Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3lj7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A N ARG 2.A O no hydrogen 3.010 N/A GLY 7.A N GLN 3.A O no hydrogen 3.017 N/A ALA 8.A N LYS 4.A O no hydrogen 3.022 N/A ALA 9.A N ALA 5.A O no hydrogen 3.099 N/A THR 10.A N ARG 6.A O no hydrogen 3.072 N/A THR 10.A OG1 ARG 6.A O no hydrogen 2.976 N/A ARG 11.A N GLY 7.A O no hydrogen 2.947 N/A ARG 11.A NE GLU 128.A OE1 no hydrogen 3.191 N/A ARG 11.A NE GLU 128.A OE2 no hydrogen 3.377 N/A ARG 11.A NH2 GLU 128.A OE1 no hydrogen 2.948 N/A ALA 12.A N ALA 8.A O no hydrogen 2.792 N/A ARG 13.A N ALA 9.A O no hydrogen 2.981 N/A GLN 14.A N THR 10.A O no hydrogen 3.218 N/A LYS 15.A N ARG 11.A O no hydrogen 3.075 N/A LYS 15.A NZ ASP 119.A OD1 no hydrogen 3.179 N/A GLN 16.A N ALA 12.A O no hydrogen 2.986 N/A GLN 16.A NE2 ASN 80.A OD1 no hydrogen 2.936 N/A GLN 16.A NE2 VAL 82.A O no hydrogen 2.937 N/A ARG 17.A N ARG 13.A O no hydrogen 2.894 N/A ALA 18.A N GLN 14.A O no hydrogen 2.862 N/A SER 19.A N LYS 15.A O no hydrogen 2.914 N/A SER 19.A OG LYS 15.A O no hydrogen 3.015 N/A LEU 20.A N GLN 16.A O no hydrogen 3.018 N/A GLU 21.A N ARG 17.A O no hydrogen 3.024 N/A THR 22.A N ALA 18.A O no hydrogen 2.905 N/A THR 22.A OG1 ALA 18.A O no hydrogen 2.845 N/A MET 23.A N SER 19.A O no hydrogen 2.923 N/A ASP 24.A N LEU 20.A O no hydrogen 2.994 N/A LYS 25.A N GLU 21.A O no hydrogen 2.973 N/A ALA 26.A N THR 22.A O no hydrogen 3.219 N/A VAL 27.A N MET 23.A O no hydrogen 2.916 N/A GLN 28.A N ASP 24.A O no hydrogen 2.815 N/A GLN 28.A NE2 ASP 24.A OD1 no hydrogen 3.147 N/A ARG 29.A N LYS 25.A O no hydrogen 3.134 N/A PHE 30.A N ALA 26.A O no hydrogen 2.985 N/A ARG 31.A N VAL 27.A O no hydrogen 3.012 N/A ARG 31.A NH2 GLU 74.A OE1 no hydrogen 3.127 N/A LEU 32.A N GLN 28.A O no hydrogen 3.300 N/A GLN 33.A N ARG 29.A O no hydrogen 3.410 N/A GLN 33.A N PHE 30.A O no hydrogen 3.172 N/A ASN 34.A N ARG 31.A O no hydrogen 3.226 N/A LEU 37.A N ASN 34.A O no hydrogen 3.510 N/A ALA 41.A N ASP 38.A OD2 no hydrogen 3.411 N/A LEU 42.A N ASP 38.A O no hydrogen 3.310 N/A LEU 43.A N SER 39.A O no hydrogen 3.037 N/A THR 44.A N GLU 40.A O no hydrogen 3.038 N/A THR 44.A OG1 GLU 40.A O no hydrogen 3.318 N/A LEU 45.A N LEU 42.A O no hydrogen 3.303 N/A LEU 50.A N PRO 46.A O no hydrogen 2.932 N/A VAL 51.A N LEU 47.A O no hydrogen 2.809 N/A GLN 52.A N LEU 48.A O no hydrogen 3.225 N/A LYS 53.A N GLN 49.A O no hydrogen 2.956 N/A LYS 53.A NZ GLU 58.A OE2 no hydrogen 2.877 N/A LEU 54.A N LEU 50.A O no hydrogen 3.052 N/A GLN 55.A N VAL 51.A O no hydrogen 2.941 N/A GLN 55.A NE2 ARG 98.A O no hydrogen 3.067 N/A SER 56.A N GLN 52.A O no hydrogen 2.907 N/A SER 56.A OG GLN 52.A O no hydrogen 3.364 N/A SER 56.A OG LYS 53.A O no hydrogen 3.158 N/A GLY 57.A N LYS 53.A O no hydrogen 3.069 N/A GLU 58.A N SER 56.A OG no hydrogen 3.346 N/A LEU 59.A N LYS 53.A O no hydrogen 3.184 N/A ALA 63.A N SER 60.A OG no hydrogen 2.759 N/A VAL 64.A N SER 60.A O no hydrogen 3.096 N/A PHE 65.A N PRO 61.A O no hydrogen 2.719 N/A PHE 66.A N GLU 62.A O no hydrogen 2.987 N/A THR 67.A N ALA 63.A O no hydrogen 3.163 N/A THR 67.A OG1 ALA 63.A O no hydrogen 2.583 N/A TYR 68.A N VAL 64.A O no hydrogen 3.177 N/A LEU 69.A N PHE 65.A O no hydrogen 2.770 N/A GLY 70.A N PHE 66.A O no hydrogen 2.799 N/A LYS 71.A N THR 67.A O no hydrogen 2.997 N/A ALA 72.A N TYR 68.A O no hydrogen 2.802 N/A TRP 73.A N LEU 69.A O no hydrogen 3.096 N/A GLU 74.A N GLY 70.A O no hydrogen 3.030 N/A VAL 75.A N LYS 71.A O no hydrogen 2.886 N/A