Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mj4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N GLU 1.A OE2 no hydrogen 2.717 N/A GLU 1.A N SER 416.A O no hydrogen 3.379 N/A HIS 4.A N ALA 418.A O no hydrogen 2.832 N/A HIS 4.A ND1 ALA 2.A O no hydrogen 2.694 N/A LEU 5.A N SER 369.A O no hydrogen 2.887 N/A VAL 6.A N THR 420.A O no hydrogen 2.863 N/A GLN 7.A N GLU 367.A O no hydrogen 2.785 N/A VAL 8.A N ARG 422.A O no hydrogen 2.895 N/A ASP 9.A N TRP 365.A O no hydrogen 2.965 N/A ALA 10.A N ARG 424.A O no hydrogen 2.751 N/A ALA 11.A N ASP 9.A OD1 no hydrogen 3.172 N/A ARG 12.A N ASP 9.A O no hydrogen 3.100 N/A LEU 14.A N GLN 363.A O no hydrogen 2.812 N/A TRP 15.A NE1 GLN 363.A OE1 no hydrogen 2.765 N/A LEU 17.A N GLU 361.A O no hydrogen 2.642 N/A ARG 19.A NH1 HIS 49.A O no hydrogen 2.870 N/A ARG 19.A NH2 HIS 49.A O no hydrogen 3.077 N/A ARG 22.A NE ARG 19.A O no hydrogen 3.184 N/A ARG 22.A NH1 ARG 50.A O no hydrogen 3.082 N/A SER 23.A N TRP 21.A O no hydrogen 2.805 N/A SER 23.A OG THR 24.A O no hydrogen 3.418 N/A SER 23.A OG SER 310.A OG no hydrogen 2.727 N/A THR 24.A N GLN 54.A O no hydrogen 2.842 N/A THR 24.A OG1 ASN 311.A O no hydrogen 3.269 N/A THR 24.A OG1 ASN 313.A OD1 no hydrogen 2.816 N/A PHE 26.A N ARG 56.A O no hydrogen 2.965 N/A CYS 27.A SG PRO 28.A O no hydrogen 3.565 N/A LEU 33.A N PRO 30.A O no hydrogen 3.219 N/A SER 34.A N TYR 31.A O no hydrogen 3.420 N/A SER 34.A OG TYR 31.A O no hydrogen 2.744 N/A GLN 37.A N SER 34.A OG no hydrogen 3.389 N/A GLN 37.A NE2 ASN 40.A OD1 no hydrogen 3.597 N/A GLN 38.A N SER 34.A O no hydrogen 3.005 N/A GLN 38.A NE2 LEU 33.A O no hydrogen 3.147 N/A LEU 39.A N TRP 35.A O no hydrogen 2.979 N/A ASN 40.A N ASP 36.A O no hydrogen 2.869 N/A LEU 41.A N GLN 37.A O no hydrogen 3.007 N/A ALA 42.A N GLN 38.A O no hydrogen 3.300 N/A TYR 43.A N LEU 39.A O no hydrogen 3.025 N/A VAL 44.A N ASN 40.A O no hydrogen 2.954 N/A GLY 45.A N LEU 41.A O no hydrogen 2.875 N/A ALA 46.A N TYR 43.A O no hydrogen 3.133 N/A HIS 49.A N ASP 533.A OD2 no hydrogen 2.767 N/A GLY 51.A N PRO 48.A O no hydrogen 3.100 N/A LYS 53.A N ARG 22.A O no hydrogen 2.731 N/A GLN 54.A N ARG 22.A O no hydrogen 3.119 N/A GLN 54.A NE2 SER 23.A OG no hydrogen 2.728 N/A VAL 55.A N LEU 90.A O no hydrogen 2.733 N/A ARG 56.A N THR 24.A O no hydrogen 2.796 N/A ARG 56.A NE GLU 141.A OE2 no hydrogen 2.927 N/A ARG 56.A NH1 ASN 144.A OD1 no hydrogen 3.476 N/A ARG 56.A NH1 GLU 262.A OE2 no hydrogen 2.767 N/A ARG 56.A NH2 GLU 141.A OE1 no hydrogen 3.444 N/A ARG 56.A NH2 ASN 144.A OD1 no hydrogen 2.866 N/A THR 57.A N GLY 92.A O no hydrogen 3.324 N/A THR 57.A OG1 VAL 55.A O no hydrogen 3.090 N/A THR 57.A OG1 TYR 80.A OH no hydrogen 2.656 N/A HIS 58.A N PHE 26.A O no hydrogen 3.246 N/A LEU 61.A N MET 96.A O no hydrogen 2.956 N/A GLU 62.A N TRP 59.A O no hydrogen 3.040 N/A LEU 63.A N LEU 60.A O no hydrogen 3.231 N/A THR 65.A N ASN 73.A O no hydrogen 3.253 N/A THR 66.A OG1 ALA 99.A O no hydrogen 2.870 N/A ARG 67.A N SER 71.A O no hydrogen 2.888 N/A SER 71.A N ARG 67.A O no hydrogen 3.120 N/A ASN 73.A N THR 65.A O no hydrogen 2.854 N/A THR 75.A N ASN 73.A OD1 no hydrogen 3.062 N/A THR 75.A OG1 ASN 73.A OD1 no hydrogen 2.813 N/A ASP 78.A N PHE 74.A O no hydrogen 2.711 N/A GLY 79.A N THR 75.A O no hydrogen 3.013 N/A TYR 80.A N HIS 76.A O no hydrogen 3.230 N/A TYR 80.A OH THR 57.A OG1 no hydrogen 