 2.813 N/A LEU 216.A N THR 181.A O no hydrogen 2.842 N/A ARG 218.A N ASP 183.A OD1 no hydrogen 2.803 N/A ARG 218.A NE GLU 327.A OE2 no hydrogen 2.767 N/A ARG 218.A NH1 ARG 218.A O no hydrogen 2.763 N/A ARG 218.A NH2 GLU 327.A OE1 no hydrogen 3.088 N/A ARG 218.A NH2 GLU 327.A OE2 no hydrogen 2.994 N/A THR 219.A N ASP 183.A OD1 no hydrogen 3.095 N/A THR 219.A OG1 GLU 184.A OE1 no hydrogen 2.728 N/A GLY 220.A N ASP 183.A OD2 no hydrogen 3.057 N/A SER 221.A N THR 219.A OG1 no hydrogen 3.379 N/A SER 221.A OG GLU 184.A OE1 no hydrogen 2.539 N/A GLN 226.A N ASP 230.A OD2 no hydrogen 2.826 N/A ARG 229.A NE ASP 230.A OD1 no hydrogen 2.750 N/A ARG 229.A NH2 ASP 199.A OD1 no hydrogen 2.894 N/A ARG 229.A NH2 ASP 230.A OD1 no hydrogen 3.004 N/A ARG 229.A NH2 ASP 230.A OD2 no hydrogen 3.060 N/A ASP 230.A N GLN 226.A O no hydrogen 2.937 N/A LEU 231.A N VAL 213.A O no hydrogen 2.823 N/A TRP 233.A N VAL 215.A O no hydrogen 2.686 N/A LEU 236.A N TRP 232.A O no hydrogen 3.180 N/A ILE 237.A N TRP 233.A O no hydrogen 2.955 N/A GLU 238.A N ARG 234.A O no hydrogen 3.304 N/A LYS 239.A N LEU 236.A O no hydrogen 3.148 N/A ALA 240.A N ILE 237.A O no hydrogen 3.230 N/A SER 241.A OG GLU 243.A O no hydrogen 3.351 N/A GLU 243.A N SER 241.A OG no hydrogen 3.104 N/A MET 249.A N LEU 71.A O no hydrogen 2.801 N/A ASN 250.A N ASP 253.A OD2 no hydrogen 2.836 N/A ASN 250.A ND2 GLU 67.A O no hydrogen 2.938 N/A ALA 251.A N GLY 69.A O no hydrogen 2.922 N/A GLU 252.A N ASN 250.A OD1 no hydrogen 2.963 N/A ASP 253.A N ASN 250.A O no hydrogen 3.119 N/A LEU 255.A N HIS 272.A O no hydrogen 2.748 N/A PHE 256.A N HIS 272.A O no hydrogen 3.259 N/A ILE 257.A N HIS 155.A O no hydrogen 3.106 N/A LEU 258.A N VAL 270.A O no hydrogen 2.872 N/A TYR 259.A OH ASP 173.A OD1 no hydrogen 2.537 N/A THR 260.A N LYS 268.A O no hydrogen 2.985 N/A THR 260.A OG1 LEU 258.A O no hydrogen 2.904 N/A SER 261.A OG GLU 527.A OE2 no hydrogen 2.403 N/A LYS 268.A N THR 260.A O no hydrogen 3.034 N/A VAL 270.A N LEU 258.A O no hydrogen 2.914 N/A LEU 271.A N THR 472.A O no hydrogen 2.983 N/A HIS 272.A N PHE 256.A O no hydrogen 2.982 N/A HIS 272.A NE2 THR 412.A O no hydrogen 2.809 N/A THR 273.A OG1 GLU 252.A OE1 no hydrogen 2.783 N/A THR 274.A N ALA 251.A O no hydrogen 3.245 N/A THR 274.A OG1 ASP 253.A O no hydrogen 2.891 N/A GLY 275.A N ALA 251.A O no hydrogen 2.938 N/A TYR 277.A OH SER 310.A OG no hydrogen 2.765 N/A LEU 278.A N THR 