ASN 76.A N ALA 72.A O no hydrogen 3.012 N/A LYS 77.A N GLU 74.A O no hydrogen 3.207 N/A THR 79.A N ASN 76.A O no hydrogen 3.173 N/A THR 79.A OG1 VAL 75.A O no hydrogen 2.787 N/A ASN 80.A N ASN 76.A O no hydrogen 2.795 N/A ASN 80.A ND2 PHE 169.A O no hydrogen 2.847 N/A ASN 80.A ND2 GLN 171.A O no hydrogen 3.257 N/A CYS 81.A SG ASN 76.A OD1 no hydrogen 3.957 N/A CYS 81.A SG THR 79.A OG1 no hydrogen 3.203 N/A VAL 82.A N ASN 76.A OD1 no hydrogen 2.978 N/A THR 83.A N HIS 152.A O no hydrogen 2.970 N/A THR 83.A OG1 HIS 152.A O no hydrogen 3.510 N/A SER 84.A N HIS 152.A O no hydrogen 3.437 N/A SER 84.A OG HIS 118.A ND1 no hydrogen 3.057 N/A TYR 85.A N SER 19.A OG no hydrogen 3.190 N/A TYR 85.A OH GLU 90.A OE1 no hydrogen 2.744 N/A LEU 86.A N PHE 150.A O no hydrogen 2.887 N/A THR 87.A N HIS 118.A NE2 no hydrogen 3.326 N/A THR 87.A OG1 HIS 118.A NE2 no hydrogen 3.291 N/A CYS 89.A N LEU 86.A O no hydrogen 2.942 N/A CYS 89.A SG TYR 85.A OH no hydrogen 3.709 N/A CYS 89.A SG LEU 86.A O no hydrogen 3.009 N/A THR 91.A OG1 ASP 88.A O no hydrogen 2.952 N/A GLN 92.A N ASP 88.A O no hydrogen 2.941 N/A LEU 93.A N CYS 89.A O no hydrogen 2.821 N/A SER 94.A N GLU 90.A O no hydrogen 3.249 N/A SER 94.A OG THR 91.A O no hydrogen 3.095 N/A GLN 95.A N GLN 92.A O no hydrogen 2.913 N/A ARG 98.A NH2 GLN 55.A O no hydrogen 2.836 N/A GLY 100.A N PRO 97.A O no hydrogen 3.080 N/A LEU 101.A N GLN 145.A OE1 no hydrogen 3.185 N/A LEU 102.A N GLN 145.A O no hydrogen 2.923 N/A TYR 103.A N GLY 100.A O no hydrogen 3.147 N/A GLY 104.A N GLY 146.A O no hydrogen 2.990 N/A VAL 105.A N LEU 102.A O no hydrogen 2.962 N/A VAL 107.A N VAL 148.A O no hydrogen 3.119 N/A SER 108.A N LEU 200.A O no hydrogen 2.978 N/A SER 108.A OG GLU 189.A OE1 no hydrogen 2.477 N/A SER 108.A OG GLU 189.A OE2 no hydrogen 3.238 N/A SER 108.A OG SER 198.A OG no hydrogen 3.023 N/A SER 108.A OG LEU 200.A O no hydrogen 3.433 N/A LEU 109.A N VAL 151.A O no hydrogen 2.992 N/A LYS 110.A N LEU 202.A O no hydrogen 3.126 N/A LYS 110.A NZ SER 185.A OG no hydrogen 2.632 N/A LYS 110.A NZ SER 186.A OG no hydrogen 3.181 N/A LYS 110.A NZ THR 204.A O no hydrogen 3.264 N/A LYS 110.A NZ THR 204.A OG1 no hydrogen 2.836 N/A GLU 111.A N THR 153.A O no hydrogen 3.188 N/A PHE 113.A N LYS 110.A O no hydrogen 3.080 N/A SER 114.A OG SER 132.A OG no hydrogen 3.264 N/A SER 114.A OG GLY 233.A O no hydrogen 2.778 N/A TYR 115.A OH ASP 88.A OD1 no hydrogen 2.575 N/A LYS 116.A N ASP 135.A OD2 no hydrogen 2.904 N/A LYS 116.A NZ GLU 133.A O no hydrogen 3.406 N/A GLY 117.A N SER 132.A O no hydrogen 2.989 N/A HIS 118.A N TYR 115.A O no hydrogen 3.029 N/A HIS 118.A ND1 SER 84.A OG no hydrogen 3.057 N/A HIS 118.A NE2 THR 87.A OG1 no hydrogen 3.291 N/A SER 120.A OG GLU 111.A O no hydrogen 2.733 N/A THR 121.A N GLU 111.A OE1 no hydrogen 2.943 N/A THR 121.A OG1 GLU 111.A OE1 no hydrogen 2.588 N/A THR 121.A OG1 GLU 111.A OE2 no hydrogen 3.183 N/A LEU 122.A N GLU 111.A OE2 no hydrogen 2.691 N/A GLY 123.A N THR 121.A OG1 no hydrogen 3.107 N/A LEU 124.A N THR 121.A O no hydrogen 2.922 N/A SER 125.A N ASP 363.A OD2 no hydrogen 2.858 N/A ASN 127.A N LEU 124.A O no hydrogen 3.127 N/A ASN 127.A ND2 THR 121.A O no hydrogen 3.074 N/A GLU 128.A N SER 125.A O no hydrogen 3.132 N/A GLY 129.A N ASP 119.A OD1 no hydrogen 2.892 N/A MET 130.A N ASP 119.A OD2 no hydrogen 3.034 N/A SER 132.A N HIS 118.A O no hydrogen 3.133 N/A SER 132.A OG HIS 118.A O no hydrogen 3.491 N/A CYS 136.A N SER 114.A O no hydrogen 3.059 N/A CYS 136.A SG SER 114.A O no hydrogen 3.566 