Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p0b_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N LYS 374.A O no hydrogen 3.005 N/A ARG 5.A N GLY 340.A O no hydrogen 2.851 N/A ARG 5.A NH1 ALA 383.A O no hydrogen 2.914 N/A ARG 5.A NH2 GLU 339.A O no hydrogen 2.723 N/A PHE 6.A N ARG 376.A O no hydrogen 2.780 N/A ALA 7.A N ILE 342.A O no hydrogen 2.876 N/A VAL 9.A N SER 344.A O no hydrogen 2.995 N/A LEU 10.A N THR 58.A O no hydrogen 2.861 N/A HIS 11.A N TYR 346.A O no hydrogen 2.842 N/A ALA 12.A N GLY 60.A O no hydrogen 2.836 N/A HIS 13.A N GLU 349.A OE2 no hydrogen 2.989 N/A HIS 13.A ND1 THR 62.A OG1 no hydrogen 2.772 N/A HIS 13.A NE2 ASP 454.A OD1 no hydrogen 3.131 N/A HIS 13.A NE2 ASP 454.A OD2 no hydrogen 3.115 N/A TYR 16.A OH ARG 497.A O no hydrogen 2.565 N/A TYR 16.A OH ASN 499.A OD1 no hydrogen 3.214 N/A VAL 17.A N GLN 68.A OE1 no hydrogen 2.823 N/A ARG 18.A N GLN 68.A OE1 no hydrogen 3.046 N/A ARG 18.A NE ASP 71.A OD1 no hydrogen 2.829 N/A ARG 18.A NH1 TYR 16.A OH no hydrogen 3.058 N/A ARG 18.A NH1 GLU 496.A O no hydrogen 2.770 N/A ARG 18.A NH2 GLU 496.A O no hydrogen 3.454 N/A ARG 18.A NH2 GLU 496.A OE2 no hydrogen 2.946 N/A ALA 19.A N GLU 27.A OE2 no hydrogen 2.792 N/A HIS 20.A N VAL 17.A O no hydrogen 3.095 N/A HIS 20.A NE2 ASP 498.A OD1 no hydrogen 2.784 N/A GLU 27.A N GLY 21.A O no hydrogen 2.804 N/A GLU 28.A N MET 22.A O no hydrogen 2.976 N/A THR 29.A N.A GLY 26.A O no hydrogen 2.940 N/A THR 29.A N.B GLY 26.A O no hydrogen 2.934 N/A THR 29.A OG1.A GLY 26.A O no hydrogen 2.621 N/A TYR 31.A N GLU 27.A O no hydrogen 3.064 N/A TYR 31.A OH GLU 27.A OE1 no hydrogen 2.621 N/A GLU 32.A N GLU 28.A O no hydrogen 2.825 N/A ALA 33.A N THR 29.A O.A no hydrogen 3.196 N/A ALA 33.A N THR 29.A O.B no hydrogen 3.315 N/A MET 34.A N LEU 30.A O no hydrogen 2.863 N/A ALA 35.A N TYR 31.A O no hydrogen 2.953 N/A GLU 36.A N GLU 32.A O no hydrogen 2.900 N/A THR 37.A N ALA 33.A O no hydrogen 2.860 N/A THR 37.A OG1 PHE 351.A O no hydrogen 2.798 N/A TYR 38.A N ALA 33.A O no hydrogen 2.931 N/A TYR 38.A OH GLU 349.A OE2 no hydrogen 2.661 N/A LEU 39.A N MET 34.A O no hydrogen 2.884 N/A LEU 41.A N.A THR 37.A O no hydrogen 2.958 N/A LEU 41.A N.B THR 37.A O no hydrogen 2.937 N/A ILE 42.A N TYR 38.A O no hydrogen 2.931 N/A ARG 43.A N LEU 39.A O no hydrogen 2.994 N/A ARG 43.A NH1 HIS 118.A ND1 no hydrogen 3.044 N/A VAL 44.A N PRO 40.A O no hydrogen 3.006 N/A LEU 45.A N LEU 41.A O.A no hydrogen 2.914 N/A LEU 45.A N LEU 41.A O.B no hydrogen 3.101 N/A GLU 46.A N ILE 42.A O no hydrogen 2.840 N/A ARG 47.A N ARG 43.A O no hydrogen 3.022 N/A ARG 47.A NE GLU 363.A OE1 no hydrogen 3.136 N/A ARG 47.A NE GLU 363.A OE2 no hydrogen 3.424 N/A ARG 47.A NH2 GLU 363.A OE2 no hydrogen 2.801 N/A LEU 48.A N VAL 44.A O no hydrogen 2.890 N/A ARG 49.A N LEU 45.A O no hydrogen 3.105 N/A ALA 50.A N GLU 46.A O no hydrogen 2.934 N/A GLU 51.A N ARG 47.A O no hydrogen 2.971 N/A GLY 52.A N ARG 49.A O no hydrogen 3.167 N/A VAL 53.A N LEU 48.A O no hydrogen 2.969 N/A THR 58.A N LEU 8.A O no hydrogen 2.982 N/A LEU 59.A N GLU 140.A O no hydrogen 2.792 N/A GLY 60.A N LEU 10.A O no hydrogen 2.778 N/A ILE 61.A N ILE 142.A O no hydrogen 3.419 N/A THR 62.A N ALA 12.A O no hydrogen 3.079 N/A THR 62.A OG1 HIS 13.A ND1 no hydrogen 2.772 N/A LEU 65.A N THR 62.A OG1 no hydrogen 3.301 N/A ALA 66.A N THR 62.A O no hydrogen 2.860 N/A GLU 67.A N PRO 63.A O no hydrogen 2.853 N/A GLN 68.A N ILE 64.A O no hydrogen 3.365 N/A GLN 68.A NE2 LEU 14.A O no