274.A O no hydrogen 3.072 N/A VAL 279.A N GLY 275.A O no hydrogen 2.915 N/A TYR 280.A N GLY 276.A O no hydrogen 2.882 N/A TYR 280.A OH PHE 417.A O no hydrogen 2.693 N/A ALA 281.A N TYR 277.A O no hydrogen 2.885 N/A ALA 282.A N LEU 278.A O no hydrogen 3.065 N/A THR 283.A N VAL 279.A O no hydrogen 2.879 N/A THR 283.A OG1 GLN 38.A OE1 no hydrogen 3.005 N/A THR 283.A OG1 VAL 279.A O no hydrogen 2.628 N/A THR 284.A N TYR 280.A O no hydrogen 3.023 N/A THR 284.A OG1 TYR 280.A O no hydrogen 2.559 N/A THR 284.A OG1 ALA 281.A O no hydrogen 3.237 N/A THR 284.A OG1 TYR 311.A OH no hydrogen 2.626 N/A PHE 285.A N ALA 281.A O no hydrogen 3.006 N/A LYS 286.A N ALA 282.A O no hydrogen 3.053 N/A TYR 287.A N THR 283.A O no hydrogen 3.223 N/A VAL 288.A N THR 284.A O no hydrogen 3.022 N/A PHE 289.A N PHE 285.A O no hydrogen 3.199 N/A TYR 291.A N LYS 286.A O no hydrogen 2.883 N/A HIS 292.A N ASP 295.A OD2 no hydrogen 2.808 N/A HIS 292.A ND1 ASP 290.A O no hydrogen 2.961 N/A ASP 295.A N HIS 292.A O no hydrogen 2.942 N/A ILE 296.A N ASN 348.A OD1 no hydrogen 2.713 N/A TYR 297.A N THR 322.A O no hydrogen 3.010 N/A TYR 297.A OH TYR 311.A O no hydrogen 2.712 N/A TRP 298.A N ILE 349.A O no hydrogen 2.675 N/A THR 300.A N TYR 351.A O no hydrogen 3.087 N/A THR 300.A OG1 TYR 351.A O no hydrogen 3.493 N/A THR 300.A OG1 THR 352.A OG1 no hydrogen 2.825 N/A GLY 304.A N ASP 302.A OD1 no hydrogen 2.818 N/A TRP 305.A N ASP 302.A O no hydrogen 3.064 N/A HIS 309.A N TRP 305.A O no hydrogen 3.165 N/A HIS 309.A ND1 TRP 305.A O no hydrogen 3.163 N/A SER 310.A N VAL 306.A O no hydrogen 2.790 N/A SER 310.A OG TYR 277.A OH no hydrogen 2.765 N/A SER 310.A OG GLY 415.A O no hydrogen 2.607 N/A TYR 311.A N THR 307.A O no hydrogen 2.837 N/A TYR 311.A OH THR 284.A OG1 no hydrogen 2.626 N/A LEU 312.A N THR 307.A O no hydrogen 3.230 N/A TYR 314.A N HIS 309.A O no hydrogen 2.980 N/A TYR 314.A OH HIS 155.A NE2 no hydrogen 2.762 N/A GLY 315.A N SER 310.A O no hydrogen 2.779 N/A LEU 317.A N LEU 313.A O no hydrogen 3.003 N/A ALA 318.A N TYR 314.A O no hydrogen 2.996 N/A CYS 319.A N GLY 315.A O no hydrogen 3.297 N/A CYS 319.A N PRO 316.A O no hydrogen 3.031 N/A CYS 319.A SG ALA 282.A O no hydrogen 3.465 N/A CYS 319.A SG GLY 315.A O no hydrogen 3.631 N/A GLY 320.A N LEU 317.A O no hydrogen 3.033 N/A ALA 321.A N PRO 316.A O no hydrogen 3.030 N/A THR 322.A OG1 THR 89.A O no hydrogen 2.638 N/A THR 323.A N ALA 90.A