N/A VAL 137.A N SER 232.A O no hydrogen 3.119 N/A GLN 140.A N CYS 136.A O no hydrogen 3.007 N/A GLN 140.A NE2 ASP 135.A O no hydrogen 3.027 N/A VAL 141.A N VAL 137.A O no hydrogen 2.912 N/A LEU 142.A N VAL 138.A O no hydrogen 2.880 N/A LYS 143.A N VAL 139.A O no hydrogen 3.133 N/A LYS 143.A NZ TYR 115.A OH no hydrogen 2.845 N/A LYS 143.A NZ ASP 135.A OD1 no hydrogen 2.709 N/A LEU 144.A N GLN 140.A O no hydrogen 2.848 N/A GLN 145.A N VAL 141.A O no hydrogen 2.881 N/A GLN 145.A N LEU 142.A O no hydrogen 3.072 N/A GLN 145.A NE2 ALA 264.A O no hydrogen 2.904 N/A GLY 146.A N LYS 143.A O no hydrogen 2.918 N/A ALA 147.A N LEU 142.A O no hydrogen 3.040 N/A VAL 148.A N VAL 105.A O no hydrogen 2.899 N/A PHE 150.A N VAL 107.A O no hydrogen 3.017 N/A HIS 152.A N SER 84.A O no hydrogen 2.956 N/A HIS 152.A NE2 PHE 113.A O no hydrogen 2.842 N/A THR 153.A N LEU 109.A O no hydrogen 2.969 N/A THR 153.A OG1 LEU 109.A O no hydrogen 3.169 N/A THR 153.A OG1 GLU 189.A OE2 no hydrogen 2.578 N/A ASN 154.A N CYS 81.A O no hydrogen 2.827 N/A ASN 154.A ND2 GLY 170.A O no hydrogen 3.051 N/A ASN 154.A ND2 THR 172.A OG1 no hydrogen 2.894 N/A GLN 157.A N SER 165.A O no hydrogen 3.013 N/A GLN 157.A NE2 GLY 123.A O no hydrogen 3.514 N/A GLN 157.A NE2 PHE 364.A O no hydrogen 2.936 N/A SER 158.A N LEU 122.A O no hydrogen 2.721 N/A SER 158.A OG GLN 157.A O no hydrogen 2.551 N/A MET 159.A N PRO 156.A O no hydrogen 2.814 N/A PHE 160.A N SER 158.A OG no hydrogen 3.126 N/A SER 161.A N MET 159.A O no hydrogen 2.895 N/A TYR 162.A OH ALA 455.A O no hydrogen 2.819 N/A ASP 163.A N SER 161.A OG no hydrogen 2.764 N/A CYS 164.A SG ASN 154.A O no hydrogen 3.356 N/A SER 165.A OG ASP 366.A OD1 no hydrogen 3.332 N/A SER 165.A OG ASP 366.A OD2 no hydrogen 2.685 N/A ASN 166.A N GLY 170.A O no hydrogen 3.087 N/A ASN 166.A ND2 ASN 154.A OD1 no hydrogen 2.903 N/A ASN 166.A ND2 VAL 155.A O no hydrogen 2.741 N/A LEU 168.A N ASN 166.A OD1 no hydrogen 2.895 N/A PHE 169.A N ASN 166.A OD1 no hydrogen 2.825 N/A GLY 170.A N ASN 166.A O no hydrogen 2.763 N/A GLN 171.A NE2 ASN 450.A OD1 no hydrogen 3.641 N/A THR 172.A N CYS 164.A O no hydrogen 2.900 N/A THR 172.A OG1 ASN 80.A O no hydrogen 2.739 N/A MET 173.A N THR 79.A O no hydrogen 2.915 N/A ASN 174.A N LYS 180.A O no hydrogen 2.911 N/A ASN 174.A ND2 SER 181.A O no hydrogen 2.963 N/A ASN 174.A ND2 PHE 216.A O no hydrogen 2.829 N/A TRP 176.A N ASN 174.A OD1 no hydrogen 2.894 N/A TRP 176.A NE1 CYS 217.A O no hydrogen 2.913 N/A LYS 177.A N ASN 174.A O no hydrogen 3.318 N/A LYS 177.A NZ ASN 509.A O no hydrogen 3.000 N/A LYS 180.A N LYS 177.A O no hydrogen 3.048 N/A LYS 180.A NZ ALA 446.A O no hydrogen 3.004 N/A LYS 180.A NZ ASP 448.A OD1 no hydrogen 2.755 N/A LYS 180.A NZ LYS 508.A O no hydrogen 3.003 N/A LYS 180.A NZ SER 510.A OG no hydrogen 3.073 N/A SER 181.A N LEU 447.A O no hydrogen 2.899 N/A SER 181.A OG ASP 163.A OD2 no hydrogen 2.574 N/A GLY 183.A N SER 181.A OG no hydrogen 2.866 N/A SER 185.A N SER 209.A OG no hydrogen 2.861 N/A SER 185.A OG MET 159.A O no hydrogen 3.521 N/A SER 185.A OG SER 209.A OG no hydrogen 3.060 N/A SER 186.A N SER 209.A O no hydrogen 3.103 N/A SER 186.A OG THR 204.A O no hydrogen 3.274 N/A SER 186.A OG SER 209.A O no hydrogen 2.806 N/A GLY 188.A N ASN 154.A O no hydrogen 3.053 N/A GLY 190.A N SER 186.A O no hydrogen 3.052 N/A ALA 191.A N GLY 187.A O no hydrogen 2.912 N/A LEU 192.A N GLY 188.A O no hydrogen 2.954 N/A ILE 193.A N GLU 189.A O no hydrogen 2.930 N/A GLY 194.A N GLY 190.A O no hydrogen 2.896 N/A SER 