2.656 N/A LEU 81.A N LEU 77.A O no hydrogen 2.990 N/A ASP 82.A N ASP 78.A O no hydrogen 2.813 N/A LEU 83.A N GLY 79.A O no hydrogen 3.005 N/A LEU 84.A N TYR 80.A O no hydrogen 2.972 N/A ARG 85.A N LEU 81.A O no hydrogen 2.940 N/A GLU 86.A N ASP 82.A O no hydrogen 2.895 N/A ASN 87.A N LEU 83.A O no hydrogen 3.339 N/A ASN 87.A ND2 LEU 83.A O no hydrogen 2.824 N/A GLN 88.A N ARG 85.A O no hydrogen 2.953 N/A GLN 88.A NE2 GLU 534.A OE2 no hydrogen 3.004 N/A LEU 89.A N LEU 84.A O no hydrogen 2.853 N/A LEU 90.A N LYS 53.A O no hydrogen 2.729 N/A GLY 92.A N VAL 55.A O no hydrogen 2.798 N/A PHE 93.A N ASN 139.A O no hydrogen 2.887 N/A GLU 94.A N GLY 92.A O no hydrogen 2.907 N/A LEU 95.A N GLU 141.A O no hydrogen 2.741 N/A SER 98.A N GLU 62.A OE2 no hydrogen 2.759 N/A SER 98.A OG GLU 62.A OE2 no hydrogen 2.790 N/A SER 100.A OG VAL 64.A O no hydrogen 2.688 N/A GLY 101.A N SER 98.A OG no hydrogen 2.923 N/A HIS 102.A NE2 GLU 114.A OE1 no hydrogen 3.184 N/A PHE 103.A N SER 98.A O no hydrogen 3.009 N/A THR 104.A N GLN 111.A OE1 no hydrogen 2.887 N/A THR 104.A OG1 GLN 111.A OE1 no hydrogen 3.425 N/A ASP 105.A N GLN 111.A OE1 no hydrogen 2.921 N/A GLU 107.A N ASP 105.A OD1 no hydrogen 3.173 N/A GLN 110.A N ASP 108.A OD1 no hydrogen 3.312 N/A GLN 111.A NE2 THR 104.A OG1 no hydrogen 3.209 N/A GLN 111.A NE2 ASP 108.A OD2 no hydrogen 3.130 N/A VAL 112.A N ASP 108.A O no hydrogen 3.129 N/A PHE 113.A N LYS 109.A O no hydrogen 3.169 N/A GLU 114.A N GLN 110.A O no hydrogen 2.988 N/A TRP 115.A N GLN 111.A O no hydrogen 2.755 N/A LYS 116.A N VAL 112.A O no hydrogen 3.276 N/A ASP 117.A N PHE 113.A O no hydrogen 3.245 N/A LEU 118.A N GLU 114.A O no hydrogen 2.963 N/A VAL 119.A N TRP 115.A O no hydrogen 2.936 N/A SER 120.A N LYS 116.A O no hydrogen 3.017 N/A SER 120.A OG LYS 116.A O no hydrogen 3.323 N/A SER 120.A OG ASP 117.A O no hydrogen 2.821 N/A SER 121.A N ASP 117.A O no hydrogen 2.960 N/A SER 121.A OG ASP 117.A O no hydrogen 3.099 N/A SER 121.A OG LEU 118.A O no hydrogen 2.828 N/A LEU 122.A N LEU 118.A O no hydrogen 2.916 N/A ALA 123.A N VAL 119.A O no hydrogen 3.039 N/A ARG 124.A N SER 120.A O no hydrogen 2.956 N/A ARG 125.A N SER 121.A O no hydrogen 3.049 N/A ARG 125.A NE ASP 78.A OD1 no hydrogen 3.005 N/A ARG 125.A NH2 ASP 78.A OD2 no hydrogen 2.738 N/A TYR 126.A N LEU 122.A O no hydrogen 3.134 N/A TYR 126.A OH ASP 78.A OD1 no hydrogen 2.846 N/A ILE 127.A N ALA 123.A O no hydrogen 2.870 N/A GLY 128.A N ARG 124.A O no hydrogen 2.967 N/A ARG 129.A N ARG 125.A O no hydrogen 2.820 N/A ARG 129.A NH1 ASP 82.A OD1 no hydrogen 3.287 N/A TYR 130.A N TYR 126.A O no hydrogen 2.816 N/A TYR 130.A OH ASP 82.A OD1 no hydrogen 2.634 N/A GLY 131.A N ILE 127.A O no hydrogen 2.686 N/A VAL 135.A N GLY 131.A O no hydrogen 3.244 N/A SER 136.A N LEU 132.A O no hydrogen 2.839 N/A SER 136.A OG LEU 132.A O no hydrogen 2.852 N/A LYS 137.A N HIS 134.A O no hydrogen 3.111 N/A TRP 138.A N VAL 135.A O no hydrogen 3.105 N/A ASN 139.A ND2 GLN 54.A OE1 no hydrogen 2.724 N/A PHE 140.A N ARG 180.A O no hydrogen 3.074 N/A GLU 141.A N PHE 93.A O no hydrogen 2.897 N/A THR 142.A N GLY 182.A O no hydrogen 3.095 N/A THR 142.A OG1 TRP 143.A O no hydrogen 3.550 N/A THR 142.A OG1 PRO 184.A O no hydrogen 3.029 N/A TRP 143.A N TYR 164.A OH no hydrogen 2.762 N/A TRP 143.A NE1 ASP 150.A O no hydrogen 3.069 N/A GLU 145.A N GLY 185.A O no