hydrogen 3.698 N/A GLN 68.A NE2 PRO 15.A O no hydrogen 3.011 N/A GLN 68.A NE2 ILE 64.A O no hydrogen 3.123 N/A LEU 69.A N LEU 65.A O no hydrogen 2.885 N/A ALA 70.A N ALA 66.A O no hydrogen 2.960 N/A ASP 71.A N GLN 68.A O no hydrogen 3.053 N/A ARG 73.A NE GLU 27.A OE2 no hydrogen 2.924 N/A ARG 73.A NH2 GLU 27.A OE2 no hydrogen 3.402 N/A ILE 74.A N ASP 71.A OD1 no hydrogen 3.109 N/A LYS 75.A N ASP 71.A O no hydrogen 2.978 N/A LYS 75.A NZ SER 123.A O.A no hydrogen 3.208 N/A LYS 75.A NZ SER 123.A O.B no hydrogen 3.489 N/A GLU 76.A N.A ALA 72.A O no hydrogen 3.014 N/A GLU 76.A N.B ALA 72.A O no hydrogen 3.027 N/A GLY 77.A N ARG 73.A O no hydrogen 2.816 N/A PHE 78.A N ILE 74.A O no hydrogen 2.803 N/A TRP 79.A N.A LYS 75.A O no hydrogen 3.147 N/A TRP 79.A N.B LYS 75.A O no hydrogen 3.175 N/A TRP 79.A NE1.A GLN 120.A OE1.A no hydrogen 2.965 N/A TRP 79.A NE1.B GLN 120.A OE1.A no hydrogen 3.086 N/A ALA 80.A N GLU 76.A O.A no hydrogen 3.036 N/A ALA 80.A N GLU 76.A O.B no hydrogen 3.075 N/A TYR 81.A N GLY 77.A O no hydrogen 2.850 N/A ALA 82.A N PHE 78.A O no hydrogen 2.813 N/A LYS 83.A N TRP 79.A O.A no hydrogen 3.038 N/A LYS 83.A N TRP 79.A O.B no hydrogen 2.879 N/A LYS 83.A NZ GLU 87.A OE2 no hydrogen 2.795 N/A ASP 84.A N ALA 80.A O no hydrogen 2.946 N/A ARG 85.A N TYR 81.A O no hydrogen 2.854 N/A LEU 86.A N ALA 82.A O no hydrogen 2.929 N/A GLU 87.A N LYS 83.A O no hydrogen 3.061 N/A ARG 88.A N ASP 84.A O no hydrogen 2.876 N/A ARG 88.A NE ASP 84.A OD2 no hydrogen 2.786 N/A ARG 88.A NH1 SER 290.A O no hydrogen 2.918 N/A ARG 88.A NH2 ASP 84.A OD2 no hydrogen 3.304 N/A ALA 89.A N ARG 85.A O no hydrogen 2.883 N/A GLN 90.A N LEU 86.A O no hydrogen 2.834 N/A GLY 91.A N GLU 87.A O no hydrogen 2.942 N/A ASP 92.A N ARG 88.A O no hydrogen 2.890 N/A TYR 93.A N ALA 89.A O no hydrogen 2.882 N/A GLN 94.A N GLN 90.A O no hydrogen 2.969 N/A ARG 95.A N GLY 91.A O no hydrogen 2.999 N/A ARG 95.A NH2 ASP 92.A OD1 no hydrogen 2.871 N/A ARG 95.A NH2 ASP 287.A OD1 no hydrogen 2.828 N/A ARG 95.A NH2 ASP 287.A OD2 no hydrogen 3.558 N/A TYR 96.A N ASP 92.A O no hydrogen 2.775 N/A TYR 96.A OH ASP 287.A OD2 no hydrogen 2.536 N/A ARG 97.A N TYR 93.A O no hydrogen 2.905 N/A ARG 97.A NE TYR 93.A OH no hydrogen 3.287 N/A GLY 98.A N GLU 102.A OE1 no hydrogen 2.784 N/A THR 99.A N TYR 96.A O no hydrogen 2.936 N/A THR 99.A OG1 TYR 96.A O no hydrogen 2.700 N/A LEU 101.A N THR 99.A OG1 no hydrogen 3.110 N/A GLU 102.A N THR 99.A O no hydrogen 3.025 N/A SER 104.A OG HIS 294.A ND1 no hydrogen 2.737 N/A ALA 105.A N LEU 101.A O no hydrogen 3.060 N/A ARG 106.A N GLU 102.A O no hydrogen 2.857 N/A ARG 106.A NH2 TYR 93.A OH no hydrogen 3.307 N/A ARG 106.A NH2 GLU 102.A OE2 no hydrogen 2.287 N/A HIS 107.A N ALA 103.A O no hydrogen 3.000 N/A HIS 107.A NE2 TYR 356.A OH no hydrogen 2.682 N/A GLN 108.A N SER 104.A O no hydrogen 2.982 N/A GLN 108.A NE2 HIS 293.A O no hydrogen 3.459 N/A VAL 109.A N ALA 105.A O no hydrogen 3.096 N/A ALA 110.A N ARG 106.A O no hydrogen 3.079 N/A PHE 111.A N HIS 107.A O no hydrogen 2.842 N/A TRP 112.A N GLN 108.A O no hydrogen 3.016 N/A GLU 113.A N VAL 109.A O no hydrogen 2.971 N/A LEU 114.A N ALA 110.A O no hydrogen 3.010 N/A THR 115.A N PHE 111.A O no hydrogen 2.866 N/A THR 115.A OG1 PHE 111.A O no hydrogen 2.783 N/A LEU 116.A N TRP 112.A O no hydrogen 2.996 N/A ASP 117.A N GLU 113.A O no hydrogen 3.031 N/A HIS 118.A N LEU 114.A O no hydrogen 2.847 N/A HIS 118.A NE2 GLU 46.A OE2 no hydrogen 2.979 N/A PHE 119.A N THR 115.A O no