195.A N ALA 191.A O no hydrogen 3.174 N/A SER 195.A N LEU 192.A O no hydrogen 3.407 N/A SER 195.A OG ALA 191.A O no hydrogen 2.625 N/A SER 195.A OG LEU 192.A O no hydrogen 3.424 N/A GLY 196.A N ILE 193.A O no hydrogen 3.060 N/A GLY 197.A N LEU 192.A O no hydrogen 2.908 N/A SER 198.A OG SER 108.A OG no hydrogen 3.023 N/A LEU 200.A N SER 198.A OG no hydrogen 3.429 N/A GLY 201.A N MET 251.A O no hydrogen 2.889 N/A LEU 202.A N SER 108.A O no hydrogen 3.137 N/A GLY 203.A N GLY 249.A O no hydrogen 2.995 N/A THR 204.A N SER 186.A OG no hydrogen 3.247 N/A ASP 205.A N SER 247.A O no hydrogen 2.790 N/A SER 209.A OG SER 185.A OG no hydrogen 3.060 N/A ILE 210.A N ASP 205.A OD1 no hydrogen 2.975 N/A ARG 211.A N ASP 205.A OD1 no hydrogen 3.459 N/A ARG 211.A NE ASP 205.A OD1 no hydrogen 2.952 N/A ARG 211.A NH1 THR 462.A O no hydrogen 3.079 N/A ARG 211.A NH1 GLN 518.A OE1 no hydrogen 2.707 N/A ARG 211.A NH2 ASP 205.A OD1 no hydrogen 3.506 N/A ARG 211.A NH2 ASP 205.A OD2 no hydrogen 2.796 N/A ARG 211.A NH2 THR 462.A O no hydrogen 3.239 N/A ARG 211.A NH2 ASN 466.A OD1 no hydrogen 2.879 N/A PHE 212.A N GLY 208.A O no hydrogen 2.747 N/A SER 214.A N ILE 210.A O no hydrogen 3.254 N/A SER 214.A OG ILE 210.A O no hydrogen 2.824 N/A ALA 215.A N ARG 211.A O no hydrogen 2.907 N/A PHE 216.A N PHE 212.A O no hydrogen 2.784 N/A CYS 217.A N PRO 213.A O no hydrogen 2.972 N/A CYS 217.A SG PRO 182.A O no hydrogen 3.290 N/A GLY 218.A N ALA 215.A O no hydrogen 3.299 N/A ILE 219.A N SER 214.A O no hydrogen 2.902 N/A CYS 220.A N ALA 252.A O no hydrogen 2.870 N/A CYS 220.A SG GLU 537.A OE1 no hydrogen 3.829 N/A GLY 221.A N VAL 474.A O no hydrogen 3.298 N/A LEU 222.A N PRO 250.A O no hydrogen 3.108 N/A LYS 223.A N ALA 472.A O no hydrogen 2.790 N/A LYS 223.A NZ LYS 223.A O no hydrogen 3.074 N/A LYS 223.A NZ PRO 224.A O no hydrogen 2.973 N/A LYS 223.A NZ PHE 470.A O no hydrogen 2.645 N/A THR 225.A N GLU 526.A OE2 no hydrogen 2.599 N/A THR 225.A OG1 GLU 526.A OE2 no hydrogen 2.548 N/A GLY 226.A N ASP 469.A OD2 no hydrogen 2.804 N/A ASN 227.A ND2 THR 276.A O no hydrogen 3.384 N/A ARG 228.A N THR 225.A O no hydrogen 2.987 N/A ARG 228.A NH1 LEU 280.A O no hydrogen 2.836 N/A ARG 228.A NH1 GLU 527.A OE2 no hydrogen 3.143 N/A ARG 228.A NH2 GLU 526.A OE1 no hydrogen 2.828 N/A ARG 228.A NH2 GLU 527.A OE1 no hydrogen 3.152 N/A ARG 228.A NH2 GLU 527.A OE2 no hydrogen 3.562 N/A SER 230.A OG ASP 274.A OD1 no hydrogen 2.479 N/A LYS 231.A NZ LEU 246.A O no hydrogen 3.009 N/A SER 232.A N SER 230.A OG no hydrogen 3.061 N/A LEU 234.A N LYS 231.A O no hydrogen 3.150 N/A LYS 235.A N CYS 112.A O no hydrogen 2.922 N/A GLY 236.A N TYR 239.A OH no hydrogen 2.787 N/A CYS 237.A SG SER 158.A O no hydrogen 3.215 N/A GLN 241.A NE2 VAL 244.A O no hydrogen 3.034 N/A THR 242.A OG1 GLN 416.A OE1.A no hydrogen 3.465 N/A VAL 244.A N GLN 241.A OE1 no hydrogen 2.923 N/A SER 247.A N ASP 205.A O no hydrogen 2.945 N/A SER 247.A OG PRO 224.A O no hydrogen 2.698 N/A GLY 249.A N GLY 203.A O no hydrogen 3.100 N/A MET 251.A N GLY 201.A O no hydrogen 2.934 N/A ALA 252.A N CYS 220.A O no hydrogen 3.026 N/A ARG 253.A NH2 TYR 68.A OH no hydrogen 3.150 N/A VAL 255.A N GLU 537.A OE1 no hydrogen 2.989 N/A SER 257.A N ASP 254.A OD2 no hydrogen 2.761 N/A SER 257.A OG ASP 254.A OD2 no hydrogen 2.469 N/A ALA 259.A N VAL 255.A O no hydrogen 2.963 N/A LEU 260.A N GLU 256.A O no hydrogen 2.908 N/A CYS 261.A N SER 257.A O no hydrogen 2.977 N/A LEU 262.A N LEU 258.A O no hydrogen 3.067 N/A LYS 263.A N ALA 259.A O no hydrogen 