Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4m8u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N TYR 481.A OH no hydrogen 2.671 N/A GLU 2.A N GLU 2.A OE1 no hydrogen 2.979 N/A TRP 3.A NE1 ASP 248.A OD1 no hydrogen 2.886 N/A LYS 5.A N GLU 2.A O no hydrogen 2.931 N/A LYS 5.A NZ GLU 2.A OE1 no hydrogen 3.121 N/A GLU 6.A N TRP 3.A O no hydrogen 3.323 N/A VAL 8.A N ASP 44.A OD1 no hydrogen 3.113 N/A VAL 9.A N PRO 364.A O no hydrogen 2.954 N/A TYR 10.A N VAL 45.A O no hydrogen 2.808 N/A TYR 10.A OH GLU 371.A OE2 no hydrogen 2.671 N/A GLN 11.A N ILE 366.A O no hydrogen 2.825 N/A GLN 11.A NE2 SER 49.A OG no hydrogen 3.138 N/A GLN 11.A NE2 HIS 330.A ND1 no hydrogen 3.004 N/A ILE 12.A N TRP 47.A O no hydrogen 2.899 N/A TYR 13.A N GLN 368.A OE1 no hydrogen 2.704 N/A ARG 15.A NH1 GLN 56.A OE1 no hydrogen 2.918 N/A SER 16.A N TYR 13.A O no hydrogen 2.860 N/A SER 16.A OG ARG 421.A O no hydrogen 2.645 N/A PHE 17.A N PRO 14.A O no hydrogen 3.226 N/A ASP 19.A N PHE 434.A O no hydrogen 3.023 N/A ALA 20.A N ASP 27.A OD1 no hydrogen 3.133 N/A ASN 21.A N ASP 27.A OD2 no hydrogen 3.334 N/A GLY 22.A N ASP 19.A OD1 no hydrogen 3.068 N/A GLY 24.A N ASP 19.A OD2 no hydrogen 2.820 N/A PHE 25.A N ASP 23.A OD1 no hydrogen 3.017 N/A GLY 26.A N ARG 15.A O no hydrogen 2.737 N/A ASP 27.A N TYR 18.A O no hydrogen 3.142 N/A LEU 28.A N PHE 73.A O no hydrogen 2.968 N/A GLN 29.A NE2 ASP 78.A OD1 no hydrogen 2.842 N/A GLN 29.A NE2 GLN 81.A OE1 no hydrogen 2.986 N/A GLY 30.A N ASP 27.A OD1 no hydrogen 2.867 N/A VAL 31.A N ASP 27.A O no hydrogen 3.046 N/A ILE 32.A N LEU 28.A O no hydrogen 2.993 N/A GLN 33.A N GLN 29.A O no hydrogen 2.980 N/A LYS 34.A N GLY 30.A O no hydrogen 3.191 N/A LYS 34.A N VAL 31.A O no hydrogen 2.887 N/A LEU 35.A N ILE 32.A O no hydrogen 3.255 N/A TYR 37.A OH GLU 371.A OE2 no hydrogen 2.613 N/A ILE 38.A N LYS 34.A O no hydrogen 3.319 N/A LYS 39.A N LEU 35.A O no hydrogen 2.914 N/A LYS 39.A NZ ARG 89.A O no hydrogen 3.159 N/A ASN 40.A N ASP 36.A O no hydrogen 2.945 N/A LEU 41.A N TYR 37.A O no hydrogen 2.961 N/A GLY 42.A N ILE 38.A O no hydrogen 3.088 N/A ASP 44.A N VAL 8.A O no hydrogen 3.076 N/A VAL 45.A N VAL 8.A O no hydrogen 3.342 N/A ILE 46.A N LYS 92.A O no hydrogen 2.890 N/A TRP 47.A N TYR 10.A O no hydrogen 2.967 N/A TRP 47.A NE1 ASP 96.A OD2 no hydrogen 2.973 N/A LEU 48.A N VAL 94.A O no hydrogen 3.046 N/A SER 49.A N ILE 12.A O no hydrogen 3.010 N/A SER 49.A OG TYR 61.A OH no hydrogen 3.058 N/A ASP 53.A N ASN 68.A O no hydrogen 2.927 N/A SER 54.A N ASP 53.A OD2 no hydrogen 3.063 N/A SER 54.A OG ASP 62.A O no hydrogen 2.690 N/A SER 54.A OG ASP 62.A OD1 no hydrogen 3.000 N/A GLN 56.A N SER 54.A OG no hydrogen 2.923 N/A GLN 56.A NE2 SER 54.A O no hydrogen 3.153 N/A ASP 57.A N ASP 62.A OD2 no hydrogen 2.811 N/A ASP 58.A N ASP 62.A OD1 no hydrogen 2.983 N/A ASN 59.A ND2 TYR 13.A OH no hydrogen 3.091 N/A ASN 59.A ND2 ASP 385.A OD2 no hydrogen 3.357 N/A TYR 61.A N ASP 58.A O no hydrogen 3.040 N/A TYR 61.A OH SER 49.A OG no hydrogen 3.058 N/A TYR 61.A OH ASP 96.A OD2 no hydrogen 2.655 N/A TYR 61.A OH HIS 330.A NE2 no hydrogen 3.157 N/A SER 64.A N ASP 53.A O no hydrogen 2.819 N/A ASP 65.A N ASP 53.A O no hydrogen 3.398 N/A TYR 66.A OH VAL 98.A O no hydrogen 2.657 N/A LYS 67.A N ASP 65.A OD1 no hydrogen 2.933 N/A LYS 67.A NZ ASP 182.A OD2.B no hydrogen 2.701 N/A ASN 68.A ND2 ASP 65.A OD2 no hydrogen 2.868 N/A TYR 70.A N VAL 51.A O no hydrogen 2.860 N/A LYS 72.A NZ GLU 71.A OE1 no hydrogen 3.210 N/A PHE 73.A N TYR 70.A O no hydrogen 2.860 N/A GLY 74.A N TYR 70.A O no hydrogen 3.380 N/A GLY 74.A N GLU 71.A O no hydrogen 