hydrogen 2.922 N/A GLN 120.A N.A LEU 116.A O no hydrogen 2.981 N/A GLN 120.A N.B LEU 116.A O no hydrogen 3.035 N/A ARG 121.A N ASP 117.A O no hydrogen 2.891 N/A ARG 121.A NE ASP 117.A OD2 no hydrogen 2.929 N/A ARG 121.A NH2 ASP 117.A OD2 no hydrogen 3.027 N/A LEU 122.A N HIS 118.A O no hydrogen 2.907 N/A SER 123.A N.A GLN 120.A O.A no hydrogen 3.050 N/A SER 123.A N.A GLN 120.A O.B no hydrogen 2.707 N/A SER 123.A N.B GLN 120.A O.A no hydrogen 3.031 N/A SER 123.A N.B GLN 120.A O.B no hydrogen 2.688 N/A GLY 124.A N PHE 119.A O no hydrogen 2.858 N/A ASP 125.A N LEU 122.A O no hydrogen 3.119 N/A ALA 128.A N ASP 125.A OD1 no hydrogen 3.059 N/A ALA 129.A N ASP 125.A O no hydrogen 3.236 N/A PHE 130.A N LEU 126.A O no hydrogen 2.983 N/A ARG 131.A N VAL 127.A O no hydrogen 2.931 N/A ARG 131.A NH2 GLU 135.A OE2 no hydrogen 2.935 N/A LYS 132.A N.A ALA 128.A O no hydrogen 2.968 N/A LYS 132.A N.B ALA 128.A O no hydrogen 2.959 N/A ALA 133.A N ALA 129.A O no hydrogen 3.031 N/A GLU 134.A N PHE 130.A O no hydrogen 3.049 N/A GLU 135.A N ARG 131.A O no hydrogen 2.964 N/A GLY 136.A N LYS 132.A O.A no hydrogen 3.052 N/A GLY 136.A N LYS 132.A O.B no hydrogen 2.891 N/A GLY 137.A N GLU 134.A O no hydrogen 2.926 N/A GLN 138.A N ALA 133.A O no hydrogen 3.167 N/A GLN 138.A NE2 GLY 136.A O no hydrogen 3.199 N/A GLU 140.A N PHE 57.A O no hydrogen 2.889 N/A ILE 142.A N LEU 59.A O no hydrogen 2.935 N/A THR 143.A N GLY 181.A O no hydrogen 3.349 N/A THR 143.A OG1 GLY 167.A O no hydrogen 3.187 N/A SER 144.A OG TRP 183.A O no hydrogen 2.702 N/A ASN 145.A ND2 GLY 149.A O no hydrogen 2.995 N/A ASN 145.A ND2 SER 151.A OG no hydrogen 2.946 N/A ALA 146.A N GLN 163.A O no hydrogen 2.911 N/A THR 147.A N GLN 163.A OE1 no hydrogen 3.039 N/A THR 147.A OG1 LEU 448.A O no hydrogen 2.644 N/A HIS 148.A N ASN 145.A O no hydrogen 3.028 N/A HIS 148.A ND1 SER 453.A OG no hydrogen 2.784 N/A TYR 150.A OH HIS 404.A ND1 no hydrogen 2.733 N/A LEU 153.A N TYR 150.A O no hydrogen 3.052 N/A GLY 155.A N GLU 423.A OE1 no hydrogen 2.824 N/A GLU 158.A N GLU 158.A OE1 no hydrogen 2.788 N/A ALA 159.A N TYR 156.A O.B no hydrogen 2.937 N/A LEU 160.A N TYR 156.A O.A no hydrogen 3.133 N/A LEU 160.A N TYR 156.A O.B no hydrogen 3.068 N/A TRP 161.A N ASP 157.A O no hydrogen 2.773 N/A ALA 162.A N GLU 158.A O no hydrogen 2.925 N/A GLN 163.A N ALA 159.A O no hydrogen 3.001 N/A GLN 163.A NE2 THR 147.A OG1 no hydrogen 2.924 N/A GLN 163.A NE2 GLU 451.A OE1 no hydrogen 2.870 N/A ILE 164.A N LEU 160.A O no hydrogen 2.907 N/A LYS 165.A N.A TRP 161.A O no hydrogen 2.774 N/A LYS 165.A N.B TRP 161.A O no hydrogen 2.776 N/A THR 166.A N ALA 162.A O no hydrogen 2.959 N/A THR 166.A OG1 ALA 162.A O no hydrogen 2.724 N/A GLY 167.A N GLN 163.A O no hydrogen 3.114 N/A VAL 168.A N ILE 164.A O no hydrogen 2.957 N/A SER 169.A N.A LYS 165.A O.A no hydrogen 2.832 N/A SER 169.A N.A LYS 165.A O.B no hydrogen 2.823 N/A SER 169.A N.B LYS 165.A O.A no hydrogen 2.837 N/A SER 169.A N.B LYS 165.A O.B no hydrogen 2.827 N/A SER 169.A OG.A LYS 165.A O.A no hydrogen 3.077 N/A SER 169.A OG.A LYS 165.A O.B no hydrogen 3.081 N/A SER 169.A OG.B LYS 165.A O.A no hydrogen 3.165 N/A SER 169.A OG.B LYS 165.A O.B no hydrogen 3.163 N/A SER 169.A OG.B THR 166.A O no hydrogen 2.990 N/A THR 170.A N THR 166.A O no hydrogen 2.942 N/A THR 170.A OG1 THR 166.A O no hydrogen 2.879 N/A TYR 171.A N GLY 167.A O no hydrogen 2.986 N/A TYR 171.A OH LEU 141.A O no hydrogen 2.716 N/A ARG 172.A N VAL 168.A O no hydrogen 2.958 N/A