Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n20_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ GLU 6.A OE1 no hydrogen 3.303 N/A LYS 4.A NZ ASP 7.A OD2 no hydrogen 3.235 N/A ARG 5.A NH1 GLU 56.A OE1 no hydrogen 2.912 N/A ARG 5.A NH1 GLU 56.A OE2 no hydrogen 3.233 N/A GLU 6.A N GLU 6.A OE2 no hydrogen 3.027 N/A ASP 7.A N LYS 4.A O no hydrogen 2.951 N/A TRP 8.A N ARG 5.A O no hydrogen 3.178 N/A TYR 9.A N ARG 5.A O no hydrogen 2.932 N/A TYR 9.A OH GLU 48.A OE2 no hydrogen 2.775 N/A LEU 11.A N TRP 8.A O no hydrogen 3.103 N/A THR 12.A N TYR 9.A O no hydrogen 2.899 N/A THR 12.A OG1 TYR 9.A O no hydrogen 2.585 N/A ARG 13.A N ASP 10.A O no hydrogen 3.042 N/A ARG 13.A NE ASP 10.A OD1 no hydrogen 3.062 N/A ARG 13.A NH1 ASP 47.A OD1 no hydrogen 2.694 N/A ARG 13.A NH1 GLU 48.A OE1 no hydrogen 2.941 N/A ARG 13.A NH2 ASP 10.A OD1 no hydrogen 2.845 N/A ARG 13.A NH2 ASP 47.A OD1 no hydrogen 2.967 N/A THR 14.A N LEU 11.A O no hydrogen 3.443 N/A THR 14.A OG1 ASP 10.A O no hydrogen 2.632 N/A ASN 16.A ND2 GLU 44.A OE2 no hydrogen 2.858 N/A ASN 16.A ND2 LYS 118.A O no hydrogen 2.912 N/A THR 23.A N GLU 26.A OE1 no hydrogen 2.846 N/A GLU 26.A N THR 23.A O no hydrogen 3.154 N/A GLU 26.A N THR 23.A OG1 no hydrogen 3.218 N/A LEU 27.A N THR 23.A O no hydrogen 2.994 N/A PHE 28.A N GLU 24.A O no hydrogen 2.788 N/A MET 32.A N PRO 29.A O no hydrogen 2.844 N/A SER 33.A N PRO 29.A O no hydrogen 2.814 N/A SER 33.A OG PRO 29.A O no hydrogen 3.451 N/A SER 33.A OG PHE 116.A O no hydrogen 2.847 N/A GLY 34.A N GLU 30.A O no hydrogen 2.891 N/A ARG 36.A N GLU 30.A OE2 no hydrogen 3.045 N/A ARG 36.A NH1 GLY 34.A O no hydrogen 2.793 N/A ARG 36.A NH1 ASP 183.A OD1 no hydrogen 2.971 N/A ARG 36.A NH1 ASP 183.A OD2 no hydrogen 3.329 N/A ARG 36.A NH2 ASP 183.A OD2 no hydrogen 2.931 N/A ILE 38.A N ALA 35.A O no hydrogen 2.972 N/A ALA 42.A N SER 39.A OG no hydrogen 3.067 N/A TRP 43.A N SER 39.A O no hydrogen 3.055 N/A TRP 43.A NE1 ALA 35.A O no hydrogen 3.207 N/A GLU 44.A N MET 40.A O no hydrogen 3.106 N/A GLU 44.A N GLU 41.A O no hydrogen 3.158 N/A LYS 45.A N ALA 42.A O no hydrogen 3.374 N/A TYR 46.A N TRP 43.A O no hydrogen 3.082 N/A TYR 46.A OH GLN 236.A O no hydrogen 2.873 N/A GLU 48.A N GLU 48.A OE1 no hydrogen 2.625 N/A TYR 50.A N GLN 235.A OE1 no hydrogen 2.848 N/A LYS 51.A NZ ASP 47.A OD1 no hydrogen 3.068 N/A LYS 51.A NZ GLU 48.A O no hydrogen 2.863 N/A THR 53.A N GLU 56.A OE1 no hydrogen 3.048 N/A THR 53.A OG1 GLU 56.A OE1 no hydrogen 3.310 N/A TYR 57.A N THR 53.A O no hydrogen 2.915 N/A TYR 57.A OH ASP 132.A OD1 no hydrogen 2.541 N/A VAL 58.A N TYR 54.A O no hydrogen 3.050 N/A SER 59.A N PRO 55.A O no hydrogen 3.298 N/A ILE 60.A N GLU 56.A O no hydrogen 2.988 N/A GLN 61.A N TYR 57.A O no hydrogen 2.865 N/A GLN 61.A NE2 ASP 229.A OD1 no hydrogen 2.837 N/A ARG 62.A N VAL 58.A O no hydrogen 3.147 N/A GLU 63.A N SER 59.A O no hydrogen 3.288 N/A LYS 64.A N ILE 60.A O no hydrogen 3.135 N/A LYS 64.A NZ GLN 61.A OE1 no hydrogen 3.231 N/A LYS 64.A NZ THR 228.A OG1 no hydrogen 2.857 N/A LYS 64.A NZ ASP 229.A OD1 no hydrogen 2.799 N/A ASP 65.A N GLN 61.A O no