2.992 N/A ALA 264.A N LEU 260.A O no hydrogen 2.885 N/A LEU 265.A N CYS 261.A O no hydrogen 2.920 N/A LEU 266.A N LEU 262.A O no hydrogen 2.813 N/A CYS 267.A N LEU 265.A O no hydrogen 2.856 N/A CYS 267.A SG ALA 264.A O no hydrogen 3.392 N/A CYS 267.A SG LEU 265.A O no hydrogen 3.733 N/A PHE 271.A N CYS 267.A O no hydrogen 3.195 N/A THR 272.A N GLU 268.A O no hydrogen 2.762 N/A THR 272.A OG1 GLU 268.A O no hydrogen 2.927 N/A THR 272.A OG1 HIS 269.A O no hydrogen 3.273 N/A LEU 273.A N HIS 269.A O no hydrogen 2.885 N/A ASP 274.A N LEU 270.A O no hydrogen 2.835 N/A THR 276.A N ASP 274.A OD2 no hydrogen 3.167 N/A THR 276.A OG1 ASP 274.A OD1 no hydrogen 3.550 N/A THR 276.A OG1 ASP 274.A OD2 no hydrogen 2.699 N/A VAL 277.A N ASP 274.A O no hydrogen 3.269 N/A LEU 280.A N PRO 278.A O no hydrogen 2.834 N/A ARG 283.A N GLU 527.A OE2 no hydrogen 2.862 N/A ARG 283.A NE GLU 527.A OE2 no hydrogen 3.431 N/A ARG 283.A NH1 TRP 524.A O no hydrogen 2.899 N/A GLU 285.A N GLU 285.A OE1 no hydrogen 2.843 N/A VAL 286.A N ARG 283.A O no hydrogen 3.129 N/A TYR 287.A N ARG 283.A O no hydrogen 3.316 N/A TYR 287.A OH GLU 256.A OE1 no hydrogen 2.666 N/A ARG 288.A N GLU 284.A O no hydrogen 2.828 N/A ARG 288.A NH1 GLU 256.A OE2 no hydrogen 3.146 N/A ARG 288.A NH1 GLU 284.A OE1 no hydrogen 2.853 N/A ARG 288.A NH2 GLU 256.A OE1 no hydrogen 2.848 N/A ARG 288.A NH2 GLU 256.A OE2 no hydrogen 3.124 N/A ARG 291.A N SER 289.A OG no hydrogen 3.319 N/A ARG 291.A NE SER 289.A OG no hydrogen 3.067 N/A ARG 291.A NH2 SER 289.A OG no hydrogen 3.398 N/A LEU 293.A N HIS 326.A ND1 no hydrogen 3.007 N/A ARG 294.A N ASP 436.A OD1 no hydrogen 2.886 N/A ARG 294.A NE ASN 434.A O no hydrogen 2.998 N/A ARG 294.A NH2 MET 433.A O no hydrogen 2.927 N/A VAL 295.A N THR 327.A O no hydrogen 2.752 N/A GLY 296.A N VAL 437.A O no hydrogen 3.021 N/A TYR 297.A N ILE 329.A O no hydrogen 2.914 N/A TYR 298.A N LEU 439.A O no hydrogen 3.310 N/A TYR 298.A OH TYR 465.A OH no hydrogen 2.564 N/A THR 300.A OG1 TYR 494.A OH no hydrogen 2.568 N/A ASP 301.A N TYR 461.A OH no hydrogen 3.225 N/A ASN 302.A N THR 300.A OG1 no hydrogen 2.950 N/A TYR 303.A N ASP 301.A OD2 no hydrogen 2.926 N/A TYR 303.A OH GLU 341.A OE1 no hydrogen 2.598 N/A THR 304.A N ASP 301.A OD2 no hydrogen 2.980 N/A THR 304.A OG1 SER 460.A OG no hydrogen 2.741 N/A SER 307.A OG GLY 444.A O no hydrogen 2.756 N/A MET 310.A N SER 307.A OG no hydrogen 3.128 N/A ARG 311.A N SER 307.A O no hydrogen 3.004 N/A ARG 311.A NH2 GLU 299.A OE2 no hydrogen 3.380 N/A ARG 312.A N PRO 308.A O no hydrogen 2.893 N/A ARG 312.A NE ASP 484.A OD1 no hydrogen 3.110 N/A ARG 312.A NE ASP 484.A OD2 no hydrogen 3.024 N/A ARG 312.A NH1 THR 478.A OG1 no hydrogen 3.298 N/A ARG 312.A NH1 THR 479.A O no hydrogen 2.952 N/A ARG 312.A NH1 ASP 484.A OD1 no hydrogen 2.632 N/A ARG 312.A NH2 GLU 316.A OE2 no hydrogen 3.261 N/A ARG 312.A NH2 THR 478.A OG1 no hydrogen 3.168 N/A ALA 313.A N ALA 309.A O no hydrogen 2.910 N/A LEU 314.A N MET 310.A O no hydrogen 2.983 N/A ILE 315.A N ARG 311.A O no hydrogen 3.032 N/A GLU 316.A N ARG 312.A O no hydrogen 2.929 N/A THR 317.A N ALA 313.A O no hydrogen 3.161 N/A THR 317.A OG1 ALA 313.A O no hydrogen 2.765 N/A LYS 318.A N LEU 314.A O no hydrogen 2.948 N/A LYS 318.A NZ TYR 297.A OH no hydrogen 3.380 N/A GLN 319.A N ILE 315.A O no hydrogen 2.936 N/A ARG 320.A N GLU 316.A O no hydrogen 3.087 N/A ARG 320.A NE LEU 539.A O no hydrogen 3.388 N/A ARG 320.A NH1 LEU 539.A O no hydrogen 3.455 N/A LEU 321.A N THR 317.A O no hydrogen 2.982 N/A GLU 