3.241 N/A THR 75.A N ASP 78.A OD2 no hydrogen 2.884 N/A THR 75.A OG1 ASP 78.A OD2 no hydrogen 3.527 N/A ASN 76.A ND2 LYS 67.A O no hydrogen 2.878 N/A ASP 78.A N THR 75.A O no hydrogen 2.938 N/A MET 79.A N THR 75.A O no hydrogen 3.128 N/A PHE 80.A N ASN 76.A O no hydrogen 2.750 N/A GLN 81.A N GLU 77.A O no hydrogen 2.934 N/A GLN 81.A NE2 GLU 85.A OE1 no hydrogen 3.181 N/A LEU 82.A N ASP 78.A O no hydrogen 2.923 N/A ILE 83.A N MET 79.A O no hydrogen 2.965 N/A ASP 84.A N PHE 80.A O no hydrogen 3.025 N/A GLU 85.A N GLN 81.A O no hydrogen 2.812 N/A VAL 86.A N LEU 82.A O no hydrogen 2.915 N/A HIS 87.A N ILE 83.A O no hydrogen 3.064 N/A HIS 87.A NE2 ASP 193.A OD2 no hydrogen 2.729 N/A LYS 88.A N ASP 84.A O no hydrogen 2.871 N/A ARG 89.A N GLU 85.A O no hydrogen 3.379 N/A ARG 89.A N VAL 86.A O no hydrogen 3.169 N/A ARG 89.A NE ASP 36.A OD1 no hydrogen 2.741 N/A ARG 89.A NH1 GLU 85.A O no hydrogen 2.891 N/A ARG 89.A NH1 GLU 85.A OE2 no hydrogen 2.795 N/A ARG 89.A NH2 ASP 36.A OD1 no hydrogen 3.339 N/A GLY 90.A N HIS 87.A O no hydrogen 2.917 N/A MET 91.A N VAL 86.A O no hydrogen 3.054 N/A LYS 92.A N ASP 44.A O no hydrogen 2.973 N/A ILE 93.A N ASP 193.A OD2 no hydrogen 2.925 N/A VAL 94.A N ILE 46.A O no hydrogen 2.787 N/A MET 95.A N GLY 194.A O no hydrogen 3.034 N/A LEU 97.A N ARG 196.A O no hydrogen 2.779 N/A ASN 100.A ND2 HIS 101.A ND1 no hydrogen 3.010 N/A ASN 100.A ND2 ASP 168.A OD2 no hydrogen 2.964 N/A THR 102.A N PRO 167.A O no hydrogen 3.092 N/A THR 102.A OG1 SER 103.A O no hydrogen 2.833 N/A THR 102.A OG1 TYR 124.A OH no hydrogen 2.681 N/A SER 103.A N ILE 63.A O no hydrogen 2.895 N/A ASP 104.A N LYS 165.A O no hydrogen 3.065 N/A GLU 105.A N SER 103.A OG no hydrogen 2.836 N/A HIS 106.A N SER 103.A O no hydrogen 3.118 N/A TRP 108.A N HIS 106.A ND1 no hydrogen 2.956 N/A ALA 110.A N HIS 106.A O no hydrogen 2.971 N/A GLU 111.A N ALA 107.A O no hydrogen 3.036 N/A SER 112.A N TRP 108.A O no hydrogen 2.844 N/A SER 112.A OG TYR 120.A O no hydrogen 2.910 N/A SER 112.A OG ARG 121.A O no hydrogen 2.961 N/A ARG 113.A N PHE 109.A O no hydrogen 3.017 N/A ARG 113.A NE ASP 151.A OD1 no hydrogen 3.415 N/A ARG 113.A NH2 ASP 151.A OD1 no hydrogen 2.934 N/A LYS 114.A N GLU 111.A O no hydrogen 2.867 N/A LYS 114.A NZ GLU 111.A OE2 no hydrogen 2.868 N/A SER 115.A OG ASP 117.A OD2 no hydrogen 2.695 N/A ASN 118.A N SER 115.A O no hydrogen 3.221 N/A ASN 118.A ND2 GLU 111.A OE1 no hydrogen 3.046 N/A TYR 120.A N ASN 118.A OD1 no hydrogen 2.899 N/A ARG 121.A N ASN 118.A O no hydrogen 2.892 N/A ARG 121.A NH1 SER 112.A O no hydrogen 2.936 N/A ARG 121.A NH2 THR 154.A OG1 no hydrogen 2.935 N/A ARG 121.A NH2 GLN 156.A OE1 no hydrogen 2.872 N/A TYR 123.A N TYR 120.A O no hydrogen 3.010 N/A TYR 123.A OH GLU 179.A OE1 no hydrogen 2.494 N/A TYR 124.A N ARG 121.A O no hydrogen 3.479 N/A TYR 124.A OH THR 102.A OG1 no hydrogen 2.681 N/A TRP 126.A NE1 SER 112.A OG no hydrogen 2.990 N/A LYS 127.A N TYR 157.A O no hydrogen 2.918 N/A LYS 130.A N SER 134.A O no hydrogen 2.942 N/A GLY 133.A N LYS 130.A O no hydrogen 2.844 N/A SER 134.A N ASP 132.A OD1 no hydrogen 2.985 N/A SER 134.A OG ASP 132.A OD1 no hydrogen 2.687 N/A GLU 135.A N GLU 135.A OE1 no hydrogen 2.790 N/A ASN 137.A ND2 PHE 209.A O no hydrogen 2.986 N/A ASN 138.A N ASP 211.A OD1 no hydrogen 2.933 N/A ASN 138.A ND2 TYR 212.A O no hydrogen 3.048 N/A TRP 139.A N ASN 137.A OD1 no hydrogen 3.006 N/A TRP 139.A NE1 PRO 210.A O no hydrogen 2.721 N/A GLY 140.A N ILE 221.A O no hydrogen 2.843 N/A SER 141.A N GLY 145.A O no hydrogen 2.927 N/A SER 141.A OG TYR 161.A O no hydrogen 3.282 N/A SER 141.A OG PHE 162.A