hydrogen 3.216 N/A SER 66.A N ARG 62.A O no hydrogen 3.016 N/A SER 66.A OG ARG 62.A O no hydrogen 3.125 N/A GLY 67.A N GLU 63.A O no hydrogen 3.079 N/A ALA 68.A N LYS 64.A O no hydrogen 3.101 N/A TYR 69.A N ASP 65.A O no hydrogen 2.805 N/A SER 70.A N SER 66.A O no hydrogen 3.043 N/A SER 70.A OG SER 66.A O no hydrogen 2.693 N/A ILE 71.A N GLY 67.A O no hydrogen 2.949 N/A LYS 72.A N ALA 68.A O no hydrogen 3.054 N/A LYS 72.A NZ GLU 76.A OE2 no hydrogen 3.088 N/A ALA 73.A N TYR 69.A O no hydrogen 3.068 N/A ALA 74.A N SER 70.A O no hydrogen 3.047 N/A LEU 75.A N ILE 71.A O no hydrogen 3.138 N/A GLY 79.A N GLU 76.A O no hydrogen 3.208 N/A ASP 82.A N GLY 79.A O no hydrogen 2.874 N/A ARG 83.A N PHE 80.A O no hydrogen 2.952 N/A ARG 83.A NH1 ASP 78.A O no hydrogen 2.927 N/A ARG 83.A NH2 ASP 78.A OD1 no hydrogen 3.362 N/A ARG 83.A NH2 ASP 78.A OD2 no hydrogen 2.814 N/A GLY 87.A N ASP 85.A OD1 no hydrogen 2.603 N/A TRP 88.A N ASP 85.A O no hydrogen 2.867 N/A TRP 88.A NE1 ASP 216.A OD2 no hydrogen 2.931 N/A VAL 89.A N ASP 85.A O no hydrogen 3.112 N/A SER 90.A N PRO 86.A O no hydrogen 3.043 N/A SER 90.A OG PRO 86.A O no hydrogen 3.078 N/A SER 90.A OG ASP 344.A O no hydrogen 2.584 N/A THR 91.A N GLY 87.A O no hydrogen 3.081 N/A THR 91.A OG1 GLY 87.A O no hydrogen 2.817 N/A MET 92.A N TRP 88.A O no hydrogen 3.092 N/A GLN 93.A N VAL 89.A O no hydrogen 3.016 N/A LEU 94.A N SER 90.A O no hydrogen 2.953 N/A HIS 95.A N THR 91.A O no hydrogen 2.980 N/A HIS 95.A NE2 GLN 140.A OE1 no hydrogen 2.782 N/A PHE 96.A N MET 92.A O no hydrogen 2.856 N/A GLY 97.A N GLN 93.A O no hydrogen 3.187 N/A ALA 98.A N LEU 94.A O no hydrogen 2.941 N/A ILE 99.A N HIS 95.A O no hydrogen 3.076 N/A ALA 100.A N PHE 96.A O no hydrogen 3.081 N/A GLU 103.A N ILE 99.A O no hydrogen 2.666 N/A TYR 104.A N ALA 100.A O no hydrogen 3.281 N/A ALA 105.A N LEU 101.A O no hydrogen 2.935 N/A ALA 106.A N GLU 102.A O no hydrogen 2.940 N/A ALA 106.A N GLU 103.A O no hydrogen 3.033 N/A SER 107.A N TYR 104.A O no hydrogen 3.114 N/A SER 107.A OG TYR 104.A O no hydrogen 2.603 N/A THR 108.A N ALA 105.A O no hydrogen 2.904 N/A ALA 109.A N ALA 105.A O no hydrogen 3.308 N/A GLU 110.A N ALA 106.A O no hydrogen 2.861 N/A ALA 111.A N SER 107.A O no hydrogen 2.847 N/A ARG 112.A N THR 108.A O no hydrogen 2.832 N/A ARG 112.A NH2 MET 180.A O no hydrogen 2.915 N/A ALA 114.A N GLU 110.A O no hydrogen 2.897 N/A ARG 115.A N ALA 111.A O no hydrogen 3.094 N/A ARG 115.A NH1 LEU 27.A O no hydrogen 2.994 N/A ARG 115.A NH1 ARG 115.A O no hydrogen 2.913 N/A ARG 115.A NH2 LEU 27.A O no hydrogen 2.944 N/A PHE 116.A N ARG 112.A O no hydrogen 2.951 N/A ALA 117.A N MET 113.A O no hydrogen 3.010 N/A LYS 118.A NZ GLU 24.A OE2 no hydrogen 2.801 N/A ARG 123.A N ALA 119.A O no hydrogen 3.045 N/A ARG 123.A NH1 ASN 16.A OD1 no hydrogen 3.028 N/A ARG 123.A NH1 ALA 117.A O no hydrogen 2.935 N/A ARG 123.A NH2 ASN 16.A OD1 no hydrogen 2.790 N/A ASN 124.A N PRO 120.A O no hydrogen 3.203 N/A ASN 124.A ND2 THR 12.A O no hydrogen 2.779 N/A MET 125.A N GLY 121.A O no hydrogen 3.101 N/A ALA 126.A N ASN 122.A O no hydrogen 2.916 N/A THR 127.A