322.A N LYS 318.A O no hydrogen 2.958 N/A ALA 323.A N GLN 319.A O no hydrogen 3.058 N/A ALA 324.A N ARG 320.A O no hydrogen 2.926 N/A GLY 325.A N GLU 322.A O no hydrogen 3.043 N/A HIS 326.A N LEU 321.A O no hydrogen 3.052 N/A HIS 326.A NE2 GLU 535.A OE1 no hydrogen 3.226 N/A THR 327.A N LEU 293.A O no hydrogen 3.008 N/A ILE 329.A N VAL 295.A O no hydrogen 2.892 N/A PHE 331.A N TYR 297.A O no hydrogen 2.925 N/A ASN 334.A N GLN 429.A OE1 no hydrogen 2.879 N/A ASN 334.A ND2 SER 425.A OG no hydrogen 3.035 N/A ASN 334.A ND2 GLN 429.A OE1 no hydrogen 3.037 N/A ASN 335.A ND2 ASN 334.A OD1 no hydrogen 2.705 N/A TYR 338.A OH GLU 418.A OE2 no hydrogen 2.539 N/A ALA 339.A N ASN 335.A O no hydrogen 3.042 N/A LEU 340.A N ILE 336.A O no hydrogen 2.959 N/A LEU 340.A N PRO 337.A O no hydrogen 3.159 N/A GLU 341.A N PRO 337.A O no hydrogen 2.644 N/A VAL 342.A N TYR 338.A O no hydrogen 2.925 N/A LEU 343.A N TYR 338.A O no hydrogen 3.104 N/A SER 344.A N ALA 339.A O no hydrogen 2.867 N/A SER 344.A OG ALA 339.A O no hydrogen 2.681 N/A THR 345.A N LEU 340.A O no hydrogen 3.231 N/A THR 345.A OG1 LEU 340.A O no hydrogen 3.037 N/A GLY 346.A N VAL 342.A O no hydrogen 3.042 N/A GLY 347.A N LEU 343.A O no hydrogen 2.843 N/A LEU 348.A N SER 344.A O no hydrogen 2.950 N/A PHE 349.A N THR 345.A O no hydrogen 2.878 N/A SER 350.A OG GLY 346.A O no hydrogen 2.545 N/A SER 350.A OG GLY 347.A O no hydrogen 3.383 N/A GLY 352.A N PHE 349.A O no hydrogen 2.760 N/A GLY 353.A N ASP 351.A OD1 no hydrogen 2.839 N/A ARG 354.A N ASP 351.A O no hydrogen 3.366 N/A SER 355.A N ASP 351.A OD2 no hydrogen 2.699 N/A SER 355.A OG ASP 351.A OD2 no hydrogen 2.644 N/A LEU 357.A N GLY 353.A O no hydrogen 2.909 N/A GLN 358.A N ARG 354.A O no hydrogen 3.337 N/A GLN 358.A N SER 355.A O no hydrogen 3.281 N/A GLN 358.A NE2 ARG 354.A O no hydrogen 2.840 N/A ASN 359.A N PHE 356.A O no hydrogen 3.275 N/A ASN 359.A ND2 CYS 237.A O no hydrogen 3.250 N/A ASN 359.A ND2 PHE 356.A O no hydrogen 3.054 N/A PHE 360.A N LEU 357.A O no hydrogen 2.921 N/A LYS 361.A N GLN 358.A O no hydrogen 3.417 N/A ASP 363.A N PHE 360.A O no hydrogen 2.985 N/A ASP 366.A N GLN 157.A OE1 no hydrogen 2.978 N/A CYS 368.A N ASP 366.A OD1 no hydrogen 2.765 N/A CYS 368.A SG SER 165.A O no hydrogen 3.358 N/A CYS 368.A SG ASP 366.A OD1 no hydrogen 3.214 N/A LEU 369.A N ASP 366.A O no hydrogen 3.061 N/A GLY 370.A N PRO 367.A O no hydrogen 3.109 N/A LEU 372.A N LEU 369.A O no hydrogen 3.281 N/A ILE 375.A N ASP 371.A O no hydrogen 2.841 N/A LEU 376.A N LEU 372.A O no hydrogen 2.892 N/A ARG 377.A N ILE 373.A O no hydrogen 2.859 N/A LEU 378.A N ILE 375.A O no hydrogen 3.326 N/A LYS 383.A N PRO 379.A O no hydrogen 2.993 N/A LYS 383.A NZ GLY 352.A O no hydrogen 3.270 N/A LYS 383.A NZ MET 404.A O no hydrogen 3.224 N/A ARG 384.A N SER 380.A O no hydrogen 3.286 N/A LEU 385.A N TRP 381.A O no hydrogen 2.919 N/A LEU 386.A N PHE 382.A O no hydrogen 3.215 N/A SER 387.A N LYS 383.A O no hydrogen 2.787 N/A SER 387.A OG ALA 398.A O no hydrogen 2.787 N/A LEU 388.A N ARG 384.A O no hydrogen 3.196 N/A LEU 389.A N LEU 385.A O no hydrogen 3.052 N/A LEU 390.A N LEU 386.A O no hydrogen 3.050 N/A PHE 394.A N LEU 390.A O no hydrogen 2.643 N/A ARG 396.A NE ASP 497.A OD1 no hydrogen 2.823 N/A ARG 396.A NH2 ASP 497.A OD1 no hydrogen 3.373 N/A ARG 396.A NH2 ASP 497.A OD2 no hydrogen 2.739 N/A ARG 396.A NH2 ASP 500.A OD2 no hydrogen 3.075 N/A ALA 398.A N PHE 394.A O no hydrogen 3.134 N/A ALA 399.A N PRO 395.A O no hydrogen 3.091 N/A PHE 400.A N ARG 396.A O no