O no hydrogen 2.652 N/A ILE 142.A N TYR 161.A O no hydrogen 2.803 N/A PHE 143.A N SER 141.A OG no hydrogen 2.970 N/A SER 144.A N SER 141.A O no hydrogen 3.134 N/A GLY 145.A N GLU 395.A OE2 no hydrogen 2.910 N/A SER 146.A OG TRP 148.A O no hydrogen 3.417 N/A ALA 147.A N TRP 139.A O no hydrogen 2.949 N/A TRP 148.A N SER 146.A OG no hydrogen 2.988 N/A TRP 148.A NE1 ASN 137.A OD1 no hydrogen 2.828 N/A THR 149.A N TYR 158.A O no hydrogen 3.054 N/A THR 149.A OG1 HIS 160.A NE2 no hydrogen 2.693 N/A ASP 151.A N GLN 156.A O no hydrogen 2.887 N/A THR 154.A N ASP 151.A OD2 no hydrogen 2.834 N/A THR 154.A OG1 ASP 151.A OD2 no hydrogen 2.910 N/A GLY 155.A N ASP 151.A O no hydrogen 2.832 N/A GLN 156.A NE2 ASP 128.A OD1 no hydrogen 2.884 N/A TYR 157.A N LYS 127.A O no hydrogen 2.890 N/A TYR 157.A OH GLY 133.A O no hydrogen 2.648 N/A TYR 158.A N THR 149.A O no hydrogen 2.922 N/A TYR 158.A OH LYS 164.A O no hydrogen 2.666 N/A LEU 159.A N LEU 125.A O no hydrogen 3.042 N/A HIS 160.A N ALA 147.A O no hydrogen 2.750 N/A HIS 160.A ND1 PHE 162.A O no hydrogen 2.927 N/A HIS 160.A NE2 THR 149.A OG1 no hydrogen 2.693 N/A TYR 161.A N ASP 168.A OD1 no hydrogen 2.887 N/A SER 163.A N GLN 166.A OE1 no hydrogen 2.803 N/A SER 163.A OG ASP 57.A OD2 no hydrogen 2.762 N/A SER 163.A OG GLN 166.A OE1 no hydrogen 3.191 N/A LYS 165.A N SER 163.A OG no hydrogen 3.009 N/A LYS 165.A NZ ASP 104.A OD1 no hydrogen 2.736 N/A LYS 165.A NZ GLU 105.A OE2 no hydrogen 2.759 N/A GLN 166.A N SER 163.A O no hydrogen 2.841 N/A GLN 166.A NE2 ASP 58.A OD2 no hydrogen 2.995 N/A GLN 166.A NE2 TYR 61.A O no hydrogen 3.169 N/A ASP 168.A N LEU 159.A O no hydrogen 2.957 N/A LEU 169.A N ASN 100.A O no hydrogen 2.884 N/A ASN 170.A N TYR 123.A O no hydrogen 2.842 N/A ASN 170.A ND2 ASP 122.A O no hydrogen 2.934 N/A TRP 171.A NE1 VAL 99.A O no hydrogen 2.865 N/A GLU 172.A N ASN 170.A OD1 no hydrogen 3.128 N/A ASN 173.A N ASN 170.A O no hydrogen 3.073 N/A ASN 173.A ND2 ASP 122.A O no hydrogen 3.065 N/A ALA 175.A N ASN 173.A OD1 no hydrogen 2.966 N/A ARG 177.A N ASN 173.A O no hydrogen 3.347 N/A ARG 177.A NE GLU 238.A OE2 no hydrogen 2.687 N/A ARG 177.A NH1 TRP 171.A O no hydrogen 2.846 N/A ARG 177.A NH2 GLU 238.A OE1 no hydrogen 3.151 N/A ARG 178.A N GLU 174.A O no hydrogen 2.913 N/A GLU 179.A N ALA 175.A O no hydrogen 2.894 N/A VAL 180.A N VAL 176.A O no hydrogen 2.980 N/A TYR 181.A N ARG 177.A O no hydrogen 2.950 N/A TYR 181.A OH GLU 238.A OE2 no hydrogen 2.627 N/A ASP 182.A N ARG 178.A O no hydrogen 2.941 N/A VAL 183.A N GLU 179.A O no hydrogen 3.034 N/A MET 184.A N VAL 180.A O no hydrogen 3.023 N/A ARG 185.A N TYR 181.A O no hydrogen 2.922 N/A ARG 185.A NH1 ASP 182.A OD2.A no hydrogen 2.744 N/A ARG 185.A NH2 GLU 242.A O no hydrogen 3.019 N/A PHE 186.A N ASP 182.A O no hydrogen 2.953 N/A TRP 187.A N VAL 183.A O no hydrogen 3.191 N/A TRP 187.A NE1 TYR 66.A O no hydrogen 2.839 N/A MET 188.A N MET 184.A O no hydrogen 2.918 N/A ASP 189.A N ARG 185.A O no hydrogen 2.785 N/A ARG 190.A N TRP 187.A O no hydrogen 3.046 N/A ARG 190.A NH1 PHE 186.A O no hydrogen 2.882 N/A GLY 191.A N MET 188.A O no hydrogen 3.082 N/A VAL 192.A N TRP 187.A O no hydrogen 3.089 N/A ASP 193.A N ILE 93.A O no hydrogen 2.843 N/A TRP 195.A N MET 250.A O no hydrogen 2.933 N/A ARG 196.A N MET 95.A O no hydrogen 2.867 N/A ARG 196.A NH1 ASP 96.A OD1 no hydrogen 2.888 N/A ARG 196.A NH1 ASP 198.A OD1 no hydrogen 2.878 N/A MET 197.A N VAL 252.A O no hydrogen 2.816 N/A ASP 198.A N LEU 97.A O no hydrogen 2.872 N/A ALA 199.A N GLU 254.A OE1 no hydrogen 2.780 N/A ILE 200.A N GLU 254.A O no hydrogen 3.118 N/A GLY 201.A N