N ASN 124.A O no hydrogen 2.897 N/A THR 127.A OG1 ARG 123.A O no hydrogen 2.896 N/A PHE 128.A N ASN 124.A O no hydrogen 3.194 N/A GLY 129.A N MET 125.A O no hydrogen 2.842 N/A MET 130.A N ALA 126.A O no hydrogen 2.745 N/A MET 131.A N THR 127.A O no hydrogen 3.140 N/A ASP 132.A N PHE 128.A O no hydrogen 2.854 N/A GLU 133.A N GLY 129.A O no hydrogen 3.085 N/A ASN 134.A N MET 130.A O no hydrogen 3.165 N/A ARG 135.A N MET 131.A O no hydrogen 2.961 N/A ARG 135.A NE ASP 65.A OD1 no hydrogen 2.841 N/A ARG 135.A NH1 SER 225.A O no hydrogen 3.437 N/A ARG 135.A NH1 SER 225.A OG no hydrogen 3.326 N/A ARG 135.A NH1 ASP 229.A OD2 no hydrogen 2.594 N/A ARG 135.A NH2 ASP 65.A OD1 no hydrogen 2.928 N/A ARG 135.A NH2 SER 225.A OG no hydrogen 2.719 N/A HIS 136.A N ASP 132.A O no hydrogen 2.930 N/A HIS 136.A NE2 ASP 229.A OD2 no hydrogen 2.887 N/A GLY 137.A N GLU 133.A O no hydrogen 2.927 N/A GLN 138.A N ASN 134.A O no hydrogen 3.056 N/A ILE 139.A N ARG 135.A O no hydrogen 2.805 N/A GLN 140.A N HIS 136.A O no hydrogen 3.214 N/A GLN 140.A NE2 GLU 103.A OE2 no hydrogen 2.767 N/A GLN 140.A NE2 HIS 136.A O no hydrogen 3.266 N/A LEU 141.A N GLN 138.A O no hydrogen 3.087 N/A TYR 142.A N GLN 138.A O no hydrogen 2.917 N/A PHE 143.A N ILE 139.A O no hydrogen 3.095 N/A TYR 145.A N LEU 141.A O no hydrogen 3.081 N/A ALA 146.A N PHE 143.A O no hydrogen 3.325 N/A ASN 147.A N PRO 144.A O no hydrogen 2.820 N/A VAL 148.A N TYR 145.A O no hydrogen 3.273 N/A ARG 150.A N ASN 147.A O no hydrogen 2.878 N/A ARG 150.A NE ASP 82.A OD1 no hydrogen 2.895 N/A ARG 150.A NE ASP 82.A OD2 no hydrogen 3.125 N/A ARG 150.A NH2 ASP 82.A OD2 no hydrogen 2.840 N/A LYS 153.A N SER 151.A OG no hydrogen 3.095 N/A LYS 153.A NZ GLY 475.A O no hydrogen 2.838 N/A TRP 154.A N SER 151.A O no hydrogen 3.145 N/A ASP 155.A N ARG 152.A O no hydrogen 2.909 N/A TRP 156.A N LYS 153.A O no hydrogen 3.120 N/A ALA 157.A N TRP 154.A O no hydrogen 3.149 N/A HIS 158.A N ASP 155.A O no hydrogen 3.100 N/A LYS 159.A N ASP 155.A O no hydrogen 2.982 N/A ALA 160.A N TRP 156.A O no hydrogen 3.064 N/A HIS 162.A N LYS 159.A O no hydrogen 2.750 N/A THR 163.A N ALA 160.A O no hydrogen 2.874 N/A THR 163.A OG1 ALA 160.A O no hydrogen 2.701 N/A GLU 165.A N THR 163.A OG1 no hydrogen 3.302 N/A TRP 166.A NE1 THR 340.A OG1 no hydrogen 2.904 N/A ALA 168.A N GLU 165.A OE1 no hydrogen 3.072 N/A ILE 169.A N GLU 165.A O no hydrogen 3.113 N/A ALA 170.A N TRP 166.A O no hydrogen 3.030 N/A ALA 171.A N ALA 167.A O no hydrogen 2.970 N/A ARG 172.A N ALA 168.A O no hydrogen 2.958 N/A ARG 172.A NH1 ILE 161.A O no hydrogen 2.807 N/A ARG 172.A NH1 THR 163.A O no hydrogen 2.851 N/A ARG 172.A NH2 THR 163.A O no hydrogen 3.119 N/A SER 173.A N ILE 169.A O no hydrogen 2.795 N/A SER 173.A OG MET 398.A O no hydrogen 3.191 N/A PHE 174.A N ALA 170.A O no hydrogen 3.119 N/A PHE 175.A N ALA 171.A O no hydrogen 2.855 N/A ASP 176.A N ARG 172.A O no hydrogen 2.769 N/A ASP 177.A N SER 173.A O no hydrogen 3.361 N/A MET 178.A N PHE 174.A O no hydrogen 2.929 N/A MET 179.A N PHE 175.A O no hydrogen 2.909 N/A MET 180.A N PHE 175.A O no hydrogen 3.411 N/A