O no hydrogen 2.850 N/A THR 323.A OG1 LEU 312.A O no hydrogen 2.810 N/A LEU 324.A N TYR 297.A O no hydrogen 2.788 N/A MET 325.A N ILE 92.A O no hydrogen 2.721 N/A GLU 327.A N GLU 94.A O no hydrogen 2.868 N/A TRP 332.A N VAL 329.A O no hydrogen 3.221 N/A ALA 336.A N THR 334.A OG1 no hydrogen 3.354 N/A ARG 337.A N THR 334.A O no hydrogen 2.958 N/A ARG 337.A NH1 ASP 96.A O no hydrogen 2.734 N/A ARG 337.A NH1 TRP 332.A O no hydrogen 2.999 N/A ARG 337.A NH2 GLU 94.A OE2 no hydrogen 2.976 N/A ARG 337.A NH2 GLY 95.A O no hydrogen 2.823 N/A MET 338.A N PRO 330.A O no hydrogen 2.830 N/A CYS 339.A SG ALA 367.A O no hydrogen 3.810 N/A GLN 340.A N ALA 336.A O no hydrogen 2.909 N/A VAL 341.A N ARG 337.A O no hydrogen 3.028 N/A VAL 342.A N MET 338.A O no hydrogen 3.174 N/A ASP 343.A N CYS 339.A O no hydrogen 3.081 N/A LYS 344.A N GLN 340.A O no hydrogen 2.834 N/A LYS 344.A NZ GLU 94.A OE1 no hydrogen 2.807 N/A LYS 344.A NZ GLU 94.A OE2 no hydrogen 3.247 N/A LYS 344.A NZ THR 98.A O no hydrogen 2.680 N/A LYS 344.A NZ THR 98.A OG1 no hydrogen 3.294 N/A HIS 345.A N VAL 341.A O no hydrogen 2.991 N/A HIS 345.A NE2 GLU 94.A OE1 no hydrogen 2.709 N/A GLN 346.A N ASP 343.A O no hydrogen 3.305 N/A VAL 347.A N VAL 342.A O no hydrogen 2.855 N/A ASN 348.A N ILE 296.A O no hydrogen 2.799 N/A ASN 348.A ND2 SER 375.A O no hydrogen 2.779 N/A ILE 349.A N ILE 296.A O no hydrogen 2.980 N/A LEU 350.A N ILE 378.A O no hydrogen 2.964 N/A TYR 351.A N TRP 298.A O no hydrogen 2.687 N/A TYR 351.A OH THR 408.A OG1 no hydrogen 2.696 N/A THR 352.A N GLY 380.A O no hydrogen 3.044 N/A THR 352.A OG1 THR 300.A OG1 no hydrogen 2.825 N/A ALA 353.A N THR 352.A OG1 no hydrogen 2.730 N/A THR 355.A N GLU 384.A OE2 no hydrogen 3.036 N/A THR 355.A OG1 GLU 384.A OE1 no hydrogen 2.883 N/A THR 355.A OG1 GLU 384.A OE2 no hydrogen 2.918 N/A ILE 357.A N ALA 353.A O no hydrogen 3.061 N/A ARG 358.A N PRO 354.A O no hydrogen 2.886 N/A ARG 358.A NE ILE 550.A O no hydrogen 2.748 N/A ARG 358.A NH1 PRO 385.A O no hydrogen 3.456 N/A ARG 358.A NH2 GLU 384.A OE1 no hydrogen 2.587 N/A ARG 358.A NH2 ILE 550.A O no hydrogen 3.050 N/A ALA 359.A N THR 355.A O no hydrogen 2.848 N/A LEU 360.A N ALA 356.A O no hydrogen 2.901 N/A MET 361.A N ILE 357.A O no hydrogen 2.832 N/A ALA 362.A N ARG 358.A O no hydrogen 3.000 N/A GLU 363.A N LEU 360.A O no hydrogen 2.902 N/A GLY 364.A N MET 361.A O no hydrogen 2.771 N/A LYS 366.A N GLU 363.A