ARG 172.A NE ASP 178.A OD1 no hydrogen 2.569 N/A ARG 172.A NH2 ASP 178.A OD1 no hydrogen 2.765 N/A ARG 173.A N.A SER 169.A O.A no hydrogen 2.926 N/A ARG 173.A N.A SER 169.A O.B no hydrogen 2.935 N/A ARG 173.A N.B SER 169.A O.A no hydrogen 2.888 N/A ARG 173.A N.B SER 169.A O.B no hydrogen 2.898 N/A ARG 173.A NH1.B GLU 67.A OE2 no hydrogen 2.762 N/A ARG 173.A NH2.B GLU 67.A OE2 no hydrogen 3.160 N/A HIS 174.A N THR 170.A O no hydrogen 2.961 N/A PHE 175.A N TYR 171.A O no hydrogen 2.873 N/A ALA 176.A N ARG 172.A O no hydrogen 2.856 N/A LYS 177.A NZ GLU 134.A OE2 no hydrogen 2.806 N/A THR 180.A OG1 TYR 221.A OH no hydrogen 2.730 N/A PHE 182.A N TYR 221.A O no hydrogen 3.151 N/A TRP 183.A N THR 143.A O no hydrogen 2.798 N/A MET 187.A N LEU 184.A O no hydrogen 2.794 N/A ALA 188.A N PRO 185.A O no hydrogen 2.943 N/A TYR 189.A N GLY 396.A O no hydrogen 2.907 N/A TYR 189.A OH ASP 211.A OD2 no hydrogen 2.661 N/A ARG 190.A NE PRO 152.A O no hydrogen 3.187 N/A ARG 190.A NH2 PRO 208.A O no hydrogen 3.064 N/A GLY 193.A N ARG 207.A O no hydrogen 3.001 N/A TRP 195.A N GLY 205.A O no hydrogen 2.948 N/A GLY 205.A N TRP 195.A O no hydrogen 3.094 N/A ARG 207.A N GLY 193.A O no hydrogen 2.986 N/A ARG 207.A NE ASP 157.A OD1 no hydrogen 2.813 N/A ARG 207.A NH1 LEU 154.A O no hydrogen 2.888 N/A ARG 207.A NH2 LEU 154.A O no hydrogen 3.261 N/A ARG 207.A NH2 ASP 157.A OD1 no hydrogen 3.025 N/A GLY 209.A N GLU 212.A OE2 no hydrogen 2.764 N/A VAL 210.A N ARG 190.A O no hydrogen 2.918 N/A GLU 212.A N GLY 209.A O no hydrogen 2.976 N/A LEU 214.A N VAL 210.A O no hydrogen 3.027 N/A MET 215.A N ASP 211.A O no hydrogen 2.964 N/A ARG 216.A N GLU 212.A O no hydrogen 3.103 N/A ALA 217.A N LEU 213.A O no hydrogen 3.093 N/A GLY 218.A N MET 215.A O no hydrogen 2.994 N/A ILE 219.A N LEU 214.A O no hydrogen 3.030 N/A ARG 220.A N THR 180.A O no hydrogen 2.769 N/A ARG 220.A NH1 MET 215.A O no hydrogen 2.976 N/A ARG 220.A NH1 ILE 219.A O no hydrogen 2.917 N/A TYR 221.A N THR 180.A O no hydrogen 3.330 N/A TYR 221.A OH GLU 140.A OE1 no hydrogen 2.483 N/A TYR 221.A OH THR 180.A OG1 no hydrogen 2.730 N/A THR 222.A N ARG 255.A O no hydrogen 3.056 N/A THR 222.A OG1 PHE 182.A O no hydrogen 2.648 N/A PHE 223.A N THR 222.A OG1 no hydrogen 2.764 N/A VAL 224.A N LEU 257.A O no hydrogen 2.920 N/A ALA 226.A N ASP 225.A OD2 no hydrogen 2.796 N/A HIS 227.A NE2 GLY 402.A O no hydrogen 3.024 N/A LEU 228.A N ASP 225.A O no hydrogen 3.042 N/A VAL 229.A N ALA 226.A O no hydrogen 3.003 N/A GLN 230.A N ALA 226.A O no hydrogen 3.006 N/A GLN 230.A NE2 GLU 239.A O no hydrogen 3.096 N/A GLY 231.A N HIS 227.A O no hydrogen 3.036 N/A SER 240.A OG SER 240.A O no hydrogen 2.585 N/A SER 240.A OG TYR 245.A OH no hydrogen 2.824 N/A SER 240.A OG GLU 262.A OE1 no hydrogen 3.133 N/A SER 240.A OG GLU 262.A OE2 no hydrogen 2.631 N/A GLN 241.A N GLN 230.A OE1 no hydrogen 2.806 N/A GLN 241.A NE2.A GLN 230.A O no hydrogen 3.415 N/A THR 244.A N GLN 241.A O no hydrogen 3.067 N/A THR 244.A OG1 GLN 241.A O no hydrogen 2.833 N/A TYR 245.A N GLU 242.A O no hydrogen 2.968 N/A TYR 245.A OH SER 240.A OG no hydrogen 2.824 N/A HIS 246.A N ALA 243.A O no hydrogen 3.249 N/A HIS 246.A NE2 GLU 242.A OE1 no hydrogen 2.750 N/A HIS 248.A N VAL 256.A O no hydrogen 3.031 N/A HIS 248.A ND1 THR 391.A OG1 no hydrogen 2.672 N/A HIS 248.A NE2 ALA 243.A O no hydrogen 2.772 N/A GLU 249.A N VAL 389.A O no hydrogen 2.797 N/A LEU 250.A N LEU 254.A O no hydrogen 2.849 N/A SER 252.A OG ASP 211.A OD1 no hydrogen 