THR 181.A OG1 ASP 176.A O no hydrogen 2.724 N/A ARG 182.A NE ASP 177.A O no hydrogen 2.864 N/A ARG 182.A NH2 ASP 177.A OD1 no hydrogen 2.860 N/A SER 184.A N MET 32.A O no hydrogen 2.648 N/A VAL 185.A N SER 33.A O no hydrogen 3.335 N/A ALA 186.A N ASP 183.A OD1 no hydrogen 2.775 N/A VAL 187.A N ASP 183.A O no hydrogen 2.934 N/A SER 188.A N SER 184.A O no hydrogen 3.055 N/A SER 188.A OG VAL 185.A O no hydrogen 2.757 N/A SER 188.A OG SER 240.A OG no hydrogen 2.880 N/A ILE 189.A N VAL 185.A O no hydrogen 3.145 N/A MET 190.A N ALA 186.A O no hydrogen 2.727 N/A LEU 191.A N VAL 187.A O no hydrogen 2.780 N/A THR 192.A OG1 SER 188.A O no hydrogen 2.404 N/A THR 192.A OG1 ALA 234.A O no hydrogen 3.450 N/A PHE 193.A N SER 188.A O no hydrogen 3.176 N/A ALA 194.A N ILE 189.A O no hydrogen 3.006 N/A PHE 195.A N LEU 191.A O no hydrogen 3.229 N/A GLU 196.A N LEU 191.A O no hydrogen 2.845 N/A THR 197.A N THR 192.A O no hydrogen 2.873 N/A THR 197.A OG1 THR 192.A O no hydrogen 2.787 N/A THR 197.A OG1 ALA 234.A O no hydrogen 2.817 N/A GLY 198.A N PHE 193.A O no hydrogen 3.058 N/A PHE 199.A N PHE 195.A O no hydrogen 2.851 N/A VAL 200.A N PHE 195.A O no hydrogen 3.043 N/A ASN 201.A N GLU 196.A O no hydrogen 3.006 N/A GLN 203.A N PHE 199.A O no hydrogen 3.000 N/A PHE 204.A N VAL 200.A O no hydrogen 2.959 N/A GLY 206.A N MET 202.A O no hydrogen 2.987 N/A LEU 207.A N GLN 203.A O no hydrogen 2.781 N/A ALA 208.A N PHE 204.A O no hydrogen 2.975 N/A ALA 209.A N LEU 205.A O no hydrogen 3.270 N/A ASP 210.A N GLY 206.A O no hydrogen 2.859 N/A ALA 211.A N LEU 207.A O no hydrogen 2.860 N/A ALA 212.A N ALA 208.A O no hydrogen 3.131 N/A GLU 213.A N ALA 209.A O no hydrogen 2.934 N/A ALA 214.A N ASP 210.A O no hydrogen 2.886 N/A GLY 215.A N ALA 212.A O no hydrogen 2.910 N/A ASP 216.A N ALA 211.A O no hydrogen 2.862 N/A PHE 219.A N ASP 216.A OD1 no hydrogen 3.033 N/A ALA 220.A N ASP 216.A O no hydrogen 2.995 N/A SER 221.A N HIS 217.A O no hydrogen 2.964 N/A SER 221.A OG HIS 217.A O no hydrogen 2.758 N/A LEU 222.A N THR 218.A O no hydrogen 3.040 N/A ILE 223.A N PHE 219.A O no hydrogen 2.970 N/A SER 224.A N ALA 220.A O no hydrogen 3.001 N/A SER 225.A N SER 221.A O no hydrogen 2.914 N/A ILE 226.A N LEU 222.A O no hydrogen 2.899 N/A GLN 227.A N ILE 223.A O no hydrogen 2.894 N/A THR 228.A N SER 225.A O no hydrogen 3.366 N/A THR 228.A OG1 SER 225.A O no hydrogen 2.720 N/A ASP 229.A N ILE 226.A O no hydrogen 3.006 N/A GLU 230.A N GLN 227.A O no hydrogen 3.275 N/A ARG 232.A N ASP 229.A O no hydrogen 3.213 N/A ARG 232.A NH1 ASP 132.A OD1 no hydrogen 2.749 N/A ARG 232.A NH1 ASP 132.A OD2 no hydrogen 3.287 N/A ARG 232.A NH1 ASP 229.A OD1 no hydrogen 3.343 N/A ARG 232.A NH2 GLN 61.A OE1 no hydrogen 2.879 N/A HIS 233.A N GLU 230.A O no hydrogen 3.076 N/A HIS 233.A ND1 ASP 132.A OD2 no hydrogen 2.872 N/A ALA 234.A N GLU 230.A O no hydrogen 2.739 N/A GLN 235.A N SER 231.A O no hydrogen 3.296 N/A GLN 235.A NE2 TYR 50.A O no hydrogen 2.732 N/A GLN 235.A NE2 ARG 232.A O no hydrogen 2.862 N/A GLN 236.A N HIS 233.A O no hydrogen 3.305 N/A GLN 236.A NE2 ASN 122.A O no hydrogen 3.201 N/A