O no hydrogen 3.174 N/A ALA 367.A N GLY 364.A O no hydrogen 3.310 N/A ILE 368.A N ASP 365.A O no hydrogen 3.099 N/A THR 371.A N ILE 368.A O no hydrogen 2.964 N/A THR 371.A OG1 ILE 368.A O no hydrogen 2.760 N/A ASP 372.A N ASP 343.A OD2 no hydrogen 2.826 N/A ARG 373.A N ASP 343.A OD1 no hydrogen 2.907 N/A ARG 373.A NE THR 371.A OG1 no hydrogen 2.870 N/A ARG 373.A NH1 LYS 397.A O no hydrogen 2.686 N/A ARG 373.A NH2 THR 371.A O no hydrogen 3.046 N/A SER 374.A N ASP 372.A OD1 no hydrogen 2.708 N/A SER 374.A OG ASP 372.A OD1 no hydrogen 2.106 N/A SER 375.A OG VAL 347.A O no hydrogen 2.821 N/A LEU 376.A N ARG 373.A O no hydrogen 3.254 N/A ARG 377.A N ASN 348.A O no hydrogen 2.872 N/A ARG 377.A NH2 ASP 295.A OD1 no hydrogen 2.681 N/A ILE 378.A N ASN 348.A O no hydrogen 3.093 N/A LEU 379.A N PRO 404.A O no hydrogen 2.960 N/A GLY 380.A N LEU 350.A O no hydrogen 2.708 N/A SER 381.A N VAL 406.A O no hydrogen 2.961 N/A ALA 382.A N THR 352.A O no hydrogen 3.112 N/A ALA 390.A N ASN 387.A OD1 no hydrogen 2.793 N/A TRP 391.A N ASN 387.A O no hydrogen 3.002 N/A GLU 392.A N PRO 388.A O no hydrogen 2.922 N/A TRP 393.A N GLU 389.A O no hydrogen 2.956 N/A TYR 394.A N ALA 390.A O no hydrogen 2.895 N/A TYR 394.A OH GLY 380.A O no hydrogen 2.840 N/A TRP 395.A N TRP 391.A O no hydrogen 2.835 N/A LYS 396.A N GLU 392.A O no hydrogen 2.948 N/A LYS 397.A N TRP 393.A O no hydrogen 2.813 N/A LYS 397.A NZ ASP 365.A OD1 no hydrogen 2.616 N/A ILE 398.A N TYR 394.A O no hydrogen 3.236 N/A GLY 399.A N TYR 394.A O no hydrogen 3.211 N/A LYS 400.A NZ ASP 372.A O no hydrogen 3.129 N/A GLU 401.A N TRP 395.A O no hydrogen 2.960 N/A LYS 402.A N GLY 399.A O no hydrogen 3.025 N/A CYS 403.A SG LEU 376.A O no hydrogen 3.142 N/A CYS 403.A SG GLY 399.A O no hydrogen 3.646 N/A VAL 406.A N LEU 379.A O no hydrogen 2.755 N/A THR 408.A N SER 381.A O no hydrogen 2.989 N/A THR 408.A OG1 TYR 351.A OH no hydrogen 2.696 N/A THR 408.A OG1 SER 381.A O no hydrogen 3.494 N/A THR 408.A OG1 THR 408.A O no hydrogen 2.571 N/A TRP 409.A N ILE 419.A O no hydrogen 2.952 N/A TRP 409.A NE1 ASP 496.A OD2 no hydrogen 2.841 N/A GLN 411.A N THR 414.A OG1 no hydrogen 3.234 N/A GLN 411.A NE2 SER 494.A O no hydrogen 2.743 N/A GLU 413.A N GLU 413.A OE1 no hydrogen 2.769 N/A THR 414.A N GLN 411.A O no hydrogen 2.857 N/A THR 414.A OG1 GLN 411.A O no hydrogen 3.110 N/A THR 414.A OG1 GLY 416.A O no hydrogen 2.896 N/A GLY 415.A N THR 