hydrogen 2.979 N/A ASP 147.A N ASP 186.A OD2 no hydrogen 2.858 N/A HIS 148.A N GLU 145.A O no hydrogen 3.029 N/A SER 155.A N THR 104.A O no hydrogen 2.554 N/A THR 157.A OG1 GLU 107.A OE1 no hydrogen 2.742 N/A GLN 159.A NE2 GLN 159.A O no hydrogen 3.209 N/A GLN 159.A NE2 ASN 163.A OD1 no hydrogen 2.918 N/A GLY 160.A N THR 157.A OG1 no hydrogen 3.150 N/A PHE 161.A N THR 157.A O no hydrogen 3.009 N/A LEU 162.A N MET 158.A O no hydrogen 3.280 N/A ASN 163.A N GLN 159.A O no hydrogen 3.027 N/A ASN 163.A ND2 PHE 106.A O no hydrogen 2.967 N/A TYR 164.A N GLY 160.A O no hydrogen 2.822 N/A TYR 164.A OH LEU 95.A O no hydrogen 2.592 N/A TYR 165.A N PHE 161.A O no hydrogen 2.947 N/A TYR 165.A OH ARG 218.A O no hydrogen 2.565 N/A ASP 166.A N LEU 162.A O no hydrogen 3.066 N/A ALA 167.A N ASN 163.A O no hydrogen 2.998 N/A CYS 168.A N TYR 164.A O no hydrogen 2.935 N/A CYS 168.A SG TYR 164.A O no hydrogen 3.404 N/A SER 169.A N TYR 165.A O no hydrogen 2.783 N/A GLU 170.A N ASP 166.A O no hydrogen 2.803 N/A GLY 171.A N ALA 167.A O no hydrogen 2.897 N/A LEU 172.A N CYS 168.A O no hydrogen 3.020 N/A ARG 173.A N SER 169.A O no hydrogen 2.983 N/A ALA 174.A N GLU 170.A O no hydrogen 2.951 N/A ALA 175.A N GLY 171.A O no hydrogen 3.402 N/A SER 176.A N LEU 172.A O no hydrogen 2.882 N/A ALA 178.A N SER 176.A OG no hydrogen 3.205 N/A LEU 179.A N SER 176.A O no hydrogen 3.272 N/A ARG 180.A NE.C ASN 139.A OD1 no hydrogen 2.792 N/A ARG 180.A NH1.A TRP 138.A O no hydrogen 3.548 N/A ARG 180.A NH2.A ASN 139.A OD1 no hydrogen 2.697 N/A ARG 180.A NH2.C ASN 139.A OD1 no hydrogen 2.937 N/A LEU 181.A N ASP 220.A OD2 no hydrogen 2.998 N/A GLY 182.A N PHE 140.A O no hydrogen 3.052 N/A GLY 183.A N TYR 221.A O no hydrogen 3.308 N/A GLY 185.A N SER 223.A O no hydrogen 2.878 N/A SER 187.A N ASP 186.A OD1 no hydrogen 2.608 N/A SER 187.A OG HIS 225.A O no hydrogen 3.223 N/A HIS 189.A N SER 194.A OG no hydrogen 2.903 N/A ARG 193.A N THR 190.A O no hydrogen 3.068 N/A ARG 193.A NH1 THR 190.A O no hydrogen 3.208 N/A LEU 196.A N ASP 147.A OD1 no hydrogen 2.952 N/A SER 197.A OG ASP 147.A OD2 no hydrogen 2.624 N/A TRP 198.A N SER 194.A O no hydrogen 3.143 N/A TRP 198.A NE1 HIS 189.A O no hydrogen 2.842 N/A GLY 199.A N PRO 195.A O no hydrogen 2.803 N/A LEU 200.A N LEU 196.A O no hydrogen 3.270 N/A LEU 200.A N SER 197.A O no hydrogen 3.183 N/A LEU 201.A N SER 197.A O no hydrogen 3.421 N/A ARG 202.A N TRP 198.A O no hydrogen 3.064 N/A HIS 203.A N GLY 199.A O no hydrogen 3.023 N/A HIS 203.A NE2 ASP 166.A OD1 no hydrogen 2.761 N/A CYS 204.A N LEU 200.A O no hydrogen 2.847 N/A CYS 204.A SG LEU 200.A O no hydrogen 3.367 N/A CYS 204.A SG ARG 218.A O no hydrogen 3.919 N/A HIS 205.A N LEU 201.A O no hydrogen 2.869 N/A HIS 205.A ND1 ASP 206.A OD1 no hydrogen 2.788 N/A HIS 205.A ND1 ASP 206.A OD2 no hydrogen 3.205 N/A ASP 206.A N ARG 202.A O no hydrogen 2.744 N/A GLY 207.A N HIS 203.A O no hydrogen 2.719 N/A ASN 209.A N GLU 214.A O no hydrogen 2.864 N/A PHE 210.A N ASP 166.A OD2 no hydrogen 2.737 N/A PHE 211.A N ASN 209.A OD1 no hydrogen 2.960 N/A THR 212.A OG1 GLU 214.A OE2 no hydrogen 2.990 N/A GLY 213.A N ASN 209.A O no hydrogen 2.860 N/A GLY 216.A N GLY 207.A O no hydrogen 2.623 N/A VAL 217.A N CYS 204.A O no hydrogen 2.971 N/A ARG 218.A NE SER 169.A OG no hydrogen 2.710 N/A ARG 218.A NH1 LEU 179.A O no hydrogen 2.953 N/A ARG 218.A NH1 ASP 