GLN 236.A NE2 ASN 122.A OD1 no hydrogen 2.960 N/A SER 240.A OG SER 188.A OG no hydrogen 2.880 N/A LEU 241.A N GLY 237.A O no hydrogen 3.029 N/A LYS 242.A N GLY 238.A O no hydrogen 3.131 N/A ILE 243.A N PRO 239.A O no hydrogen 3.145 N/A LEU 244.A N SER 240.A O no hydrogen 2.985 N/A VAL 245.A N LEU 241.A O no hydrogen 2.881 N/A GLU 246.A N LYS 242.A O no hydrogen 2.838 N/A ASN 247.A N ILE 243.A O no hydrogen 3.101 N/A LYS 249.A N LEU 244.A O no hydrogen 2.913 N/A LYS 250.A NZ GLY 309.A O no hydrogen 2.482 N/A GLU 252.A N GLU 252.A OE1 no hydrogen 2.527 N/A ALA 253.A N LYS 249.A O no hydrogen 3.115 N/A GLN 254.A N LYS 250.A O no hydrogen 2.892 N/A GLN 254.A NE2 ASP 258.A OD1 no hydrogen 2.837 N/A GLN 254.A NE2 ASP 311.A O no hydrogen 2.823 N/A GLN 255.A N ASP 251.A O no hydrogen 2.984 N/A MET 256.A N GLU 252.A O no hydrogen 3.215 N/A VAL 257.A N ALA 253.A O no hydrogen 3.118 N/A ASP 258.A N GLN 254.A O no hydrogen 2.823 N/A VAL 259.A N GLN 255.A O no hydrogen 3.053 N/A ALA 260.A N MET 256.A O no hydrogen 2.935 N/A ILE 261.A N VAL 257.A O no hydrogen 2.922 N/A TRP 262.A N ASP 258.A O no hydrogen 3.303 N/A TRP 262.A NE1 ASP 432.A OD2 no hydrogen 3.144 N/A ARG 263.A N VAL 259.A O no hydrogen 3.041 N/A ARG 263.A NH1 SER 173.A O no hydrogen 3.181 N/A ARG 263.A NH1 ASP 177.A OD2 no hydrogen 2.791 N/A ARG 263.A NH2 SER 173.A OG no hydrogen 2.914 N/A SER 264.A N ALA 260.A O no hydrogen 2.991 N/A SER 264.A OG ALA 260.A O no hydrogen 2.669 N/A TRP 265.A N ILE 261.A O no hydrogen 2.923 N/A LYS 266.A N TRP 262.A O no hydrogen 3.016 N/A LYS 266.A NZ ASP 432.A OD2 no hydrogen 2.841 N/A LEU 267.A N ARG 263.A O no hydrogen 3.290 N/A PHE 268.A N SER 264.A O no hydrogen 2.952 N/A SER 269.A N TRP 265.A O no hydrogen 2.758 N/A SER 269.A OG LYS 266.A O no hydrogen 2.579 N/A VAL 270.A N LEU 267.A O no hydrogen 3.272 N/A LEU 271.A N LEU 267.A O no hydrogen 2.974 N/A THR 272.A N PHE 268.A O no hydrogen 2.951 N/A GLY 273.A N PHE 268.A O no hydrogen 3.211 N/A MET 276.A N THR 272.A O no hydrogen 3.119 N/A ASP 277.A N GLY 273.A O no hydrogen 3.179 N/A TYR 278.A OH HIS 328.A ND1 no hydrogen 2.753 N/A TYR 279.A N PRO 274.A O no hydrogen 3.361 N/A THR 280.A N ILE 275.A O no hydrogen 3.041 N/A THR 280.A OG1 ILE 275.A O no hydrogen 2.991 N/A GLU 283.A N GLU 283.A OE1 no hydrogen 2.568 N/A SER 284.A N PRO 281.A O no hydrogen 2.792 N/A SER 284.A OG GLU 213.A OE2 no hydrogen 2.859 N/A ARG 285.A N LEU 282.A O no hydrogen 3.161 N/A ARG 285.A NE THR 280.A O no hydrogen 2.634 N/A ARG 285.A NH2 THR 280.A O no hydrogen 2.851 N/A SER 288.A N GLU 291.A OE1 no hydrogen 2.982 N/A PHE 289.A N ASP 277.A OD1 no hydrogen 2.876 N/A LYS 290.A N TYR 361.A OH no hydrogen 3.177 N/A LYS 290.A NZ ASP 324.A OD1 no hydrogen 2.913 N/A GLU 291.A N SER 288.A OG no hydrogen 3.155 N/A PHE 292.A N SER 288.A O no hydrogen 2.793 N/A MET 293.A N PHE 289.A O no hydrogen 2.931 N/A LEU 294.A N LYS 290.A O no hydrogen 2.979 N/A GLU 295.A N GLU 291.A O no hydrogen 2.977 N/A TRP 296.A N PHE 292.A O no hydrogen 2.806 N/A ILE 297.A N MET 293.A O no hydrogen 3.066 N/A VAL 298.A N MET 293.A O no hydrogen 