412.A O no hydrogen 3.412 N/A GLY 416.A N THR 414.A O no hydrogen 2.732 N/A PHE 417.A N TYR 311.A OH no hydrogen 2.827 N/A MET 418.A N TRP 409.A O no hydrogen 3.046 N/A ILE 419.A N TRP 409.A O no hydrogen 3.304 N/A THR 420.A N ARG 435.A O no hydrogen 2.912 N/A THR 420.A OG1 PRO 421.A O no hydrogen 2.916 N/A ALA 425.A N LEU 422.A O no hydrogen 3.114 N/A ILE 426.A N LEU 422.A O no hydrogen 2.886 N/A LEU 428.A N HIS 3.A O no hydrogen 3.116 N/A LYS 429.A NZ ASP 501.A OD2 no hydrogen 2.650 N/A LYS 429.A NZ ASP 503.A OD2 no hydrogen 2.858 N/A SER 432.A N LYS 429.A O no hydrogen 2.921 N/A SER 432.A OG TYR 506.A O no hydrogen 2.813 N/A THR 434.A N SER 432.A OG no hydrogen 3.010 N/A THR 434.A OG1 ALA 433.A O no hydrogen 2.569 N/A ARG 435.A N THR 434.A OG1 no hydrogen 2.697 N/A ARG 435.A NH1 ASP 503.A O no hydrogen 2.975 N/A ARG 435.A NH2 ASP 503.A O no hydrogen 3.510 N/A PHE 437.A N MET 418.A O no hydrogen 2.750 N/A GLY 439.A N SER 27.A OG no hydrogen 2.907 N/A VAL 440.A N PHE 437.A O no hydrogen 3.015 N/A ALA 443.A N VAL 461.A O no hydrogen 2.920 N/A VAL 445.A N ASN 459.A O no hydrogen 3.052 N/A ASP 446.A N HIS 450.A O no hydrogen 2.987 N/A GLU 448.A N ASP 446.A OD1 no hydrogen 3.037 N/A GLY 449.A N ASP 446.A O no hydrogen 2.786 N/A HIS 450.A N ASP 446.A OD1 no hydrogen 2.807 N/A HIS 450.A ND1 ASP 446.A OD2 no hydrogen 3.045 N/A GLN 452.A N LEU 444.A O no hydrogen 2.674 N/A THR 456.A N ARG 500.A O no hydrogen 2.977 N/A THR 456.A OG1 GLU 457.A O no hydrogen 3.516 N/A GLY 458.A N ALA 498.A O no hydrogen 3.070 N/A ASN 459.A N VAL 445.A O no hydrogen 2.795 N/A ASN 459.A ND2 VAL 445.A O no hydrogen 3.014 N/A ASN 459.A ND2 ASN 447.A OD1 no hydrogen 2.888 N/A LEU 460.A N ASP 496.A O no hydrogen 2.973 N/A VAL 461.A N ALA 443.A O no hydrogen 2.965 N/A ILE 462.A N TYR 492.A O no hydrogen 2.884 N/A THR 463.A N GLN 441.A O no hydrogen 2.893 N/A THR 463.A OG1 GLN 441.A O no hydrogen 3.321 N/A SER 465.A N ASP 464.A OD1 no hydrogen 2.806 N/A SER 465.A OG TRP 466.A O no hydrogen 3.549 N/A SER 465.A OG GLN 469.A OE1 no hydrogen 2.643 N/A TRP 466.A NE1 THR 414.A O no hydrogen 2.884 N/A GLN 469.A N TRP 466.A O no hydrogen 3.129 N/A ALA 470.A N GLU 413.A O no hydrogen 2.806 N/A ARG 471.A N LEU 271.A O no hydrogen 2.964 N/A ARG 471.A NE GLU 252.A OE1 no hydrogen 3.173 N/A ARG 471.A NE GLU 252.A OE2 no hydrogen 3.468 N/A ARG 471.A NH1 PRO 467.A O no hydrogen 2.931 N/A ARG 471.A NH1 