220.A OD2 no hydrogen 2.973 N/A ARG 218.A NH2 SER 169.A O no hydrogen 2.819 N/A ASP 220.A N LEU 181.A O no hydrogen 2.821 N/A TYR 221.A OH PHE 140.A O no hydrogen 2.870 N/A ILE 222.A N PRO 257.A O no hydrogen 2.746 N/A SER 223.A N GLY 183.A O no hydrogen 2.908 N/A SER 223.A OG GLU 141.A OE1 no hydrogen 2.755 N/A LEU 224.A N TYR 259.A O no hydrogen 2.759 N/A HIS 225.A N ASP 186.A O no hydrogen 2.817 N/A HIS 225.A ND1 LEU 224.A O no hydrogen 2.936 N/A HIS 225.A NE2 ASN 144.A OD1 no hydrogen 3.019 N/A ARG 226.A N ASN 260.A OD1 no hydrogen 3.219 N/A ARG 226.A NE SER 187.A O no hydrogen 2.825 N/A ARG 226.A NH1 GLN 238.A OE1 no hydrogen 2.971 N/A ARG 226.A NH2 SER 187.A O no hydrogen 2.884 N/A ARG 226.A NH2 PHE 188.A O no hydrogen 3.139 N/A LYS 227.A NZ GLU 262.A OE1 no hydrogen 3.146 N/A LYS 227.A NZ ASP 264.A OD2 no hydrogen 2.631 N/A GLY 228.A N ASP 264.A O no hydrogen 3.046 N/A ARG 230.A N PRO 265.A O no hydrogen 2.751 N/A ARG 230.A NH2 GLN 273.A OE1 no hydrogen 2.950 N/A SER 231.A N GLY 228.A O no hydrogen 3.050 N/A SER 232.A N ASP 408.A OD2 no hydrogen 2.991 N/A SER 232.A OG GLN 291.A OE1 no hydrogen 3.426 N/A SER 232.A OG ASP 408.A OD1 no hydrogen 2.839 N/A SER 232.A OG ASP 408.A OD2 no hydrogen 3.424 N/A SER 234.A N SER 231.A OG no hydrogen 3.351 N/A ILE 235.A N SER 232.A O no hydrogen 3.174 N/A GLU 237.A N ILE 233.A O no hydrogen 2.994 N/A GLN 238.A N SER 234.A O no hydrogen 3.024 N/A GLN 238.A NE2 LYS 227.A O no hydrogen 2.898 N/A GLN 238.A NE2 SER 234.A O no hydrogen 2.880 N/A GLU 239.A N ILE 235.A O no hydrogen 3.166 N/A LYS 240.A N LEU 236.A O no hydrogen 3.128 N/A VAL 241.A N GLU 237.A O no hydrogen 3.409 N/A VAL 242.A N GLN 238.A O no hydrogen 3.161 N/A ALA 243.A N GLU 239.A O no hydrogen 2.889 N/A GLN 244.A N LYS 240.A O no hydrogen 2.973 N/A GLN 245.A N VAL 241.A O no hydrogen 3.138 N/A ILE 246.A N VAL 242.A O no hydrogen 3.002 N/A ARG 247.A N ALA 243.A O no hydrogen 2.943 N/A ARG 247.A NH1 SER 302.A O no hydrogen 2.854 N/A ARG 247.A NH2 SER 302.A O no hydrogen 2.763 N/A GLN 248.A N GLN 244.A O no hydrogen 3.001 N/A LEU 249.A N GLN 245.A O no hydrogen 2.996 N/A PHE 250.A N ILE 246.A O no hydrogen 2.875 N/A LYS 252.A N HIS 205.A NE2 no hydrogen 3.156 N/A PHE 253.A N PHE 250.A O no hydrogen 2.842 N/A THR 256.A N PHE 253.A O no hydrogen 3.397 N/A ILE 258.A N PRO 305.A O no hydrogen 2.879 N/A TYR 259.A N ILE 222.A O no hydrogen 2.806 N/A TYR 259.A OH ASN 139.A OD1 no hydrogen 3.293 N/A ASN 260.A N LEU 308.A O no hydrogen 2.980 N/A ASN 260.A ND2 ARG 226.A O no hydrogen 3.188 N/A ASN 260.A ND2 GLU 239.A OE2 no hydrogen 2.622 N/A ASP 261.A N LEU 224.A O no hydrogen 3.324 N/A GLU 262.A N ASN 260.A OD1 no hydrogen 3.312 N/A ALA 263.A N SER 310.A O no hydrogen 2.875 N/A LEU 271.A N GLY 268.A O no hydrogen 3.294 N/A GLN 273.A N ALA 324.A O no hydrogen 2.724 N/A GLN 273.A NE2 PRO 272.A O no hydrogen 2.718 N/A TRP 275.A NE1 GLN 273.A OE1 no hydrogen 3.092 N/A ARG 276.A N GLN 273.A O no hydrogen 2.970 N/A ARG 276.A NH1 GLY 268.A O no hydrogen 2.824 N/A ARG 276.A NH1 LEU 271.A O no hydrogen 2.649 N/A ARG 276.A NH2 GLY 268.A O no hydrogen 3.113 N/A ALA 277.A N PRO 274.A O no hydrogen 3.107 N/A VAL 279.A N ASN 441.A OD1 no hydrogen 3.042 N/A THR 280.A N ASP 278.A OD1 no hydrogen 3.169 N/A THR 280.A OG1 ASP 278.A OD1 no hydrogen 2.901 N/A ALA 282.A N ASP 278.A O no hydrogen 3.411 N/A