ASN 256.A OD1 no hydrogen 3.057 N/A SER 202.A N ALA 199.A O no hydrogen 3.023 N/A SER 202.A OG HIS 226.A O no hydrogen 2.782 N/A ILE 203.A N ILE 200.A O no hydrogen 3.499 N/A LYS 205.A NZ ASP 168.A OD2 no hydrogen 2.723 N/A LYS 205.A NZ SER 202.A O no hydrogen 2.816 N/A PHE 209.A N TYR 206.A O no hydrogen 2.840 N/A TYR 212.A N ASN 138.A OD1 no hydrogen 2.919 N/A TYR 212.A OH HIS 226.A ND1 no hydrogen 2.733 N/A HIS 216.A N THR 214.A OG1 no hydrogen 2.912 N/A ARG 218.A NH1 SER 217.A OG no hydrogen 3.099 N/A ARG 218.A NH1 ASN 290.A O no hydrogen 2.845 N/A ARG 218.A NH2 ASN 290.A OD1 no hydrogen 2.815 N/A TYR 220.A OH GLU 135.A OE2 no hydrogen 2.938 N/A ILE 221.A N ASN 138.A O no hydrogen 2.943 N/A GLY 223.A N HIS 226.A ND1 no hydrogen 3.486 N/A HIS 226.A N GLY 223.A O no hydrogen 3.068 N/A HIS 226.A ND1 TYR 212.A OH no hydrogen 2.733 N/A HIS 226.A NE2 GLY 140.A O no hydrogen 2.849 N/A ASN 228.A N GLY 201.A O no hydrogen 2.890 N/A ASN 228.A ND2 GLY 257.A O no hydrogen 2.972 N/A ARG 231.A N SER 204.A OG no hydrogen 2.905 N/A ARG 231.A NE GLU 234.A OE1 no hydrogen 2.964 N/A ARG 231.A NH1 GLU 172.A OE2 no hydrogen 2.813 N/A ARG 231.A NH2 GLU 234.A OE2 no hydrogen 2.867 N/A LEU 232.A N GLY 229.A O no hydrogen 3.140 N/A HIS 233.A ND1 GLU 273.A OE1 no hydrogen 2.569 N/A HIS 233.A NE2 GLU 262.A OE1 no hydrogen 2.687 N/A PHE 235.A N ARG 231.A O no hydrogen 2.954 N/A ILE 236.A N LEU 232.A O no hydrogen 3.068 N/A GLN 237.A N HIS 233.A O no hydrogen 2.911 N/A GLN 237.A NE2 GLU 273.A OE2 no hydrogen 2.968 N/A GLU 238.A N GLU 234.A O no hydrogen 2.942 N/A MET 239.A N PHE 235.A O no hydrogen 2.897 N/A ASN 240.A N ILE 236.A O no hydrogen 2.886 N/A ASN 240.A ND2 GLU 273.A O no hydrogen 2.866 N/A ARG 241.A N GLN 237.A O no hydrogen 2.960 N/A GLU 242.A N GLU 238.A O no hydrogen 2.810 N/A VAL 243.A N MET 239.A O no hydrogen 2.895 N/A LEU 244.A N MET 239.A O no hydrogen 3.143 N/A SER 245.A N ASN 240.A O no hydrogen 2.886 N/A SER 245.A OG ASN 240.A O no hydrogen 2.994 N/A SER 245.A OG ARG 241.A O no hydrogen 3.165 N/A HIS 246.A N VAL 243.A O no hydrogen 2.891 N/A TYR 247.A N LEU 244.A O no hydrogen 3.268 N/A TYR 247.A OH ASP 189.A OD1 no hydrogen 2.603 N/A CYS 249.A SG LEU 244.A O no hydrogen 3.545 N/A CYS 249.A SG TYR 247.A O no hydrogen 3.656 N/A MET 250.A N ASP 193.A O no hydrogen 2.991 N/A THR 251.A N ASN 275.A OD1 no hydrogen 2.806 N/A THR 251.A OG1 ASN 275.A OD1 no hydrogen 3.462 N/A VAL 252.A N TRP 195.A O no hydrogen 2.945 N/A GLY 253.A N MET 276.A O no hydrogen 2.955 N/A GLU 254.A N MET 197.A O no hydrogen 2.810 N/A ALA 255.A N PHE 278.A O no hydrogen 3.051 N/A ASN 256.A N GLU 254.A O no hydrogen 3.099 N/A ASN 256.A ND2 SER 202.A OG no hydrogen 2.842 N/A SER 258.A N ALA 255.A O no hydrogen 3.088 N/A SER 258.A OG ALA 255.A O no hydrogen 2.752 N/A SER 258.A OG THR 279.A OG1 no hydrogen 3.063 N/A GLU 262.A N ASP 259.A OD1 no hydrogen 2.945 N/A ALA 263.A N ASP 259.A O no hydrogen 2.956 N/A LYS 264.A N ILE 260.A O no hydrogen 3.171 N/A LYS 264.A NZ GLU 261.A OE2 no hydrogen 2.831 N/A LYS 265.A N GLU 261.A O no hydrogen 3.257 N/A TYR 266.A N GLU 262.A O no hydrogen 3.043 N/A THR 267.A N ALA 263.A O no hydrogen 2.934 N/A THR 267.A OG1 ALA 263.A O no hydrogen 2.838 N/A ASP 268.A N LYS 264.A O no hydrogen 2.987 N/A SER 270.A N ASP 268.A OD1 no hydrogen 2.979 N/A SER 270.A OG ASP 268.A OD1 no hydrogen 2.845 N/A SER 270.A OG ASP 268.A OD2 no hydrogen 3.430 N/A ARG 271.A N ASP 268.A O no hydrogen 3.002 N/A ARG 271.A NE LYS 265.A O no hydrogen 2.825 N/A ARG 271.A NE GLU 273.A OE2 no hydrogen 3.241 N/A ARG 271.A NH2 GLU 273.A OE2 no hydrogen 