GLN 469.A O no hydrogen 2.600 N/A ARG 471.A NH2 GLU 252.A OE2 no hydrogen 3.130 N/A ARG 471.A NH2 PRO 467.A O no hydrogen 3.445 N/A THR 472.A OG1 LEU 473.A O no hydrogen 3.522 N/A THR 472.A OG1 HIS 477.A ND1 no hydrogen 2.817 N/A PHE 474.A N GLY 269.A O no hydrogen 2.703 N/A ASP 476.A N LEU 473.A O no hydrogen 2.878 N/A HIS 477.A ND1 THR 472.A OG1 no hydrogen 2.817 N/A HIS 477.A NE2 VAL 61.A O no hydrogen 2.765 N/A ARG 479.A N ASP 476.A OD1 no hydrogen 3.171 N/A PHE 480.A N ASP 476.A O no hydrogen 3.240 N/A GLU 481.A N HIS 477.A O no hydrogen 2.988 N/A GLN 482.A N GLU 478.A O no hydrogen 2.989 N/A THR 483.A N ARG 479.A O no hydrogen 2.852 N/A THR 483.A OG1 ARG 479.A O no hydrogen 2.633 N/A TYR 484.A N PHE 480.A O no hydrogen 3.241 N/A TYR 484.A OH GLU 413.A OE2 no hydrogen 2.630 N/A PHE 485.A N GLU 481.A O no hydrogen 3.026 N/A SER 486.A OG GLN 482.A O no hydrogen 2.598 N/A MET 491.A N PHE 488.A O no hydrogen 3.017 N/A TYR 492.A N ILE 462.A O no hydrogen 2.935 N/A TYR 492.A OH GLN 411.A OE1 no hydrogen 2.573 N/A PHE 493.A N TYR 484.A O no hydrogen 2.883 N/A SER 494.A N LEU 460.A O no hydrogen 3.246 N/A SER 494.A OG LEU 460.A O no hydrogen 2.701 N/A ASP 496.A N SER 494.A OG no hydrogen 3.133 N/A GLY 497.A N GLY 510.A O no hydrogen 2.787 N/A ALA 498.A N GLY 458.A O no hydrogen 3.096 N/A ARG 499.A N TRP 507.A O no hydrogen 2.796 N/A ARG 500.A N THR 456.A O no hydrogen 2.753 N/A ARG 500.A NE GLY 454.A O no hydrogen 3.457 N/A ARG 500.A NH1 TYR 506.A OH no hydrogen 2.874 N/A ARG 500.A NH2 GLN 452.A O no hydrogen 2.761 N/A ARG 500.A NH2 GLY 454.A O no hydrogen 3.240 N/A ASP 501.A N TYR 505.A O no hydrogen 3.025 N/A ASP 503.A N ASP 501.A OD1 no hydrogen 2.898 N/A GLY 504.A N ASP 501.A O no hydrogen 2.894 N/A TYR 505.A N ASP 501.A OD1 no hydrogen 3.082 N/A TYR 505.A OH GLU 427.A O no hydrogen 2.662 N/A TYR 506.A N THR 434.A O no hydrogen 2.696 N/A TRP 507.A N ARG 499.A O no hydrogen 2.783 N/A TRP 507.A NE1 ASP 501.A OD2 no hydrogen 3.043 N/A THR 509.A N GLY 497.A O no hydrogen 3.059 N/A ARG 511.A NE ASP 513.A OD2 no hydrogen 2.896 N/A ARG 511.A NH2 ASP 513.A OD1 no hydrogen 2.791 N/A ARG 511.A NH2 ASP 513.A OD2 no hydrogen 3.460 N/A VAL 512.A N GLY 495.A O no hydrogen 2.827 N/A ASP 514.A N SER 263.A OG no hydrogen 2.989 N/A LEU 516.A N LEU 523.A O no hydrogen 2.628 N/A ASN 517.A N GLN 553.A OE1 no hydrogen 2.922 N/A ASN 517.A ND2 GLU 384.A OE1 no hydrogen 3.305 