2.720 N/A GLY 253.A N LEU 250.A O no hydrogen 2.829 N/A LEU 254.A N SER 252.A OG no hydrogen 3.244 N/A ARG 255.A N ARG 220.A O no hydrogen 2.969 N/A ARG 255.A NE GLU 249.A OE1 no hydrogen 2.789 N/A ARG 255.A NH1 VAL 384.A O no hydrogen 2.842 N/A ARG 255.A NH1 GLY 386.A O no hydrogen 2.686 N/A ARG 255.A NH2 GLU 249.A OE1 no hydrogen 2.906 N/A ARG 255.A NH2 GLY 386.A O no hydrogen 3.535 N/A VAL 256.A N HIS 248.A O no hydrogen 2.828 N/A LEU 257.A N THR 222.A O no hydrogen 3.208 N/A ARG 259.A N VAL 224.A O no hydrogen 2.914 N/A ARG 259.A NE ASP 225.A OD2 no hydrogen 2.851 N/A ARG 259.A NH2 ASP 225.A OD1 no hydrogen 2.924 N/A ARG 259.A NH2 ASP 225.A OD2 no hydrogen 3.385 N/A ASN 260.A N LEU 343.A O no hydrogen 2.877 N/A GLU 262.A N GLU 262.A OE1 no hydrogen 2.677 N/A THR 263.A N ASN 260.A OD1 no hydrogen 2.900 N/A THR 263.A OG1 ASN 260.A O no hydrogen 3.447 N/A THR 263.A OG1 ASN 260.A OD1 no hydrogen 2.813 N/A THR 263.A OG1 SER 344.A OG no hydrogen 2.784 N/A THR 264.A OG1 ASN 260.A O no hydrogen 3.545 N/A LEU 265.A N PRO 261.A O no hydrogen 3.039 N/A GLN 266.A N GLU 262.A O no hydrogen 2.980 N/A GLN 266.A NE2 GLN 266.A O no hydrogen 3.147 N/A VAL 267.A N THR 264.A O no hydrogen 3.243 N/A TRP 268.A N THR 264.A O no hydrogen 2.763 N/A SER 269.A N LEU 265.A O no hydrogen 2.787 N/A ASP 271.A N SER 269.A OG no hydrogen 3.061 N/A TYR 272.A N SER 269.A OG no hydrogen 2.936 N/A GLY 273.A N SER 269.A O no hydrogen 2.859 N/A TYR 274.A N GLN 266.A O no hydrogen 3.262 N/A TYR 274.A OH HIS 325.A ND1 no hydrogen 2.743 N/A GLY 276.A N GLY 273.A O no hydrogen 3.078 N/A GLU 277.A N TYR 274.A O no hydrogen 2.992 N/A LEU 279.A N GLU 277.A OE2 no hydrogen 2.932 N/A TYR 280.A N GLU 277.A O no hydrogen 3.099 N/A TYR 280.A OH HIS 322.A ND1 no hydrogen 2.760 N/A ARG 281.A N GLU 357.A OE2 no hydrogen 2.886 N/A GLU 282.A N TRP 295.A O no hydrogen 2.786 N/A HIS 284.A N GLU 282.A OE2 no hydrogen 2.990 N/A ARG 285.A NH1 LEU 304.A O no hydrogen 3.036 N/A LYS 286.A NZ HIS 293.A NE2 no hydrogen 2.818 N/A ASP 287.A N LEU 292.A O no hydrogen 2.828 N/A LEU 289.A N ASP 287.A OD1 no hydrogen 2.862 N/A SER 290.A N ASP 287.A OD1 no hydrogen 3.165 N/A SER 290.A OG ASP 92.A OD1 no hydrogen 3.395 N/A SER 290.A OG ASP 92.A OD2 no hydrogen 2.608 N/A GLY 291.A N ASP 287.A O no hydrogen 2.898 N/A LEU 292.A N SER 290.A OG no hydrogen 3.098 N/A HIS 294.A ND1 SER 104.A OG no hydrogen 2.737 N/A HIS 294.A NE2 ASP 92.A OD2 no hydrogen 2.765 N/A ARG 296.A N ALA 308.A O no hydrogen 2.814 N/A ARG 296.A NH1 GLY 278.A O no hydrogen 3.061 N/A VAL 297.A N TYR 280.A O no hydrogen 2.757 N/A THR 298.A N GLY 278.A O no hydrogen 2.856 N/A THR 298.A OG1 ARG 296.A O no hydrogen 2.800 N/A HIS 299.A N VAL 297.A O no hydrogen 2.761 N/A ARG 300.A NH1 GLY 273.A O no hydrogen 2.690 N/A LYS 301.A N HIS 299.A ND1 no hydrogen 3.005 N/A ALA 302.A N HIS 299.A O no hydrogen 3.034 N/A ASP 303.A N GLU 306.A OE1 no hydrogen 2.998 N/A GLU 306.A N ASP 303.A O no hydrogen 3.001 N/A LYS 307.A N LEU 304.A O no hydrogen 3.173 N/A LYS 307.A NZ GLU 282.A OE1 no hydrogen 2.820 N/A LYS 307.A NZ VAL 297.A O no hydrogen 2.826 N/A ALA 308.A N THR 298.A OG1 no hydrogen 2.840 N/A TYR 310.A N HIS 294.A O no hydrogen 2.854 N/A TYR 310.A OH GLU 357.A OE2 no hydrogen 2.665 N/A ALA 314.A N ASP 311.A OD1 no hydrogen 3.314 N/A ALA 315.A N ASP 311.A O no hydrogen 3.129 N/A PHE 316.A N PRO 312.A O no hydrogen 2.965 N/A ALA 317.A N GLU 313.A O.A no hydrogen 3.130 N/A ALA 317.A N GLU 313.A O.B no