2.909 N/A GLN 272.A N ALA 269.A O no hydrogen 3.142 N/A LEU 274.A N TYR 266.A O no hydrogen 2.857 N/A ASN 275.A N THR 251.A OG1 no hydrogen 3.029 N/A PHE 278.A N GLY 253.A O no hydrogen 2.749 N/A THR 279.A OG1 SER 258.A O no hydrogen 3.193 N/A THR 279.A OG1 SER 258.A OG no hydrogen 3.063 N/A GLU 281.A N THR 279.A OG1 no hydrogen 3.253 N/A HIS 282.A N HIS 282.A ND1 no hydrogen 2.858 N/A HIS 282.A NE2 TYR 326.A O no hydrogen 2.927 N/A ASP 284.A N GLU 281.A O no hydrogen 3.278 N/A LYS 287.A N ASP 284.A O no hydrogen 3.237 N/A LYS 287.A NZ GLU 288.A O no hydrogen 3.240 N/A LYS 287.A NZ GLN 289.A O no hydrogen 3.133 N/A GLU 288.A N GLN 297.A O no hydrogen 2.997 N/A SER 291.A OG GLN 297.A OE1 no hydrogen 3.527 N/A ASN 293.A N SER 291.A OG no hydrogen 3.005 N/A ASN 293.A ND2 GLN 297.A OE1 no hydrogen 2.817 N/A ASN 293.A ND2 THR 402.A O no hydrogen 3.055 N/A GLY 294.A N SER 291.A O no hydrogen 3.090 N/A LYS 295.A NZ GLU 388.A OE1 no hydrogen 2.777 N/A LYS 295.A NZ GLU 388.A OE2 no hydrogen 3.473 N/A TRP 296.A N ASN 293.A O no hydrogen 3.061 N/A GLN 297.A N GLY 294.A O no hydrogen 3.092 N/A GLN 297.A NE2 GLU 407.A OE2.A no hydrogen 3.379 N/A LYS 299.A N ASP 286.A O no hydrogen 2.986 N/A ALA 305.A N ASP 302.A OD2 no hydrogen 3.243 N/A LEU 306.A N ASP 302.A O no hydrogen 3.049 N/A LYS 307.A N LEU 303.A O no hydrogen 2.846 N/A LYS 307.A NZ GLU 489.A O no hydrogen 2.973 N/A LYS 307.A NZ ASP 491.A O no hydrogen 2.719 N/A LYS 307.A NZ VAL 494.A O no hydrogen 2.853 N/A LYS 308.A N ILE 304.A O no hydrogen 2.877 N/A THR 309.A N ALA 305.A O no hydrogen 2.958 N/A THR 309.A OG1 ALA 305.A O no hydrogen 2.828 N/A MET 310.A N LEU 306.A O no hydrogen 2.897 N/A THR 311.A N LYS 307.A O no hydrogen 2.883 N/A THR 311.A OG1 LYS 307.A O no hydrogen 2.668 N/A THR 311.A OG1 TYR 484.A OH no hydrogen 2.878 N/A ARG 312.A N LYS 308.A O no hydrogen 2.978 N/A ARG 312.A NH1 GLU 281.A OE1 no hydrogen 2.870 N/A TRP 313.A N THR 309.A O no hydrogen 3.196 N/A TRP 313.A NE1 GLU 281.A OE1 no hydrogen 2.865 N/A GLN 314.A N MET 310.A O no hydrogen 2.869 N/A GLN 314.A NE2 LYS 361.A O no hydrogen 2.830 N/A THR 315.A N THR 311.A O no hydrogen 2.825 N/A THR 315.A OG1 THR 311.A O no hydrogen 3.001 N/A THR 315.A OG1 ARG 312.A O no hydrogen 3.345 N/A GLY 316.A N ARG 312.A O no hydrogen 2.828 N/A LEU 317.A N TRP 313.A O no hydrogen 3.147 N/A MET 318.A N THR 315.A O no hydrogen 3.168 N/A TRP 322.A NE1 THR 363.A OG1 no hydrogen 2.842 N/A ASN 323.A ND2 TRP 313.A O no hydrogen 3.031 N/A THR 324.A OG1 ILE 277.A O no hydrogen 2.675 N/A LEU 325.A N THR 363.A O no hydrogen 2.948 N/A TYR 326.A OH THR 279.A O no hydrogen 2.669 N/A ASP 331.A N ASN 329.A OD1 no hydrogen 2.750 N/A GLN 332.A N ASN 329.A O no hydrogen 3.298 N/A ARG 334.A N ASN 376.A OD1 no hydrogen 2.941 N/A ARG 334.A NE HIS 419.A O no hydrogen 3.413 N/A ARG 334.A NH1 GLN 368.A O no hydrogen 3.055 N/A ARG 334.A NH2 GLU 328.A OE2 no hydrogen 2.957 N/A ARG 334.A NH2 GLN 368.A O no hydrogen 2.904 N/A VAL 335.A N GLU 328.A OE1 no hydrogen 2.960 N/A SER 337.A N ARG 334.A O no hydrogen 3.119 N/A SER 337.A OG ASP 342.A OD2 no hydrogen 2.643 N/A ARG 338.A N ARG 334.A O no hydrogen 2.971 N/A ARG 338.A NE ASP 286.A OD2 no hydrogen 2.872 N/A ARG 338.A NH1 ASP 286.A OD1 no hydrogen 2.925 N/A ARG 338.A NH1 ASP 286.A OD2 no hydrogen 3.477 N/A ARG 338.A NH2 GLN 332.A OE1 no hydrogen 2.920 N/A TRP 339.A N VAL 335.A O no hydrogen 2.864 N/A TRP 339.A NE1 ASP 286.A OD2 no hydrogen 2.798 N/A GLY 340.A N ILE 336.A O no hydrogen 2.981 N/A ASN 341.A ND2 GLU 514.A OE2 no hydrogen 3.009 N/A ARG 343.A N ASN 341.A OD1 no hydrogen 2.874 N/A LEU 