hydrogen 3.031 N/A LEU 401.A N LEU 397.A O no hydrogen 3.065 N/A ASN 402.A N ALA 398.A O no hydrogen 2.979 N/A ASN 403.A N ALA 399.A O no hydrogen 3.056 N/A ASN 403.A N PHE 400.A O no hydrogen 3.106 N/A ASN 403.A ND2 ALA 399.A O no hydrogen 2.817 N/A MET 404.A N LEU 401.A O no hydrogen 3.478 N/A ARG 407.A N SER 350.A O no hydrogen 3.216 N/A ARG 407.A NE SER 350.A O no hydrogen 3.264 N/A ARG 407.A NH1 ASN 403.A O no hydrogen 2.888 N/A ARG 407.A NH1 ARG 405.A O no hydrogen 2.931 N/A LYS 411.A N SER 408.A OG no hydrogen 3.257 N/A LEU 412.A N SER 408.A O no hydrogen 2.929 N/A TRP 413.A N ALA 409.A O no hydrogen 2.993 N/A TRP 413.A N GLU 410.A O no hydrogen 3.244 N/A LYS 414.A N GLU 410.A O no hydrogen 3.271 N/A LEU 415.A N LYS 411.A O no hydrogen 2.931 N/A GLN 416.A N LEU 412.A O no hydrogen 2.911 N/A HIS 417.A N TRP 413.A O no hydrogen 3.034 N/A GLU 418.A N LYS 414.A O no hydrogen 3.005 N/A ILE 419.A N LEU 415.A O no hydrogen 2.975 N/A GLU 420.A N GLN 416.A O no hydrogen 3.185 N/A MET 421.A N HIS 417.A O no hydrogen 2.825 N/A TYR 422.A N GLU 418.A O no hydrogen 2.810 N/A TYR 422.A OH ASN 334.A O no hydrogen 2.597 N/A ARG 423.A N ILE 419.A O no hydrogen 2.969 N/A ARG 423.A NE LEU 468.A O no hydrogen 2.839 N/A ARG 423.A NH1 ASP 469.A O no hydrogen 2.930 N/A GLN 424.A N GLU 420.A O no hydrogen 3.111 N/A SER 425.A N MET 421.A O no hydrogen 2.919 N/A VAL 426.A N TYR 422.A O no hydrogen 2.972 N/A ILE 427.A N ARG 423.A O no hydrogen 3.058 N/A ALA 428.A N GLN 424.A O no hydrogen 2.930 N/A GLN 429.A N SER 425.A O no hydrogen 2.915 N/A GLN 429.A NE2 LEU 332.A O no hydrogen 2.818 N/A TRP 430.A N VAL 426.A O no hydrogen 2.863 N/A LYS 431.A N ILE 427.A O no hydrogen 2.836 N/A ALA 432.A N ALA 428.A O no hydrogen 2.898 N/A MET 433.A N GLN 429.A O no hydrogen 3.392 N/A ASN 434.A N LYS 431.A O no hydrogen 2.925 N/A LEU 435.A N TRP 430.A O no hydrogen 3.308 N/A ASP 436.A N ARG 294.A O no hydrogen 2.939 N/A VAL 437.A N ARG 294.A O no hydrogen 3.360 N/A LEU 438.A N VAL 520.A O no hydrogen 2.840 N/A LEU 439.A N GLY 296.A O no hydrogen 2.795 N/A THR 440.A N GLN 518.A O no hydrogen 3.020 N/A THR 440.A OG1 PRO 441.A O no hydrogen 2.766 N/A ASP 448.A N ALA 506.A O no hydrogen 3.103 N/A LEU 449.A N SER 179.A O no hydrogen 3.124 N/A ASN 450.A N ASP 163.A OD1 no hydrogen 2.808 N/A THR 451.A N ASP 448.A O no hydrogen 3.239 N/A THR 451.A OG1 ASP 448.A O no hydrogen 2.589 N/A ARG 454.A N THR 451.A O no hydrogen 2.925 N/A ARG 454.A NH1 ASP 371.A OD2 no hydrogen 3.028 N/A ALA 455.A N PRO 452.A O no hydrogen 3.101 N/A ALA 458.A N ALA 455.A O no hydrogen 3.168 N/A VAL 459.A N THR 456.A O no hydrogen 3.292 N/A SER 460.A N GLY 457.A O no hydrogen 3.005 N/A SER 460.A OG ASP 301.A OD1 no hydrogen 2.767 N/A SER 460.A OG THR 304.A OG1 no hydrogen 2.741 N/A SER 460.A OG GLY 457.A O no hydrogen 3.401 N/A TYR 461.A OH THR 304.A O no hydrogen 2.549 N/A THR 462.A N VAL 459.A O no hydrogen 3.184 N/A THR 462.A OG1 GLY 207.A O no hydrogen 2.899 N/A THR 462.A OG1 VAL 459.A O no hydrogen 3.255 N/A MET 463.A N VAL 459.A O no hydrogen 2.832 N/A TYR 465.A N THR 462.A O no hydrogen 3.078 N/A TYR 465.A OH TYR 298.A OH no hydrogen 2.564 N/A ASN 466.A N MET 463.A O no hydrogen 2.964 N/A ASN 466.A ND2 ASP 205.A OD2 no hydrogen 2.971 N/A CYS 467.A N MET 463.A O no hydrogen 3.044 N/A CYS 467.A SG ALA 339.A O no hydrogen 3.637 N/A LEU 468.A N LEU 464.A O no hydrogen 3.032 N/A ASP 469.A N ASN 466.A O no hydrogen 3.006 N/A PHE 470.A N TYR 465.A O no hydrogen 3.099 N/A ALA 472.A N LYS 223.A