hydrogen 3.048 N/A LYS 318.A N ALA 314.A O no hydrogen 3.080 N/A LYS 318.A NZ GLU 321.A OE2 no hydrogen 2.693 N/A THR 319.A N PHE 316.A O no hydrogen 3.195 N/A THR 319.A OG1 PHE 316.A O no hydrogen 2.664 N/A GLU 320.A N ALA 317.A O no hydrogen 3.129 N/A HIS 322.A N LYS 318.A O no hydrogen 3.141 N/A HIS 322.A ND1 TYR 280.A OH no hydrogen 2.760 N/A ALA 323.A N THR 319.A O no hydrogen 2.833 N/A ARG 324.A N.A GLU 320.A O no hydrogen 3.093 N/A ARG 324.A N.B GLU 320.A O no hydrogen 3.092 N/A HIS 325.A N GLU 321.A O no hydrogen 2.933 N/A HIS 325.A ND1 TYR 274.A OH no hydrogen 2.743 N/A PHE 326.A N HIS 322.A O no hydrogen 2.938 N/A VAL 327.A N ALA 323.A O no hydrogen 2.999 N/A GLY 328.A N ARG 324.A O.A no hydrogen 2.930 N/A GLY 328.A N ARG 324.A O.B no hydrogen 2.905 N/A LEU 329.A N HIS 325.A O no hydrogen 3.093 N/A LEU 330.A N PHE 326.A O no hydrogen 2.975 N/A GLU 331.A N VAL 327.A O no hydrogen 2.885 N/A ARG 332.A N GLY 328.A O no hydrogen 3.039 N/A LEU 333.A N LEU 329.A O no hydrogen 2.925 N/A ALA 334.A N LEU 330.A O no hydrogen 2.805 N/A GLY 335.A N GLU 331.A O no hydrogen 2.958 N/A ARG 336.A N ARG 332.A O no hydrogen 3.137 N/A HIS 337.A N LEU 333.A O no hydrogen 2.918 N/A GLY 340.A N HIS 337.A O no hydrogen 2.912 N/A VAL 341.A N TYR 245.A O no hydrogen 2.959 N/A ILE 342.A N ARG 5.A O no hydrogen 2.828 N/A SER 344.A N ALA 7.A O no hydrogen 2.972 N/A SER 344.A OG THR 263.A OG1 no hydrogen 2.784 N/A TYR 346.A N VAL 9.A O no hydrogen 2.904 N/A TYR 346.A OH THR 263.A O no hydrogen 2.781 N/A ALA 348.A N HIS 11.A O no hydrogen 2.788 N/A LEU 350.A N ASP 347.A O.A no hydrogen 3.254 N/A LEU 350.A N ASP 347.A O.B no hydrogen 3.398 N/A PHE 351.A N ALA 348.A O no hydrogen 2.948 N/A GLY 352.A N TRP 355.A O no hydrogen 2.749 N/A HIS 353.A ND1 GLU 36.A OE1 no hydrogen 2.848 N/A TRP 354.A N GLU 349.A O no hydrogen 3.181 N/A TRP 355.A N LEU 350.A O no hydrogen 2.872 N/A TYR 356.A OH HIS 107.A NE2 no hydrogen 2.682 N/A GLU 357.A N GLU 357.A OE1 no hydrogen 2.730 N/A GLY 358.A N TRP 355.A O no hydrogen 2.949 N/A TRP 361.A N GLU 357.A O no hydrogen 3.055 N/A LEU 362.A N GLY 358.A O no hydrogen 2.945 N/A GLU 363.A N VAL 359.A O no hydrogen 2.988 N/A ALA 364.A N ALA 360.A O no hydrogen 2.984 N/A VAL 365.A N TRP 361.A O no hydrogen 2.869 N/A LEU 366.A N LEU 362.A O no hydrogen 2.934 N/A ARG 367.A N GLU 363.A O no hydrogen 2.982 N/A ARG 367.A NE GLU 363.A OE1 no hydrogen 3.078 N/A ARG 367.A NH1 GLU 51.A OE1 no hydrogen 2.731 N/A ARG 367.A NH2 GLU 51.A OE1 no hydrogen 3.345 N/A ARG 367.A NH2 GLU 51.A OE2 no hydrogen 2.783 N/A ARG 367.A NH2 GLU 363.A OE1 no hydrogen 2.906 N/A LEU 368.A N ALA 364.A O no hydrogen 3.024 N/A LEU 369.A N VAL 365.A O no hydrogen 2.889 N/A ALA 370.A N LEU 366.A O no hydrogen 2.980 N/A GLN 371.A N LEU 368.A O no hydrogen 3.160 N/A ASN 372.A N LEU 369.A O no hydrogen 3.232 N/A ASN 372.A ND2 GLU 331.A OE2 no hydrogen 2.818 N/A LYS 374.A N ASN 372.A OD1 no hydrogen 2.768 N/A VAL 375.A N ASN 372.A OD1 no hydrogen 2.920 N/A ARG 376.A N ALA 4.A O no hydrogen 2.796 N/A ARG 376.A NH1 GLU 382.A OE2 no hydrogen 3.343 N/A VAL 378.A N PHE 6.A O no hydrogen 2.869 N/A ALA 380.A N THR 58.A OG1 no hydrogen 2.950 N/A ARG 381.A N GLU 140.A OE2 no hydrogen 2.828 N/A GLU 382.A N THR 379.A OG1 no hydrogen 3.152 N/A ALA 383.A N THR 379.A O no hydrogen 2.879 N/A VAL 384.A N ALA 380.A O no hydrogen 3.022 N/A GLN 385.A N GLU 382.A O no hydrogen 3.142 N/A VAL 389.A N VAL 247.A O no hydrogen 2.814 N/A THR 391.A N GLU 249.A