345.A N ASN 341.A OD1 no hydrogen 2.893 N/A ARG 346.A N ARG 343.A O no hydrogen 3.114 N/A ARG 346.A NH1 ILE 372.A O no hydrogen 3.169 N/A ARG 346.A NH1 GLY 373.A O no hydrogen 2.893 N/A LYS 347.A NZ ASP 458.A OD2 no hydrogen 3.150 N/A GLU 348.A N GLU 348.A OE1 no hydrogen 2.835 N/A CYS 349.A N LEU 345.A O no hydrogen 2.774 N/A ALA 350.A N ARG 346.A O no hydrogen 2.873 N/A LYS 351.A N LYS 347.A O no hydrogen 3.050 N/A LYS 351.A NZ ASP 460.A O no hydrogen 2.725 N/A ALA 352.A N GLU 348.A O no hydrogen 2.888 N/A PHE 353.A N CYS 349.A O no hydrogen 3.034 N/A ALA 354.A N ALA 350.A O no hydrogen 3.059 N/A THR 355.A N LYS 351.A O no hydrogen 2.908 N/A THR 355.A OG1 LYS 351.A O no hydrogen 2.689 N/A THR 355.A OG1 TYR 465.A OH no hydrogen 2.728 N/A VAL 356.A N ALA 352.A O no hydrogen 3.050 N/A LEU 357.A N PHE 353.A O no hydrogen 3.090 N/A HIS 358.A N ALA 354.A O no hydrogen 2.893 N/A GLY 359.A N THR 355.A O no hydrogen 3.084 N/A MET 360.A N LEU 357.A O no hydrogen 3.218 N/A LYS 361.A N GLN 314.A OE1 no hydrogen 3.043 N/A LYS 361.A NZ MET 318.A O no hydrogen 2.717 N/A THR 363.A N ASN 323.A O no hydrogen 2.946 N/A THR 363.A OG1 TRP 4.A O no hydrogen 2.799 N/A PHE 365.A N LEU 325.A O no hydrogen 2.906 N/A ILE 366.A N VAL 9.A O no hydrogen 2.784 N/A TYR 367.A N GLU 370.A OE1 no hydrogen 3.072 N/A TYR 367.A OH ALA 420.A O no hydrogen 2.692 N/A GLN 368.A N GLN 11.A O no hydrogen 3.014 N/A GLN 368.A NE2 TYR 13.A O no hydrogen 3.549 N/A GLN 368.A NE2 SER 16.A O no hydrogen 3.492 N/A GLU 370.A N TYR 367.A O no hydrogen 2.805 N/A GLU 371.A N GLU 371.A OE1 no hydrogen 2.736 N/A ILE 372.A N GLY 369.A O no hydrogen 3.200 N/A GLY 373.A N GLU 370.A O no hydrogen 3.047 N/A MET 374.A N GLY 369.A O no hydrogen 3.060 N/A ASN 376.A N SER 337.A OG no hydrogen 2.899 N/A ASN 376.A ND2 MET 413.A O no hydrogen 3.084 N/A ASN 376.A ND2 ILE 414.A O no hydrogen 3.094 N/A SER 377.A N HIS 419.A ND1 no hydrogen 2.947 N/A MET 379.A N SER 377.A OG no hydrogen 2.975 N/A MET 383.A N PRO 380.A O no hydrogen 2.923 N/A TYR 384.A N LEU 381.A O no hydrogen 3.096 N/A ASP 385.A N ASP 418.A OD2 no hydrogen 2.800 N/A ASP 386.A N ASP 418.A OD2 no hydrogen 2.970 N/A GLU 388.A N ASP 386.A OD1 no hydrogen 2.962 N/A ILE 389.A N ASP 386.A O no hydrogen 3.063 N/A LYS 390.A N ASP 386.A O no hydrogen 3.199 N/A LYS 390.A NZ ASP 385.A O no hydrogen 3.306 N/A ASN 391.A N LEU 387.A O no hydrogen 2.882 N/A ASN 391.A ND2 PHE 143.A O no hydrogen 3.011 N/A ALA 392.A N GLU 388.A O no hydrogen 3.026 N/A TYR 393.A N ILE 389.A O no hydrogen 2.846 N/A ARG 394.A N LYS 390.A O no hydrogen 3.252 N/A GLU 395.A N ASN 391.A O no hydrogen 2.938 N/A LEU 396.A N ALA 392.A O no hydrogen 2.853 N/A VAL 397.A N TYR 393.A O no hydrogen 3.026 N/A VAL 398.A N TYR 393.A O no hydrogen 3.191 N/A GLU 399.A N ARG 394.A O no hydrogen 2.846 N/A ASN 400.A N GLU 395.A O no hydrogen 2.824 N/A THR 402.A OG1 ASN 293.A OD1 no hydrogen 2.698 N/A MET 403.A N LEU 396.A O no hydrogen 3.258 N/A SER 404.A N GLU 407.A OE1.B no hydrogen 2.846 N/A GLU 407.A N SER 404.A OG no hydrogen 3.025 N/A PHE 408.A N SER 404.A O no hydrogen 2.969 N/A VAL 409.A N GLU 405.A O no hydrogen 2.901 N/A LYS 410.A N LYS 406.A O no hydrogen 3.094 N/A ALA 411.A N GLU 407.A O no hydrogen 3.053 N/A VAL 412.A N PHE 408.A O no hydrogen 2.855 N/A MET 413.A N VAL 409.A O no hydrogen 2.932 N/A ILE 414.A N LYS 410.A O no hydrogen 3.278 N/A ILE 414.A N ALA 411.A O no hydrogen 3.183 N/A LYS 415.A N ALA 411.A O no hydrogen 2.889 N/A LYS 415.A NZ ASP 286.A O no hydrogen 3.124 N/A LYS 415.A NZ ASP 286.A OD1 no hydrogen 3.146 N/A LYS 415.A NZ LYS 295.A O no hydrogen 