O no hydrogen 2.973 N/A GLY 473.A N CYS 519.A O no hydrogen 2.844 N/A VAL 474.A N GLY 221.A O no hydrogen 2.929 N/A VAL 475.A N VAL 517.A O no hydrogen 3.153 N/A VAL 477.A N VAL 515.A O no hydrogen 2.958 N/A THR 478.A N VAL 515.A O no hydrogen 3.295 N/A THR 478.A OG1 THR 479.A O no hydrogen 3.447 N/A VAL 480.A N LEU 513.A O no hydrogen 2.867 N/A THR 481.A N ASP 484.A OD1 no hydrogen 3.063 N/A ASP 484.A N THR 481.A OG1 no hydrogen 3.137 N/A ASP 485.A N THR 481.A O no hydrogen 3.105 N/A ALA 486.A N ALA 482.A O no hydrogen 2.932 N/A GLN 487.A N GLU 483.A O no hydrogen 2.900 N/A MET 488.A N ASP 485.A O no hydrogen 3.252 N/A GLU 489.A N ALA 486.A O no hydrogen 3.202 N/A LEU 490.A N GLN 487.A O no hydrogen 3.144 N/A TYR 491.A N MET 488.A O no hydrogen 3.075 N/A TYR 491.A OH MET 305.A O no hydrogen 2.450 N/A TYR 494.A OH THR 300.A OG1 no hydrogen 2.568 N/A PHE 495.A N ASP 500.A OD1 no hydrogen 2.656 N/A GLY 496.A N ASP 500.A OD1 no hydrogen 2.675 N/A ASP 500.A N ASP 497.A OD2 no hydrogen 3.066 N/A ILE 501.A N ASP 497.A O no hydrogen 3.038 N/A ILE 502.A N ILE 498.A O no hydrogen 2.811 N/A LEU 503.A N TRP 499.A O no hydrogen 3.123 N/A LYS 504.A N ASP 500.A O no hydrogen 3.112 N/A LYS 505.A N ILE 501.A O no hydrogen 3.466 N/A ALA 506.A N ILE 502.A O no hydrogen 2.757 N/A MET 507.A N LEU 503.A O no hydrogen 2.968 N/A LYS 508.A N LYS 505.A O no hydrogen 3.252 N/A LYS 508.A NZ GLU 489.A OE1 no hydrogen 3.394 N/A LYS 508.A NZ GLU 489.A OE2 no hydrogen 2.797 N/A SER 510.A N ASP 485.A OD1 no hydrogen 3.053 N/A SER 510.A OG MET 507.A O no hydrogen 2.624 N/A SER 510.A OG LYS 508.A O no hydrogen 3.077 N/A GLY 512.A N VAL 480.A O no hydrogen 2.971 N/A LEU 513.A N SER 510.A O no hydrogen 2.994 N/A VAL 515.A N THR 478.A O no hydrogen 2.894 N/A VAL 517.A N VAL 475.A O no hydrogen 3.157 N/A GLN 518.A N THR 440.A O no hydrogen 2.950 N/A GLN 518.A NE2 THR 440.A OG1 no hydrogen 2.943 N/A GLN 518.A NE2 TYR 461.A O no hydrogen 3.119 N/A CYS 519.A N GLY 473.A O no hydrogen 2.772 N/A VAL 520.A N LEU 438.A O no hydrogen 2.923 N/A ALA 521.A N PRO 471.A O no hydrogen 3.186 N/A TRP 524.A N THR 225.A OG1 no hydrogen 2.897 N/A GLN 525.A N LEU 522.A O no hydrogen 3.211 N/A GLU 527.A N GLU 527.A OE1 no hydrogen 2.803 N/A CYS 529.A N GLN 525.A O no hydrogen 3.078 N/A CYS 529.A SG PRO 471.A O no hydrogen 3.980 N/A CYS 529.A SG CYS 519.A O no hydrogen 3.288 N/A LEU 530.A N GLU 526.A O no hydrogen 2.973 N/A ARG 531.A N GLU 527.A O no hydrogen 2.930 N/A ARG 531.A NH1 ARG 531.A O no hydrogen 3.325 N/A ARG 531.A NH1 GLU 535.A OE2 no hydrogen 2.860 N/A ARG 531.A NH2 ARG 291.A O no hydrogen 2.958 N/A PHE 532.A N LEU 528.A O no hydrogen 3.024 N/A MET 533.A N CYS 529.A O no hydrogen 2.901 N/A ARG 534.A N LEU 530.A O no hydrogen 2.699 N/A ARG 534.A NE TYR 287.A O no hydrogen 3.394 N/A ARG 534.A NH1 TYR 287.A O no hydrogen 2.847 N/A ARG 534.A NH1 SER 289.A O no hydrogen 2.940 N/A GLU 535.A N ARG 531.A O no hydrogen 2.975 N/A VAL 536.A N PHE 532.A O no hydrogen 2.953 N/A GLU 537.A N MET 533.A O no hydrogen 2.909 N/A GLN 538.A N ARG 534.A O no hydrogen 2.912 N/A LEU 539.A N GLU 535.A O no hydrogen 3.017 N/A MET 540.A N VAL 536.A O no hydrogen 2.987 N/A THR 541.A N GLU 537.A O no hydrogen 3.007 N/A THR 541.A OG1 GLU 537.A O no hydrogen 2.869 N/A LYS 544.A N THR 541.A O no hydrogen 3.261 N/A LYS 544.A NZ ARG 253.A O no hydrogen 3.200 N/A GLN 545.A N PRO 542.A O no hydrogen 3.103 N/A GLN 545.A NE2 ARG 534.A O no hydrogen 3.062 N/A GLN 545.A NE2 GLU 537.A OE2 no hydrogen 2.735 N/A