ALA 283.A N VAL 279.A O no hydrogen 2.788 N/A MET 284.A N THR 280.A O no hydrogen 3.103 N/A VAL 285.A N TYR 281.A O no hydrogen 2.963 N/A VAL 286.A N ALA 282.A O no hydrogen 3.215 N/A LYS 287.A N ALA 283.A O no hydrogen 2.967 N/A LYS 287.A NZ SER 406.A O no hydrogen 2.888 N/A LYS 287.A NZ ASP 408.A OD1 no hydrogen 2.727 N/A VAL 288.A N MET 284.A O no hydrogen 2.898 N/A ILE 289.A N VAL 285.A O no hydrogen 3.207 N/A ALA 290.A N VAL 286.A O no hydrogen 2.818 N/A GLN 291.A N LYS 287.A O no hydrogen 2.898 N/A GLN 291.A NE2 SER 232.A OG no hydrogen 3.211 N/A GLN 291.A NE2 SER 377.A O no hydrogen 3.108 N/A HIS 292.A N VAL 288.A O no hydrogen 3.047 N/A HIS 292.A ND1 VAL 288.A O no hydrogen 2.774 N/A HIS 292.A NE2 GLU 239.A OE1 no hydrogen 2.443 N/A GLN 293.A N ILE 289.A O no hydrogen 2.932 N/A GLN 293.A NE2 GLN 363.A OE1 no hydrogen 2.747 N/A ASN 294.A N ALA 290.A O no hydrogen 2.969 N/A ASN 294.A ND2 SER 377.A OG no hydrogen 2.945 N/A ASN 294.A ND2 VAL 383.A O no hydrogen 3.369 N/A LEU 295.A N GLN 291.A O no hydrogen 2.949 N/A LEU 296.A N HIS 292.A O no hydrogen 3.216 N/A LEU 297.A N HIS 292.A O no hydrogen 2.928 N/A ALA 298.A N GLN 293.A O no hydrogen 2.805 N/A SER 302.A N THR 300.A OG1 no hydrogen 3.427 N/A TYR 306.A N PHE 304.A O no hydrogen 2.708 N/A TYR 306.A OH GLU 239.A OE2 no hydrogen 2.947 N/A ALA 307.A N ILE 258.A O no hydrogen 2.919 N/A LEU 309.A N PHE 20.A O no hydrogen 2.823 N/A SER 310.A N ASN 260.A O no hydrogen 2.878 N/A SER 310.A OG SER 23.A OG no hydrogen 2.727 N/A ASP 312.A N ASP 264.A OD1 no hydrogen 2.773 N/A ASN 313.A ND2 TYR 281.A OH no hydrogen 2.911 N/A ALA 314.A N GLY 25.A O no hydrogen 2.863 N/A SER 317.A OG PRO 322.A O no hydrogen 2.889 N/A TYR 318.A N GLN 325.A OE1 no hydrogen 2.968 N/A HIS 321.A N TYR 318.A O no hydrogen 2.791 N/A GLN 325.A NE2 SER 270.A O no hydrogen 2.996 N/A ARG 326.A N TRP 269.A O no hydrogen 2.786 N/A ARG 326.A NH1 LEU 266.A O no hydrogen 2.785 N/A ARG 326.A NH2 ASP 312.A O no hydrogen 2.935 N/A THR 327.A N GLN 325.A O no hydrogen 2.880 N/A THR 327.A OG1 THR 329.A O no hydrogen 2.599 N/A LEU 328.A N ASN 313.A O no hydrogen 2.790 N/A ALA 330.A N LEU 345.A O no hydrogen 2.686 N/A ARG 331.A N SER 317.A OG no hydrogen 3.071 N/A ARG 331.A NE SER 317.A O no hydrogen 2.685 N/A ARG 331.A NH1 ASP 36.A OD2 no hydrogen 3.018 N/A ARG 331.A NH2 SER 317.A O no hydrogen 2.869 N/A PHE 332.A N GLN 343.A O no hydrogen 2.775 N/A VAL 334.A N HIS 341.A O no hydrogen 2.789 N/A THR 337.A OG1 VAL 334.A O no hydrogen 3.402 N/A THR 337.A OG1 PRO 339.A O no hydrogen 2.743 N/A THR 337.A OG1 HIS 341.A ND1 no hydrogen 2.957 N/A HIS 341.A N VAL 334.A O no hydrogen 2.986 N/A HIS 341.A ND1 THR 337.A OG1 no hydrogen 2.957 N/A GLN 343.A N PHE 332.A O no hydrogen 2.817 N/A GLN 343.A NE2 HIS 341.A NE2 no hydrogen 3.318 N/A GLN 343.A NE2 GLN 526.A OE1 no hydrogen 2.764 N/A LEU 345.A N ALA 330.A O no hydrogen 2.718 N/A ARG 346.A N GLU 471.A OE2 no hydrogen 2.779 N/A ARG 346.A NE THR 351.A OG1 no hydrogen 2.860 N/A ARG 346.A NH1 ASP 472.A OD1 no hydrogen 3.243 N/A ARG 346.A NH2 ASP 472.A OD1 no hydrogen 2.568 N/A LYS 347.A N LEU 328.A O no hydrogen 3.149 N/A LYS 347.A NZ ARG 276.A O no hydrogen 3.081 N/A LYS 347.A NZ PHE 323.A O no hydrogen 2.786 N/A LYS 347.A NZ THR 327.A O no hydrogen 2.973 N/A THR 351.A N LYS 347.A O no hydrogen 3.172 N/A THR 351.A OG1 GLU 471.A O no