N/A VAL 518.A N HIS 521.A O no hydrogen 2.898 N/A SER 519.A N LYS 551.A O no hydrogen 2.865 N/A HIS 521.A N VAL 518.A O no hydrogen 2.917 N/A ARG 522.A NE SER 261.A O no hydrogen 2.963 N/A ARG 522.A NH1 GLU 413.A OE1 no hydrogen 2.762 N/A ARG 522.A NH1 GLU 413.A OE2 no hydrogen 3.263 N/A ARG 522.A NH2 SER 261.A O no hydrogen 3.133 N/A ARG 522.A NH2 GLU 413.A OE2 no hydrogen 2.682 N/A LEU 523.A N LEU 516.A O no hydrogen 3.186 N/A GLY 524.A N GLU 527.A OE2 no hydrogen 2.962 N/A THR 525.A N ASP 514.A O no hydrogen 2.989 N/A THR 525.A OG1 ASP 514.A O no hydrogen 3.218 N/A GLU 529.A N THR 525.A O no hydrogen 2.983 N/A SER 530.A N ALA 526.A O no hydrogen 2.817 N/A SER 530.A OG ALA 526.A O no hydrogen 3.208 N/A ALA 531.A N GLU 527.A O no hydrogen 2.920 N/A LEU 532.A N ILE 528.A O no hydrogen 3.051 N/A VAL 533.A N GLU 529.A O no hydrogen 2.937 N/A ALA 534.A N SER 530.A O no hydrogen 3.125 N/A HIS 535.A N LEU 532.A O no hydrogen 2.985 N/A HIS 535.A NE2 GLU 574.A OE2 no hydrogen 2.680 N/A LYS 537.A N HIS 535.A ND1 no hydrogen 3.045 N/A ILE 538.A N HIS 535.A O no hydrogen 2.921 N/A ALA 539.A N THR 560.A O no hydrogen 2.885 N/A GLU 540.A N THR 560.A O no hydrogen 3.163 N/A ALA 542.A N TYR 558.A O no hydrogen 2.853 N/A VAL 543.A N GLU 529.A OE2 no hydrogen 2.757 N/A VAL 544.A N TYR 556.A O no hydrogen 2.863 N/A ILE 546.A N ALA 554.A O no hydrogen 2.951 N/A HIS 548.A N GLY 552.A O no hydrogen 2.963 N/A LYS 551.A NZ ASP 590.A OD1 no hydrogen 2.617 N/A GLY 552.A N HIS 548.A O no hydrogen 2.954 N/A ALA 554.A N ILE 546.A O no hydrogen 2.805 N/A ILE 555.A N ASP 590.A OD2 no hydrogen 2.926 N/A TYR 556.A N VAL 544.A O no hydrogen 2.894 N/A TYR 556.A OH HIS 593.A ND1 no hydrogen 2.848 N/A ALA 557.A N VAL 591.A O no hydrogen 2.948 N/A TYR 558.A N ALA 542.A O no hydrogen 2.893 N/A TYR 558.A OH LEU 611.A O no hydrogen 2.843 N/A VAL 559.A N HIS 593.A O no hydrogen 2.853 N/A THR 560.A N GLU 540.A O no hydrogen 2.648 N/A THR 560.A OG1 THR 595.A O no hydrogen 2.750 N/A ASN 562.A N LYS 537.A O no hydrogen 2.806 N/A GLU 565.A N ASN 562.A O no hydrogen 3.260 N/A LEU 571.A N SER 568.A OG no hydrogen 3.041 N/A TYR 572.A N SER 568.A O no hydrogen 2.938 N/A ALA 573.A N PRO 569.A O no hydrogen 2.985 N/A GLU 574.A N GLU 570.A O no hydrogen 2.853 N/A VAL 575.A N LEU 571.A O no hydrogen 2.871 N/A ARG 576.A N TYR 572.A O no hydrogen 3.144 N/A ARG 576.A NH1 PRO 589.A O no hydrogen 3.406 N/A