2.743 N/A GLN 300.A N GLN 300.A OE1 no hydrogen 2.534 N/A GLN 300.A NE2 GLU 295.A O no hydrogen 2.976 N/A PHE 301.A N ILE 297.A O no hydrogen 3.160 N/A GLU 302.A N VAL 298.A O no hydrogen 3.104 N/A ARG 303.A N ALA 299.A O no hydrogen 2.980 N/A GLN 304.A N GLN 300.A O no hydrogen 2.940 N/A LEU 305.A N PHE 301.A O no hydrogen 2.806 N/A LEU 306.A N GLU 302.A O no hydrogen 3.015 N/A ASP 307.A N ARG 303.A O no hydrogen 3.039 N/A LEU 308.A N GLN 304.A O no hydrogen 3.095 N/A LEU 308.A N LEU 305.A O no hydrogen 3.216 N/A GLY 309.A N LEU 306.A O no hydrogen 3.188 N/A LEU 310.A N LEU 305.A O no hydrogen 2.806 N/A ASP 311.A N GLN 254.A OE1 no hydrogen 2.736 N/A TYR 315.A OH ASP 258.A O no hydrogen 2.650 N/A TRP 316.A N PRO 313.A O no hydrogen 3.026 N/A TRP 316.A NE1 GLU 302.A OE2 no hydrogen 2.964 N/A GLN 318.A NE2 GLN 318.A O no hydrogen 3.365 N/A GLN 318.A NE2 ASP 322.A OD1 no hydrogen 2.825 N/A PHE 319.A N TYR 315.A O no hydrogen 2.911 N/A MET 320.A N TRP 316.A O no hydrogen 2.957 N/A GLN 321.A N ASP 317.A O no hydrogen 3.012 N/A ASP 322.A N GLN 318.A O no hydrogen 2.842 N/A LEU 323.A N MET 320.A O no hydrogen 3.340 N/A ASP 324.A N GLN 321.A O no hydrogen 3.095 N/A GLU 325.A N ASP 322.A O no hydrogen 2.860 N/A THR 326.A N ASP 322.A O no hydrogen 3.056 N/A THR 326.A OG1 ASP 322.A O no hydrogen 3.526 N/A HIS 327.A NE2 ASP 277.A OD2 no hydrogen 2.744 N/A HIS 328.A N GLU 325.A O no hydrogen 2.875 N/A HIS 328.A ND1 TYR 278.A OH no hydrogen 2.753 N/A GLY 329.A N GLU 325.A O no hydrogen 3.324 N/A MET 330.A N THR 326.A O no hydrogen 2.936 N/A HIS 331.A N HIS 327.A O no hydrogen 2.842 N/A HIS 331.A NE2 ALA 347.A O no hydrogen 2.907 N/A LEU 332.A N HIS 328.A O no hydrogen 3.045 N/A GLY 333.A N GLY 329.A O no hydrogen 2.858 N/A VAL 334.A N MET 330.A O no hydrogen 2.927 N/A TRP 335.A N HIS 331.A O no hydrogen 2.849 N/A TRP 335.A NE1 ASP 480.A OD1 no hydrogen 2.817 N/A TYR 336.A N LEU 332.A O no hydrogen 2.808 N/A TYR 336.A OH LEU 386.A O no hydrogen 2.659 N/A TYR 336.A OH VAL 388.A O no hydrogen 3.375 N/A TRP 337.A N GLY 333.A O no hydrogen 2.931 N/A TRP 337.A NE1 THR 391.A O no hydrogen 3.017 N/A ARG 338.A N TRP 335.A O no hydrogen 3.016 N/A ARG 338.A NE ASP 479.A OD1 no hydrogen 3.202 N/A ARG 338.A NE TYR 484.A OH no hydrogen 3.280 N/A ARG 338.A NH1 THR 387.A OG1 no hydrogen 3.072 N/A ARG 338.A NH1 TYR 484.A OH no hydrogen 2.804 N/A ARG 338.A NH2 TRP 335.A O no hydrogen 2.942 N/A ARG 338.A NH2 THR 387.A O no hydrogen 2.904 N/A THR 340.A N TRP 337.A O no hydrogen 2.849 N/A THR 340.A OG1 TRP 337.A O no hydrogen 2.581 N/A VAL 341.A N ARG 338.A O no hydrogen 3.296 N/A TRP 342.A NE1 GLN 93.A O no hydrogen 2.792 N/A TRP 343.A NE1 TYR 279.A OH no hydrogen 3.054 N/A SER 350.A N GLU 353.A OE1 no hydrogen 3.011 N/A SER 350.A OG GLU 353.A OE1 no hydrogen 2.905 N/A GLU 352.A N GLU 352.A OE1 no hydrogen 2.674 N/A GLU 353.A N SER 350.A OG no hydrogen 3.306 N/A ARG 354.A N SER 350.A O no hydrogen 2.758 N/A ARG 354.A NE ASN 365.A OD1 no hydrogen 2.869 N/A ARG 354.A NH1 ASP 373.A OD1 no hydrogen 2.867 N/A ARG 354.A NH2 ASN 365.A OD1 no hydrogen 2.719 N/A ARG 