hydrogen 3.081 N/A ALA 352.A N PRO 348.A O no hydrogen 2.777 N/A MET 353.A N VAL 349.A O no hydrogen 3.223 N/A MET 353.A N LEU 350.A O no hydrogen 3.194 N/A LEU 355.A N THR 351.A O no hydrogen 3.248 N/A LEU 356.A N ALA 352.A O no hydrogen 2.978 N/A ALA 357.A N MET 353.A O no hydrogen 2.949 N/A LEU 358.A N LEU 355.A O no hydrogen 3.080 N/A LEU 359.A N LEU 356.A O no hydrogen 3.106 N/A ASP 360.A N SER 386.A OG no hydrogen 2.778 N/A GLU 361.A N GLU 361.A OE1 no hydrogen 2.859 N/A GLU 362.A N ALA 387.A O no hydrogen 3.273 N/A GLN 363.A N TRP 15.A O no hydrogen 2.846 N/A GLN 363.A NE2 ASN 294.A OD1 no hydrogen 2.744 N/A LEU 364.A N ALA 385.A O no hydrogen 2.878 N/A TRP 365.A N ARG 12.A O no hydrogen 2.919 N/A GLU 367.A N GLN 7.A O no hydrogen 2.749 N/A SER 369.A N LEU 5.A O no hydrogen 2.868 N/A GLN 370.A N THR 373.A O no hydrogen 2.801 N/A THR 373.A N GLN 370.A O no hydrogen 3.008 N/A LEU 375.A N VAL 368.A O no hydrogen 2.732 N/A SER 377.A OG ALA 290.A O no hydrogen 3.550 N/A ASN 378.A N ASP 376.A OD1 no hydrogen 3.020 N/A HIS 379.A ND1 ASP 376.A O no hydrogen 2.876 N/A THR 380.A OG1 GLU 1.A OE1 no hydrogen 3.354 N/A GLY 382.A N TYR 404.A O no hydrogen 3.196 N/A LEU 384.A N LEU 402.A O no hydrogen 2.983 N/A SER 386.A N ALA 400.A O no hydrogen 2.932 N/A ALA 387.A N GLU 362.A O no hydrogen 2.845 N/A HIS 388.A N ARG 398.A O no hydrogen 2.738 N/A HIS 388.A ND1 GLU 361.A OE1 no hydrogen 2.941 N/A HIS 388.A NE2 ASP 395.A OD2 no hydrogen 2.574 N/A ARG 389.A N GLU 361.A OE2 no hydrogen 3.034 N/A ARG 389.A NE GLU 362.A OE1 no hydrogen 3.038 N/A ARG 389.A NH2 GLU 362.A OE1 no hydrogen 2.756 N/A GLN 391.A N ASP 395.A OD2 no hydrogen 3.286 N/A GLY 392.A N ASP 395.A OD1 no hydrogen 2.854 N/A ASP 395.A N GLY 392.A O no hydrogen 3.307 N/A ARG 398.A N HIS 388.A O no hydrogen 3.216 N/A ARG 398.A NE ASP 360.A OD2 no hydrogen 3.329 N/A ARG 398.A NH2 ASP 360.A OD1 no hydrogen 2.853 N/A ALA 399.A N VAL 503.A O no hydrogen 2.772 N/A ALA 400.A N SER 386.A O no hydrogen 3.004 N/A VAL 401.A N VAL 501.A O no hydrogen 2.803 N/A LEU 402.A N LEU 384.A O no hydrogen 2.813 N/A ILE 403.A N LEU 499.A O no hydrogen 2.785 N/A TYR 404.A N GLY 382.A O no hydrogen 2.946 N/A TYR 404.A OH SER 377.A O no hydrogen 2.841 N/A ALA 405.A N SER 497.A O no hydrogen 2.969 N/A SER 406.A N THR 380.A O no hydrogen 2.824 N/A ASP 408.A N SER 406.A OG no hydrogen 3.164 N/A ARG 410.A N ASP 407.A O no hydrogen 3.192 N/A ARG 410.A NE ASP 407.A OD2 no hydrogen 3.003 N/A ARG 410.A NH2 ASP 407.A OD1 no hydrogen 2.754 N/A HIS 412.A N LEU 495.A O no hydrogen 3.027 N/A HIS 412.A NE2 ASP 407.A OD2 no hydrogen 2.747 N/A ARG 415.A NE GLU 1.A OE2 no hydrogen 2.767 N/A ARG 415.A NH2 GLU 1.A OE1 no hydrogen 2.664 N/A ARG 415.A NH2 GLU 1.A OE2 no hydrogen 3.377 N/A VAL 417.A N LEU 493.A O no hydrogen 2.720 N/A VAL 419.A N PRO 491.A O no hydrogen 3.138 N/A THR 420.A N HIS 4.A O no hydrogen 2.867 N/A LEU 421.A N LEU 489.A O no hydrogen 2.741 N/A ARG 422.A N VAL 6.A O no hydrogen 2.788 N/A LEU 423.A N LEU 487.A O no hydrogen 2.924 N/A ARG 424.A N VAL 8.A O no hydrogen 3.001 N/A VAL 426.A N GLY 485.A O no hydrogen 3.128 N/A VAL 433.A N CYS 504.A O no hydrogen 3.016 N/A TYR 434.A N ARG 479.A O no hydrogen 2.777 N/A VAL 435.A N HIS 502.A O no hydrogen 2.819 N/A ARG 437.A N LEU 500.A O no hydrogen 2.879 N/A ARG 437.A NH1 TYR 588.A OH no hydrogen 2.973 N/A