2.983 N/A GLY 416.A N VAL 412.A O no hydrogen 2.883 N/A ARG 417.A NE ASP 386.A OD2 no hydrogen 2.846 N/A ARG 417.A NH1 ASP 58.A OD1 no hydrogen 3.148 N/A ARG 417.A NH1 ASP 386.A OD1 no hydrogen 2.793 N/A ARG 417.A NH2 ASP 331.A OD1 no hydrogen 3.200 N/A HIS 419.A N GLY 416.A O no hydrogen 3.243 N/A HIS 419.A NE2 VAL 412.A O no hydrogen 2.884 N/A ALA 420.A N ARG 417.A O no hydrogen 3.018 N/A ARG 421.A N ASP 418.A O no hydrogen 2.940 N/A ARG 421.A NE HIS 330.A O no hydrogen 2.805 N/A ARG 421.A NH2 HIS 330.A O no hydrogen 3.026 N/A THR 422.A N ASP 418.A O no hydrogen 3.292 N/A MET 424.A N SER 16.A O no hydrogen 2.893 N/A GLN 425.A NE2 ILE 450.A O no hydrogen 2.793 N/A TRP 426.A N ALA 432.A O no hydrogen 2.834 N/A TRP 426.A NE1 PHE 17.A O no hydrogen 2.856 N/A ASP 427.A N ALA 432.A O no hydrogen 2.966 N/A GLY 429.A N ASP 427.A OD1 no hydrogen 2.863 N/A LYS 430.A NZ ALA 436.A O no hydrogen 3.035 N/A LYS 430.A NZ GLY 437.A O no hydrogen 3.318 N/A ALA 432.A N GLY 429.A O no hydrogen 2.814 N/A GLY 433.A N LYS 430.A O no hydrogen 3.011 N/A PHE 434.A N HIS 431.A O no hydrogen 2.989 N/A THR 435.A OG1 ASP 19.A OD2 no hydrogen 2.514 N/A GLY 437.A N THR 435.A OG1 no hydrogen 2.957 N/A TRP 440.A N GLY 24.A O no hydrogen 3.057 N/A TRP 440.A NE1 SER 16.A OG no hydrogen 2.961 N/A ASN 444.A ND2 ASN 376.A O no hydrogen 2.975 N/A SER 445.A OG ASP 378.A OD1 no hydrogen 3.298 N/A ARG 446.A N ASN 444.A OD1 no hydrogen 2.913 N/A ARG 446.A NH1 ASP 342.A O no hydrogen 2.955 N/A ARG 446.A NH2 ASP 342.A O no hydrogen 2.830 N/A TYR 447.A N ASN 444.A O no hydrogen 3.168 N/A ASP 449.A N ARG 446.A O no hydrogen 3.168 N/A ILE 450.A N TYR 447.A O no hydrogen 3.248 N/A ASN 451.A N GLU 454.A OE1 no hydrogen 2.983 N/A ASN 451.A ND2 TYR 447.A O no hydrogen 2.878 N/A ASN 451.A ND2 GLN 448.A O no hydrogen 3.218 N/A VAL 452.A N GLN 425.A O no hydrogen 2.937 N/A LYS 453.A N TRP 426.A O no hydrogen 2.928 N/A LYS 453.A NZ GLU 457.A OE1 no hydrogen 2.795 N/A GLU 454.A N ASN 451.A OD1 no hydrogen 2.878 N/A SER 455.A N ASN 451.A O no hydrogen 3.030 N/A SER 455.A OG ASN 451.A O no hydrogen 2.806 N/A SER 455.A OG GLU 454.A OE1 no hydrogen 3.194 N/A LEU 456.A N VAL 452.A O no hydrogen 2.947 N/A GLU 457.A N LYS 453.A O no hydrogen 3.353 N/A GLU 457.A N GLU 454.A O no hydrogen 3.206 N/A ASP 458.A N SER 455.A O no hydrogen 3.277 N/A ASP 460.A N ASP 458.A OD1 no hydrogen 2.924 N/A SER 461.A N ASP 458.A O no hydrogen 2.930 N/A SER 461.A OG SER 455.A O no hydrogen 2.872 N/A SER 461.A OG ASP 458.A O no hydrogen 3.127 N/A PHE 464.A N SER 461.A OG no hydrogen 3.131 N/A TYR 465.A N SER 461.A O no hydrogen 3.264 N/A TYR 465.A OH THR 355.A OG1 no hydrogen 2.728 N/A TYR 466.A N ILE 462.A O no hydrogen 2.912 N/A TYR 466.A OH GLU 370.A OE2 no hydrogen 2.560 N/A GLN 467.A N PHE 463.A O no hydrogen 2.879 N/A GLN 467.A NE2 ASN 40.A O no hydrogen 2.910 N/A LYS 468.A N PHE 464.A O no hydrogen 2.984 N/A LEU 469.A N TYR 465.A O no hydrogen 2.890 N/A ILE 470.A N TYR 466.A O no hydrogen 2.996 N/A GLN 471.A N GLN 467.A O no hydrogen 2.990 N/A LEU 472.A N LYS 468.A O no hydrogen 2.836 N/A ARG 473.A N LEU 469.A O no hydrogen 3.114 N/A ARG 473.A NH1 HIS 358.A O no hydrogen 2.731 N/A ARG 473.A NH2 MET 360.A O no hydrogen 2.876 N/A ARG 473.A NH2 GLY 362.A O no hydrogen 3.239 N/A LYS 474.A N ILE 470.A O no hydrogen 3.231 N/A LYS 474.A NZ GLY 42.A O no hydrogen 2.704 N/A GLN 475.A N GLN 471.A O no hydrogen 3.011 N/A GLN 475.A N LEU 472.A O no hydrogen 3.075 N/A TYR 476.A N LEU 472.A O no hydrogen 2.817 N/A MET 479.A N TYR 476.A O no hydrogen 2.872 N/A ILE 480.A N LYS 477.A O no hydrogen 2.882 