354.A NH2 GLY 369.A O no hydrogen 3.384 N/A ARG 354.A NH2 ASP 373.A OD1 no hydrogen 2.957 N/A GLU 355.A N PRO 351.A O no hydrogen 3.080 N/A GLU 355.A N GLU 352.A O no hydrogen 3.160 N/A TRP 356.A N GLU 352.A O no hydrogen 3.127 N/A LEU 357.A N GLU 353.A O no hydrogen 2.957 N/A GLU 358.A N ARG 354.A O no hydrogen 3.056 N/A GLU 359.A N GLU 355.A O no hydrogen 3.020 N/A LYS 360.A N TRP 356.A O no hydrogen 2.773 N/A LYS 360.A NZ GLU 291.A OE1 no hydrogen 2.830 N/A LYS 360.A NZ GLU 291.A OE2 no hydrogen 3.289 N/A TYR 361.A N LEU 357.A O no hydrogen 2.639 N/A TYR 361.A OH ASP 277.A OD2 no hydrogen 2.528 N/A GLY 363.A N GLU 358.A OE2 no hydrogen 2.765 N/A TRP 364.A N TYR 361.A O no hydrogen 2.969 N/A TRP 364.A NE1 TYR 278.A OH no hydrogen 3.122 N/A ASN 365.A N GLU 358.A OE1 no hydrogen 2.860 N/A ASN 365.A ND2 ARG 354.A O no hydrogen 3.285 N/A ASN 365.A ND2 GLU 358.A OE1 no hydrogen 2.664 N/A THR 367.A N TRP 364.A O no hydrogen 3.074 N/A THR 367.A OG1 GLY 363.A O no hydrogen 2.918 N/A THR 367.A OG1 TRP 364.A O no hydrogen 3.093 N/A TRP 368.A N THR 367.A OG1 no hydrogen 2.609 N/A TRP 368.A NE1 GLU 325.A OE1 no hydrogen 2.960 N/A GLY 369.A N TRP 364.A O no hydrogen 2.734 N/A GLN 370.A N THR 367.A O no hydrogen 3.019 N/A CYS 371.A N TRP 368.A O no hydrogen 3.242 N/A TRP 372.A N TRP 368.A O no hydrogen 3.407 N/A ASP 373.A N GLY 369.A O no hydrogen 2.726 N/A VAL 374.A N GLN 370.A O no hydrogen 3.222 N/A ILE 375.A N CYS 371.A O no hydrogen 3.109 N/A THR 376.A N TRP 372.A O no hydrogen 2.865 N/A THR 376.A OG1 TRP 372.A O no hydrogen 2.709 N/A ASP 377.A N ASP 373.A O no hydrogen 2.929 N/A ASN 378.A N VAL 374.A O no hydrogen 3.126 N/A LEU 379.A N ILE 375.A O no hydrogen 3.135 N/A VAL 380.A N THR 376.A O no hydrogen 2.836 N/A ASN 381.A N ASP 377.A O no hydrogen 2.712 N/A GLY 382.A N LEU 379.A O no hydrogen 3.324 N/A LYS 383.A N ASN 378.A O no hydrogen 2.602 N/A GLU 385.A N GLU 385.A OE1 no hydrogen 2.806 N/A LEU 386.A N LYS 383.A O no hydrogen 3.053 N/A THR 387.A N PRO 384.A O no hydrogen 2.860 N/A THR 387.A OG1 PRO 384.A O no hydrogen 2.553 N/A CYS 396.A N LEU 401.A O no hydrogen 2.878 N/A ASN 397.A N HIS 426.A O no hydrogen 2.775 N/A ASN 397.A ND2 HIS 426.A O no hydrogen 3.314 N/A ASN 400.A N CYS 396.A O no hydrogen 2.883 N/A ASN 400.A ND2 MET 398.A O no hydrogen 3.192 N/A ILE 403.A N THR 394.A O no hydrogen 2.885 N/A THR 406.A OG1 GLU 325.A OE1 no hydrogen 2.689 N/A ASN 409.A N ASP 366.A O no hydrogen 2.897 N/A ASN 409.A ND2 ASP 366.A O no hydrogen 3.240 N/A ASN 412.A N THR 406.A O no hydrogen 2.762 N/A TYR 416.A N PHE 427.A O no hydrogen 2.983 N/A GLN 417.A NE2 HIS 426.A NE2 no hydrogen 3.383 N/A LEU 418.A N TYR 425.A O no hydrogen 2.934 N/A TYR 420.A N ARG 423.A O no hydrogen 2.880 N/A TYR 420.A OH GLU 441.A OE2 no hydrogen 3.230 N/A ARG 423.A N TYR 420.A O no hydrogen 3.164 N/A ARG 423.A NH1 HIS 446.A O no hydrogen 3.259 N/A ARG 423.A NH2 HIS 446.A O no hydrogen 2.946 N/A TYR 425.A N LEU 418.A O no hydrogen 2.744 N/A TYR 425.A OH GLU 444.A O no hydrogen 2.736 N/A PHE 427.A N ASP 415.A OD1 no hydrogen 3.247 N/A SER 429.A OG ASP 432.A OD2 no