ARG 437.A NH2 TYR 588.A OH no hydrogen 3.025 N/A TYR 438.A N VAL 474.A O no hydrogen 2.842 N/A TYR 438.A OH ASP 440.A OD2 no hydrogen 2.864 N/A LEU 439.A N LEU 498.A O no hydrogen 2.902 N/A LEU 443.A N ASP 440.A OD1 no hydrogen 2.910 N/A CYS 444.A N ASP 440.A O no hydrogen 2.857 N/A CYS 444.A SG TYR 438.A O no hydrogen 3.618 N/A CYS 444.A SG ASP 472.A O no hydrogen 3.369 N/A GLY 448.A N SER 445.A OG no hydrogen 3.074 N/A GLU 449.A N SER 445.A O no hydrogen 3.048 N/A TRP 450.A N PRO 446.A O no hydrogen 2.868 N/A TRP 450.A NE1 PRO 456.A O no hydrogen 3.059 N/A ARG 451.A N ASP 447.A O no hydrogen 2.974 N/A ARG 451.A NE ASP 447.A OD1 no hydrogen 3.355 N/A ARG 451.A NE ASP 447.A OD2 no hydrogen 3.229 N/A ARG 452.A N GLY 448.A O no hydrogen 3.021 N/A ARG 452.A NE GLU 449.A OE1 no hydrogen 3.121 N/A ARG 452.A NH2 GLU 449.A OE1 no hydrogen 2.930 N/A LEU 453.A N GLU 449.A O no hydrogen 3.048 N/A LEU 453.A N TRP 450.A O no hydrogen 3.174 N/A GLY 454.A N ARG 451.A O no hydrogen 2.915 N/A ARG 455.A N TRP 450.A O no hydrogen 2.851 N/A THR 460.A N GLN 463.A OE1 no hydrogen 2.797 N/A GLN 463.A N THR 460.A OG1 no hydrogen 3.221 N/A PHE 464.A N THR 460.A O no hydrogen 3.027 N/A ARG 465.A N ALA 461.A O no hydrogen 3.080 N/A ARG 465.A NE SER 571.A O no hydrogen 2.830 N/A ARG 465.A NH1 GLU 462.A OE1 no hydrogen 2.913 N/A ARG 465.A NH2 SER 571.A O no hydrogen 3.287 N/A ARG 466.A N GLU 462.A O no hydrogen 2.998 N/A MET 467.A N GLN 463.A O no hydrogen 3.006 N/A ARG 468.A N PHE 464.A O no hydrogen 2.899 N/A ARG 468.A NH1 GLN 343.A OE1 no hydrogen 3.389 N/A ARG 468.A NH2 GLN 343.A OE1 no hydrogen 2.681 N/A ARG 468.A NH2 LEU 344.A O no hydrogen 2.837 N/A ALA 469.A N ARG 465.A O no hydrogen 3.047 N/A ALA 470.A N MET 467.A O no hydrogen 3.248 N/A GLU 471.A N ARG 468.A O no hydrogen 3.246 N/A VAL 474.A N TYR 438.A O no hydrogen 2.939 N/A ALA 476.A N THR 436.A O no hydrogen 3.102 N/A ARG 479.A N TYR 434.A O no hydrogen 2.940 N/A LEU 481.A N LEU 432.A O no hydrogen 2.915 N/A LEU 487.A N LEU 423.A O no hydrogen 2.956 N/A LEU 489.A N LEU 421.A O no hydrogen 2.900 N/A LEU 493.A N VAL 417.A O no hydrogen 3.012 N/A ARG 494.A N TYR 438.A OH no hydrogen 3.268 N/A ARG 494.A NH2 PRO 413.A O no hydrogen 2.727 N/A LEU 495.A N ARG 415.A O no hydrogen 3.352 N/A SER 497.A N ALA 405.A O no hydrogen 2.978 N/A SER 497.A OG ARG 494.A O no hydrogen 2.725 N/A LEU 498.A N LEU 439.A O no hydrogen 3.043 N/A LEU 499.A N ILE 403.A O no hydrogen 2.883 N/A LEU 500.A N ARG 437.A O no hydrogen 2.858 N/A VAL 501.A N VAL 401.A O no hydrogen 2.808 N/A HIS 502.A N VAL 435.A O no hydrogen 2.829 N/A HIS 502.A ND1 TYR 588.A OH no hydrogen 2.767 N/A VAL 503.A N ALA 399.A O no hydrogen 2.815 N/A CYS 504.A N VAL 433.A O no hydrogen 3.012 N/A ALA 505.A N TRP 397.A O no hydrogen 2.971 N/A ARG 506.A N PRO 430.A O no hydrogen 2.754 N/A LYS 509.A N PRO 393.A O no hydrogen 3.058 N/A GLY 512.A N VAL 536.A O no hydrogen 2.712 N/A GLN 513.A NE2 PHE 595.A O no hydrogen 3.096 N/A GLN 513.A NE2 ASP 597.A OD1 no hydrogen 3.331 N/A THR 515.A N SER 532.A O no hydrogen 3.384 N/A THR 515.A OG1 GLU 534.A OE1 no hydrogen 2.975 N/A ARG 518.A N VAL 530.A O no hydrogen 2.900 N/A ARG 518.A NH2 ASN 87.A OD1 no hydrogen 2.671 N/A LEU 520.A N VAL 528.A O no hydrogen 2.752 N/A LEU 522.A N GLN 526.A O no hydrogen 3.212 N/A GLY 525.A N GLU 603.A OE2 no hydrogen 2.482 N/A GLN 