O no hydrogen 2.999 N/A THR 391.A OG1 HIS 248.A ND1 no hydrogen 2.672 N/A GLY 396.A N TYR 189.A O no hydrogen 3.115 N/A SER 397.A N GLY 402.A O no hydrogen 2.944 N/A SER 397.A OG ASP 403.A O no hydrogen 2.695 N/A TRP 398.A N GLU 186.A O no hydrogen 2.918 N/A TRP 398.A NE1 GLU 186.A OE1 no hydrogen 2.861 N/A GLY 399.A N SER 397.A OG no hydrogen 2.934 N/A GLY 401.A N SER 236.A O no hydrogen 2.832 N/A GLY 402.A N GLY 399.A O no hydrogen 2.807 N/A HIS 404.A ND1 TYR 150.A OH no hydrogen 2.733 N/A HIS 404.A NE2 GLU 395.A OE2 no hydrogen 2.754 N/A ARG 405.A N ASP 403.A OD1 no hydrogen 3.142 N/A ARG 405.A NE ASP 403.A OD1 no hydrogen 2.894 N/A ARG 405.A NE ASP 403.A OD2 no hydrogen 3.435 N/A ARG 405.A NH2 ASP 403.A OD2 no hydrogen 2.871 N/A TRP 407.A N HIS 404.A O no hydrogen 2.910 N/A LEU 408.A N HIS 404.A O no hydrogen 2.783 N/A ASN 409.A N THR 412.A OG1 no hydrogen 3.081 N/A ASN 409.A ND2 ARG 405.A O no hydrogen 3.138 N/A LYS 411.A N ASN 409.A OD1 no hydrogen 2.878 N/A THR 412.A N ASN 409.A O no hydrogen 3.040 N/A THR 412.A OG1 TRP 407.A O no hydrogen 2.789 N/A THR 412.A OG1 ASN 409.A O no hydrogen 3.265 N/A TYR 415.A OH LEU 450.A O no hydrogen 2.778 N/A TRP 416.A N THR 412.A O no hydrogen 2.876 N/A TRP 416.A NE1 TRP 407.A O no hydrogen 2.853 N/A GLU 417.A N LEU 413.A O no hydrogen 2.967 N/A LYS 418.A N ASP 414.A O no hydrogen 3.104 N/A VAL 419.A N TYR 415.A O no hydrogen 2.985 N/A TYR 420.A N TRP 416.A O no hydrogen 2.878 N/A TYR 420.A OH LEU 153.A O no hydrogen 2.708 N/A ARG 421.A N GLU 417.A O no hydrogen 3.038 N/A ALA 422.A N LYS 418.A O no hydrogen 2.882 N/A GLU 423.A N VAL 419.A O no hydrogen 2.806 N/A GLY 424.A N TYR 420.A O no hydrogen 3.056 N/A ALA 425.A N ARG 421.A O no hydrogen 3.011 N/A MET 426.A N ALA 422.A O no hydrogen 2.805 N/A ARG 427.A N.A GLU 423.A O no hydrogen 3.170 N/A ARG 427.A N.B GLU 423.A O no hydrogen 3.166 N/A ARG 427.A NE.B TYR 509.A O no hydrogen 2.645 N/A ARG 427.A NH1.B TYR 509.A O no hydrogen 2.878 N/A ARG 427.A NH2.A GLU 158.A OE2 no hydrogen 3.170 N/A GLU 428.A N GLY 424.A O no hydrogen 3.186 N/A ALA 429.A N ALA 425.A O no hydrogen 2.873 N/A ALA 430.A N MET 426.A O no hydrogen 2.926 N/A ARG 431.A N ARG 427.A O.A no hydrogen 2.926 N/A ARG 431.A N ARG 427.A O.B no hydrogen 3.159 N/A ARG 432.A N GLU 428.A O no hydrogen 2.928 N/A ARG 432.A NE GLU 428.A OE2 no hydrogen 2.802 N/A GLY 433.A N ALA 429.A O no hydrogen 3.123 N/A LEU 440.A N PRO 436.A O no hydrogen 2.985 N/A ARG 441.A N GLU 437.A O.A no hydrogen 2.861 N/A ARG 441.A N GLU 437.A O.B no hydrogen 2.931 N/A ARG 441.A NE GLU 437.A OE1.A no hydrogen 3.127 N/A ARG 441.A NH2 GLU 437.A OE2.B no hydrogen 2.825 N/A GLN 442.A N GLY 438.A O no hydrogen 2.978 N/A GLN 442.A NE2 GLU 446.A OE2 no hydrogen 3.145 N/A GLN 442.A NE2 ASP 498.A O no hydrogen 2.957 N/A ALA 443.A N VAL 439.A O no hydrogen 2.831 N/A MET 444.A N LEU 440.A O no hydrogen 2.956 N/A ARG 445.A N ARG 441.A O no hydrogen 3.003 N/A ARG 445.A NE PRO 500.A O no hydrogen 2.897 N/A ARG 445.A NE PHE 501.A O no hydrogen 3.110 N/A ARG 445.A NH1 GLN 442.A OE1 no hydrogen 2.916 N/A ARG 445.A NH2 PHE 501.A O no hydrogen 2.959 N/A GLU 446.A N GLN 442.A O no hydrogen 2.895 N/A LEU 447.A N ALA 443.A O no hydrogen 2.861 N/A LEU 448.A N MET 444.A O no hydrogen 2.915 N/A LEU 449.A N ARG 445.A O no hydrogen 2.839 N/A LEU 450.A N GLU 446.A O no hydrogen 2.850 N/A GLU 451.A N LEU 447.A O no hydrogen 2.841 N/A ALA 452.A N LEU 449.A O no hydrogen 3.237 N/A SER 453.A N HIS 148.A O