N/A TYR 481.A N LYS 477.A O no hydrogen 2.940 N/A TYR 481.A OH GLU 6.A OE2 no hydrogen 2.551 N/A GLY 482.A N ILE 478.A O no hydrogen 2.932 N/A ASP 483.A N GLU 500.A O no hydrogen 3.002 N/A TYR 484.A OH THR 311.A OG1 no hydrogen 2.878 N/A GLN 485.A N LEU 498.A O no hydrogen 2.932 N/A LEU 487.A N SER 496.A O no hydrogen 2.907 N/A ASP 491.A N GLN 488.A O no hydrogen 3.233 N/A GLN 493.A N ASP 491.A OD2 no hydrogen 2.837 N/A GLN 493.A NE2 SER 513.A OG no hydrogen 2.964 N/A GLN 493.A NE2 LYS 516.A O no hydrogen 2.985 N/A VAL 494.A N ASP 491.A OD2 no hydrogen 3.036 N/A PHE 495.A N VAL 510.A O no hydrogen 2.745 N/A SER 496.A OG LEU 487.A O no hydrogen 3.171 N/A TYR 497.A N VAL 508.A O no hydrogen 2.939 N/A TYR 497.A OH VAL 356.A O no hydrogen 2.653 N/A LEU 498.A N GLN 485.A O no hydrogen 2.850 N/A ARG 499.A N LEU 506.A O no hydrogen 2.818 N/A ARG 499.A NE GLY 482.A O no hydrogen 3.325 N/A ARG 499.A NE ASP 483.A O no hydrogen 2.847 N/A ARG 499.A NH1 GLY 359.A O no hydrogen 2.777 N/A ARG 499.A NH1 MET 479.A O no hydrogen 2.865 N/A ARG 499.A NH2 MET 479.A O no hydrogen 3.130 N/A ARG 499.A NH2 GLY 482.A O no hydrogen 2.835 N/A GLU 500.A N ASP 483.A OD1 no hydrogen 2.947 N/A TYR 501.A N GLU 504.A O no hydrogen 2.975 N/A GLU 504.A N TYR 501.A O no hydrogen 2.908 N/A LYS 505.A N SER 558.A OG no hydrogen 2.940 N/A LYS 505.A NZ GLU 528.A OE1 no hydrogen 2.979 N/A LEU 506.A N ARG 499.A O no hydrogen 2.795 N/A LEU 507.A N GLY 556.A O no hydrogen 2.895 N/A VAL 508.A N TYR 497.A O no hydrogen 2.963 N/A VAL 509.A N VAL 554.A O.A no hydrogen 2.915 N/A VAL 509.A N VAL 554.A O.B no hydrogen 2.935 N/A VAL 510.A N PHE 495.A O no hydrogen 2.926 N/A ASN 511.A N GLU 552.A O no hydrogen 2.826 N/A ASN 511.A ND2 GLU 515.A O no hydrogen 2.826 N/A ASN 511.A ND2 LYS 549.A O no hydrogen 2.943 N/A LEU 512.A N GLN 493.A O no hydrogen 2.872 N/A SER 513.A OG ASN 511.A OD1 no hydrogen 2.755 N/A GLU 515.A N SER 513.A OG no hydrogen 3.293 N/A ALA 517.A N LEU 548.A O no hydrogen 3.005 N/A PHE 519.A N ILE 546.A O no hydrogen 2.901 N/A ALA 521.A N LYS 544.A O no hydrogen 2.863 N/A GLU 524.A N GLU 524.A OE1 no hydrogen 2.655 N/A LEU 525.A N PRO 522.A O no hydrogen 2.928 N/A ILE 526.A N PRO 523.A O no hydrogen 3.413 N/A GLU 528.A N LEU 525.A O no hydrogen 3.318 N/A LYS 531.A N ILE 557.A O no hydrogen 2.870 N/A LYS 531.A NZ TYR 476.A OH no hydrogen 3.111 N/A LEU 533.A N MET 555.A O no hydrogen 2.828 N/A ILE 534.A N MET 555.A O no hydrogen 3.487 N/A SER 535.A OG.A TYR 537.A O no hydrogen 3.001 N/A SER 535.A OG.A GLU 539.A OE1 no hydrogen 2.798 N/A SER 535.A OG.A ALA 553.A O no hydrogen 2.985 N/A SER 535.A OG.B TYR 537.A O no hydrogen 2.887 N/A ASN 536.A N ALA 553.A O no hydrogen 3.264 N/A ASN 536.A ND2 GLU 348.A O no hydrogen 3.011 N/A ASN 536.A ND2 TYR 551.A O no hydrogen 2.807 N/A TYR 537.A N SER 535.A OG.A no hydrogen 3.232 N/A TYR 537.A OH PRO 550.A O no hydrogen 2.661 N/A ARG 540.A N GLU 539.A OE2 no hydrogen 3.485 N/A LYS 544.A NZ ILE 526.A O no hydrogen 3.272 N/A ILE 546.A N PHE 519.A O no hydrogen 2.800 N/A LEU 548.A N ALA 517.A O no hydrogen 2.820 N/A LYS 549.A N GLU 552.A OE1 no hydrogen 2.874 N/A TYR 551.A N SER 513.A O no hydrogen 3.008 N/A GLU 552.A N LYS 549.A O no hydrogen 2.954 N/A ALA 553.A N ASN 536.A OD1 no hydrogen 2.812 N/A VAL 554.A N.A VAL 509.A O no hydrogen 2.952 N/A VAL 554.A N.B VAL 509.A O no hydrogen 2.910 N/A MET 555.A N ILE 534.A O no hydrogen 3.043 N/A GLY 556.A N LEU 507.A O no hydrogen 2.905 N/A ILE 557.A N LYS 531.A O no hydrogen 2.869 N/A SER 558.A N LYS 505.A O no hydrogen 2.901 N/A ILE 559.A N ARG 529.A O no hydrogen 2.929 N/A