ASN 577.A N ALA 573.A O no hydrogen 2.986 N/A TRP 578.A N GLU 574.A O no hydrogen 2.746 N/A TRP 578.A NE1 ALA 531.A O no hydrogen 2.607 N/A VAL 579.A N VAL 575.A O no hydrogen 3.265 N/A ARG 580.A N ARG 576.A O no hydrogen 3.185 N/A LYS 581.A N ASN 577.A O no hydrogen 2.926 N/A GLU 582.A N TRP 578.A O no hydrogen 2.932 N/A ILE 583.A N VAL 579.A O no hydrogen 2.894 N/A GLY 584.A N VAL 579.A O no hydrogen 3.454 N/A ALA 587.A N GLY 584.A O no hydrogen 3.049 N/A THR 588.A N PRO 585.A O no hydrogen 3.192 N/A THR 588.A OG1 PRO 585.A O no hydrogen 3.290 N/A ASP 590.A N ILE 555.A O no hydrogen 2.799 N/A VAL 591.A N ILE 555.A O no hydrogen 3.140 N/A LEU 592.A N TYR 572.A OH no hydrogen 3.068 N/A HIS 593.A N ALA 557.A O no hydrogen 2.770 N/A HIS 593.A ND1 TYR 556.A OH no hydrogen 2.848 N/A HIS 593.A NE2 GLU 630.A OE1 no hydrogen 2.663 N/A THR 595.A N VAL 559.A O no hydrogen 2.859 N/A THR 595.A OG1 GLU 630.A OE1 no hydrogen 2.888 N/A THR 595.A OG1 GLU 630.A OE2 no hydrogen 3.302 N/A SER 597.A N THR 595.A OG1 no hydrogen 2.925 N/A LYS 600.A NZ GLU 540.A OE1 no hydrogen 3.091 N/A LYS 600.A NZ GLU 540.A OE2 no hydrogen 3.158 N/A THR 601.A N LYS 605.A O no hydrogen 2.902 N/A THR 601.A OG1 SER 603.A OG no hydrogen 3.429 N/A SER 603.A OG THR 601.A OG1 no hydrogen 3.429 N/A GLY 604.A N THR 601.A O no hydrogen 2.860 N/A LYS 605.A N THR 601.A OG1 no hydrogen 3.203 N/A MET 607.A N PRO 599.A O no hydrogen 3.148 N/A ARG 608.A NE GLU 529.A OE2 no hydrogen 2.947 N/A ARG 608.A NH2 GLU 529.A OE1 no hydrogen 3.016 N/A ARG 608.A NH2 GLU 529.A OE2 no hydrogen 3.513 N/A ARG 612.A N ARG 608.A O no hydrogen 2.866 N/A LYS 613.A N ARG 609.A O no hydrogen 3.089 N/A ILE 614.A N ILE 610.A O no hydrogen 2.913 N/A ALA 615.A N LEU 611.A O no hydrogen 2.887 N/A ALA 616.A N ARG 612.A O no hydrogen 3.205 N/A GLY 617.A N LYS 613.A O no hydrogen 3.058 N/A GLY 617.A N ILE 614.A O no hydrogen 3.116 N/A GLY 622.A N ASP 620.A OD1 no hydrogen 2.978 N/A VAL 623.A N ASP 620.A O no hydrogen 3.121 N/A LYS 626.A N GLY 622.A O no hydrogen 3.516 N/A LEU 627.A N VAL 623.A O no hydrogen 2.847 N/A LEU 628.A N VAL 624.A O no hydrogen 2.890 N/A GLU 629.A N GLU 625.A O no hydrogen 3.269 N/A GLU 630.A N LYS 626.A O no hydrogen 3.048 N/A LYS 631.A N LEU 627.A O no hydrogen 3.043 N/A LYS 631.A NZ ALA 615.A O no hydrogen 3.525 N/A GLN 632.A N LEU 628.A O no hydrogen 3.162 N/A ALA 633.A N GLU 629.A O no hydrogen 3.192 N/A