no hydrogen 3.098 N/A SER 453.A OG HIS 148.A ND1 no hydrogen 2.784 N/A SER 453.A OG HIS 148.A O no hydrogen 3.096 N/A TRP 455.A N ALA 452.A O no hydrogen 3.404 N/A TRP 455.A NE1 LEU 449.A O no hydrogen 2.824 N/A PHE 457.A N SER 453.A O no hydrogen 3.126 N/A LEU 458.A N TRP 455.A O no hydrogen 3.020 N/A MET 459.A N PRO 456.A O no hydrogen 3.304 N/A THR 461.A N LEU 458.A O no hydrogen 3.070 N/A ALA 464.A N THR 461.A O no hydrogen 3.083 N/A GLU 465.A N THR 461.A O no hydrogen 2.870 N/A ALA 468.A N ALA 464.A O no hydrogen 2.973 N/A ARG 469.A N GLU 465.A O no hydrogen 2.920 N/A GLU 470.A N ALA 466.A O no hydrogen 3.009 N/A ARG 471.A N TYR 467.A O no hydrogen 2.982 N/A ARG 471.A NH1 TYR 16.A O no hydrogen 2.862 N/A ARG 471.A NH1 TYR 467.A OH no hydrogen 3.284 N/A ARG 471.A NH2 TYR 16.A O no hydrogen 2.895 N/A ARG 471.A NH2 HIS 475.A NE2 no hydrogen 2.962 N/A TYR 472.A N ALA 468.A O no hydrogen 2.974 N/A TYR 472.A OH ASP 414.A OD1 no hydrogen 2.693 N/A GLU 473.A N ARG 469.A O no hydrogen 2.854 N/A GLU 474.A N GLU 470.A O no hydrogen 2.956 N/A HIS 475.A N ARG 471.A O no hydrogen 3.112 N/A HIS 475.A ND1 GLU 446.A OE1 no hydrogen 2.869 N/A ALA 476.A N TYR 472.A O no hydrogen 2.975 N/A ARG 477.A N GLU 473.A O no hydrogen 2.873 N/A ARG 477.A NE GLU 474.A OE2 no hydrogen 2.711 N/A ARG 477.A NH1 GLU 474.A OE1 no hydrogen 2.898 N/A ARG 477.A NH2 HIS 481.A ND1 no hydrogen 3.483 N/A ALA 478.A N GLU 474.A O no hydrogen 2.912 N/A PHE 479.A N HIS 475.A O no hydrogen 2.945 N/A PHE 480.A N ALA 476.A O no hydrogen 2.985 N/A HIS 481.A N ARG 477.A O no hydrogen 2.882 N/A LEU 482.A N ALA 478.A O no hydrogen 2.985 N/A LEU 483.A N PHE 479.A O no hydrogen 3.210 N/A LYS 484.A N PHE 480.A O no hydrogen 2.931 N/A GLY 485.A N HIS 481.A O no hydrogen 2.871 N/A SER 487.A N GLU 490.A OE1 no hydrogen 2.900 N/A GLU 489.A N GLU 489.A OE2 no hydrogen 2.834 N/A GLU 490.A N SER 487.A OG no hydrogen 3.163 N/A LEU 491.A N SER 487.A O no hydrogen 2.934 N/A ARG 492.A N PRO 488.A O no hydrogen 2.883 N/A ALA 493.A N GLU 489.A O no hydrogen 3.015 N/A LEU 494.A N GLU 490.A O no hydrogen 3.132 N/A GLU 495.A N LEU 491.A O no hydrogen 2.808 N/A GLU 496.A N ARG 492.A O no hydrogen 2.950 N/A ARG 497.A N ALA 493.A O no hydrogen 3.012 N/A ARG 497.A NE ASP 498.A OD1 no hydrogen 3.023 N/A ARG 497.A NE ASP 498.A OD2 no hydrogen 3.381 N/A ARG 497.A NH1 GLU 474.A OE1 no hydrogen 2.875 N/A ARG 497.A NH2 GLU 474.A OE1 no hydrogen 2.951 N/A ARG 497.A NH2 ASP 498.A OD2 no hydrogen 2.846 N/A ASP 498.A N LEU 494.A O no hydrogen 2.853 N/A ASN 499.A N TYR 16.A OH no hydrogen 3.102 N/A ASN 499.A ND2 ASP 71.A OD2 no hydrogen 2.951 N/A PHE 501.A N GLU 67.A OE1 no hydrogen 2.838 N/A ALA 504.A N PHE 501.A O no hydrogen 3.121 N/A ARG 507.A N.A ASP 505.A OD1 no hydrogen 3.072 N/A ARG 507.A N.C ASP 505.A OD1 no hydrogen 3.074 N/A ARG 507.A NE.A ASP 505.A OD1 no hydrogen 2.909 N/A ARG 507.A NE.A ASP 505.A OD2 no hydrogen 3.301 N/A ARG 507.A NE.C ASP 505.A OD1 no hydrogen 3.109 N/A ARG 507.A NH1.C GLU 437.A OE2.A no hydrogen 2.853 N/A ARG 507.A NH2.A ASP 505.A OD2 no hydrogen 3.133 N/A ARG 507.A NH2.C GLU 437.A OE1.A no hydrogen 2.823 N/A ARG 507.A NH2.C GLU 437.A OE2.A no hydrogen 3.533 N/A ARG 507.A NH2.C ASP 505.A OD1 no hydrogen 3.393 N/A LEU 508.A N ASP 505.A O no hydrogen 3.014 N/A TYR 509.A N PRO 506.A O no hydrogen 3.063 N/A LEU 510.A N ARG 507.A O.A no hydrogen 2.837 N/A LEU 510.A N ARG 507.A O.C no hydrogen 3.081 N/A PHE 511.A N LEU 508.A O no hydrogen 3.134 N/A