526.A N THR 523.A O no hydrogen 2.971 N/A LEU 527.A N PHE 570.A O no hydrogen 3.123 N/A VAL 528.A N LEU 520.A O no hydrogen 2.723 N/A LEU 529.A N PHE 568.A O no hydrogen 2.941 N/A VAL 530.A N ARG 518.A O no hydrogen 3.050 N/A TRP 531.A N ASN 566.A O no hydrogen 3.117 N/A SER 532.A N THR 515.A O no hydrogen 2.892 N/A SER 532.A OG GLN 88.A OE1 no hydrogen 2.643 N/A GLU 534.A N SER 532.A OG no hydrogen 3.209 N/A VAL 536.A N ASP 533.A O no hydrogen 3.217 N/A LYS 539.A NZ ALA 357.A O no hydrogen 2.731 N/A LYS 539.A NZ ASP 360.A OD1 no hydrogen 3.286 N/A CYS 540.A SG.B SER 538.A OG no hydrogen 3.080 N/A TRP 542.A N LEU 586.A O no hydrogen 2.862 N/A THR 543.A N LEU 586.A O no hydrogen 3.457 N/A THR 543.A OG1 SER 563.A O no hydrogen 3.245 N/A TYR 544.A N SER 563.A O no hydrogen 3.324 N/A GLU 545.A N ARG 584.A O no hydrogen 2.856 N/A GLN 547.A N ARG 582.A O no hydrogen 2.860 N/A PHE 548.A N THR 556.A O no hydrogen 2.903 N/A SER 549.A N SER 580.A O no hydrogen 2.744 N/A SER 549.A OG ASP 551.A O no hydrogen 3.502 N/A SER 549.A OG GLY 552.A O no hydrogen 3.366 N/A SER 549.A OG ALA 554.A O no hydrogen 3.207 N/A LYS 553.A NZ TYR 555.A OH no hydrogen 2.835 N/A ALA 554.A N ASP 551.A O no hydrogen 3.302 N/A THR 556.A N PHE 548.A O no hydrogen 3.036 N/A THR 556.A OG1 PHE 548.A O no hydrogen 3.307 N/A VAL 558.A N ILE 546.A O no hydrogen 2.757 N/A ARG 560.A NE TYR 544.A O no hydrogen 3.159 N/A ARG 560.A NH2 TYR 544.A O no hydrogen 2.752 N/A LYS 561.A NZ ALA 469.A O no hydrogen 3.066 N/A SER 563.A N THR 543.A OG1 no hydrogen 3.087 N/A SER 563.A OG ASP 472.A OD1 no hydrogen 2.759 N/A SER 563.A OG ASP 472.A OD2 no hydrogen 3.494 N/A PHE 565.A N SER 563.A OG no hydrogen 3.400 N/A ASN 566.A N ALA 46.A O no hydrogen 2.857 N/A PHE 568.A N LEU 529.A O no hydrogen 2.912 N/A PHE 570.A N LEU 527.A O no hydrogen 2.781 N/A GLY 575.A N PRO 572.A O no hydrogen 3.163 N/A GLY 579.A N TYR 601.A O no hydrogen 2.779 N/A SER 580.A N SER 549.A O no hydrogen 2.905 N/A TYR 581.A N VAL 599.A O no hydrogen 3.007 N/A TYR 581.A OH VAL 577.A O no hydrogen 2.566 N/A ARG 582.A N GLN 547.A O no hydrogen 3.105 N/A ARG 582.A NE GLN 547.A OE1 no hydrogen 2.918 N/A ARG 582.A NH2 GLN 547.A OE1 no hydrogen 2.783 N/A VAL 583.A N SER 596.A OG no hydrogen 3.043 N/A ARG 584.A N GLU 545.A O no hydrogen 2.966 N/A ARG 584.A NE GLU 545.A OE2 no hydrogen 3.045 N/A ARG 584.A NH2 GLU 545.A OE2 no hydrogen 3.057 N/A LEU 586.A N THR 543.A O no hydrogen 2.918 N/A ASP 587.A N ARG 591.A O no hydrogen 3.038 N/A TYR 588.A N CYS 540.A O.A no hydrogen 3.179 N/A TYR 588.A N CYS 540.A O.B no hydrogen 3.185 N/A TYR 588.A OH HIS 502.A ND1 no hydrogen 2.767 N/A TRP 589.A N ASP 587.A OD1 no hydrogen 2.924 N/A TRP 589.A NE1 GLY 431.A O no hydrogen 2.887 N/A ALA 590.A N ASP 587.A O no hydrogen 3.121 N/A ARG 591.A N ASP 587.A OD1 no hydrogen 2.815 N/A ARG 591.A NE ASP 587.A OD2 no hydrogen 2.838 N/A ARG 591.A NH1 PRO 507.A O no hydrogen 2.809 N/A ARG 591.A NH2 PRO 507.A O no hydrogen 3.059 N/A ARG 591.A NH2 ASP 587.A OD2 no hydrogen 3.092 N/A GLY 593.A N ALA 585.A O no hydrogen 2.733 N/A SER 596.A N VAL 583.A O no hydrogen 2.779 N/A SER 596.A OG VAL 583.A O no hydrogen 3.398 N/A SER 596.A OG ASP 597.A O no hydrogen 3.253 N/A VAL 599.A N TYR 581.A O no hydrogen 2.849 N/A TYR 601.A N GLY 579.A O no hydrogen 2.716 N/A GLU 603.A N SER 578.A OG no hydrogen 3.028 N/A