hydrogen 2.603 N/A ASP 432.A N SER 429.A OG no hydrogen 2.997 N/A ARG 433.A N SER 429.A O no hydrogen 3.191 N/A ARG 433.A NH1 GLN 417.A O no hydrogen 2.861 N/A ARG 433.A NH2 GLU 430.A OE2 no hydrogen 2.997 N/A TRP 434.A N GLU 430.A O no hydrogen 3.037 N/A CYS 435.A N ALA 431.A O no hydrogen 3.005 N/A CYS 435.A SG ALA 431.A O no hydrogen 3.335 N/A PHE 436.A N ARG 433.A O no hydrogen 3.101 N/A GLN 437.A N ARG 433.A O no hydrogen 2.979 N/A ILE 438.A N TRP 434.A O no hydrogen 2.968 N/A ASP 439.A N PHE 436.A O no hydrogen 3.107 N/A ARG 442.A N ASP 439.A O no hydrogen 3.078 N/A ARG 442.A NE ASP 439.A OD2 no hydrogen 3.288 N/A ARG 442.A NH1 ASP 177.A OD1 no hydrogen 3.046 N/A ARG 442.A NH1 THR 181.A OG1 no hydrogen 2.858 N/A ARG 442.A NH2 THR 181.A O no hydrogen 3.006 N/A TYR 443.A N PRO 440.A O no hydrogen 3.121 N/A TYR 443.A OH ASP 177.A OD2 no hydrogen 2.755 N/A GLU 444.A N PRO 440.A O no hydrogen 2.687 N/A HIS 446.A N TYR 443.A O no hydrogen 3.047 N/A ASN 448.A N ASP 451.A OD2 no hydrogen 2.942 N/A ASP 451.A N ASN 448.A OD1 no hydrogen 2.700 N/A ARG 452.A N ASN 448.A O no hydrogen 3.013 N/A ARG 452.A NE THR 447.A O no hydrogen 3.045 N/A ARG 452.A NE THR 447.A OG1 no hydrogen 3.074 N/A ARG 452.A NH1 ASN 164.A OD1 no hydrogen 3.550 N/A ARG 452.A NH1 TYR 469.A OH no hydrogen 3.183 N/A ARG 452.A NH2 THR 447.A O no hydrogen 3.040 N/A PHE 453.A N LEU 449.A O no hydrogen 2.955 N/A LEU 454.A N VAL 450.A O no hydrogen 2.888 N/A LYS 455.A N ASP 451.A O no hydrogen 2.927 N/A LYS 455.A N ARG 452.A O no hydrogen 3.135 N/A LYS 455.A NZ GLU 457.A OE2 no hydrogen 2.777 N/A GLY 456.A N PHE 453.A O no hydrogen 3.289 N/A GLU 457.A N ARG 452.A O no hydrogen 3.076 N/A GLN 459.A NE2 GLY 456.A O no hydrogen 3.016 N/A GLY 465.A N ASP 462.A OD1 no hydrogen 2.665 N/A ALA 466.A N ASP 462.A O no hydrogen 2.875 N/A LEU 467.A N LEU 463.A O no hydrogen 3.010 N/A MET 468.A N ALA 464.A O no hydrogen 3.174 N/A TYR 469.A N GLY 465.A O no hydrogen 2.905 N/A MET 470.A N ALA 466.A O no hydrogen 2.979 N/A SER 471.A N MET 468.A O no hydrogen 2.805 N/A LEU 472.A N LEU 467.A O no hydrogen 2.834 N/A VAL 476.A N GLU 473.A O no hydrogen 3.130 N/A MET 477.A N GLU 473.A O no hydrogen 3.221 N/A GLY 478.A N VAL 341.A O no hydrogen 2.992 N/A ASP 479.A N ASP 344.A OD1 no hydrogen 3.022 N/A ASP 480.A N ASP 479.A OD1 no hydrogen 2.775 N/A ALA 481.A N PRO 345.A O no hydrogen 2.828 N/A HIS 482.A NE2 ASP 85.A OD1 no hydrogen 3.091 N/A ASP 483.A N ASP 480.A O no hydrogen 3.084 N/A TYR 484.A N ASP 480.A OD2 no hydrogen 2.789 N/A TYR 484.A OH ASP 479.A OD1 no hydrogen 2.639 N/A GLU 485.A N HIS 482.A O no hydrogen 2.944 N/A TRP 486.A NE1 ASP 480.A OD1 no hydrogen 3.127 N/A TRP 486.A NE1 ASP 480.A OD2 no hydrogen 3.140 N/A VAL 487.A N TYR 484.A O no hydrogen 2.904 N/A LYS 488.A N GLU 485.A O no hydrogen 3.221 N/A LYS 488.A NZ GLU 485.A OE1 no hydrogen 3.483 N/A LYS 488.A NZ GLU 485.A OE2 no hydrogen 3.137 N/A ALA 489.A N TRP 486.A O no hydrogen 3.366 N/A TYR 490.A N VAL 487.A O no hydrogen 2.870 N/A TYR 490.A OH VAL 349.A O no hydrogen 2.874 N/A GLN 491.A N LYS 488.A O no hydrogen 2.944 N/A