Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3elq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 9.A N GLY 13.A O no hydrogen 2.910 N/A GLN 11.A N ASP 94.A OD2 no hydrogen 2.791 N/A GLN 11.A NE2 ASP 94.A OD1 no hydrogen 3.031 N/A GLY 13.A N ASP 30.A O no hydrogen 2.723 N/A ILE 16.A N LEU 28.A O no hydrogen 2.731 N/A ASP 18.A N THR 26.A O no hydrogen 2.794 N/A GLY 21.A N ASP 18.A O no hydrogen 3.236 N/A GLY 21.A N ASP 18.A OD1 no hydrogen 2.892 N/A ASN 22.A ND2 GLY 235.A O no hydrogen 2.761 N/A ALA 23.A N ASP 18.A OD1 no hydrogen 2.945 N/A THR 26.A N ALA 23.A O no hydrogen 3.276 N/A THR 26.A OG1 ALA 23.A O no hydrogen 2.759 N/A ALA 27.A N ILE 70.A O no hydrogen 2.950 N/A LEU 28.A N ILE 16.A O no hydrogen 2.723 N/A VAL 29.A N VAL 68.A O no hydrogen 2.824 N/A ASP 30.A N ALA 14.A O no hydrogen 2.707 N/A LEU 31.A N ASP 66.A O no hydrogen 3.045 N/A HIS 34.A N LEU 31.A O no hydrogen 3.010 N/A HIS 34.A ND1 GLU 87.A OE2 no hydrogen 2.626 N/A SER 37.A N LYS 86.A O no hydrogen 2.958 N/A SER 37.A OG LYS 86.A O no hydrogen 3.504 N/A LYS 40.A N GLU 84.A O no hydrogen 2.939 N/A VAL 41.A N TYR 55.A O no hydrogen 2.807 N/A THR 42.A N THR 82.A O no hydrogen 2.969 N/A VAL 43.A N ILE 53.A O no hydrogen 2.655 N/A HIS 44.A N LYS 80.A O no hydrogen 3.029 N/A HIS 44.A NE2 THR 82.A OG1 no hydrogen 2.784 N/A LYS 46.A N TYR 74.A OH no hydrogen 2.975 N/A LYS 46.A NZ GLU 185.A OE1 no hydrogen 3.175 N/A ILE 53.A N VAL 43.A O no hydrogen 2.880 N/A SER 54.A OG VAL 41.A O no hydrogen 3.462 N/A TYR 55.A N VAL 41.A O no hydrogen 2.955 N/A TYR 55.A OH PRO 69.A O no hydrogen 2.604 N/A VAL 57.A N VAL 39.A O no hydrogen 3.135 N/A GLY 58.A N PHE 563.A O no hydrogen 2.944 N/A GLN 59.A NE2 ILE 36.A O no hydrogen 2.927 N/A SER 61.A N GLY 58.A O no hydrogen 3.278 N/A SER 61.A OG LYS 564.A OXT no hydrogen 2.862 N/A LEU 62.A N GLY 58.A O no hydrogen 3.223 N/A LYS 63.A N GLN 59.A O no hydrogen 2.795 N/A THR 64.A N GLU 60.A O no hydrogen 2.764 N/A THR 64.A OG1 GLU 60.A O no hydrogen 2.574 N/A TYR 65.A N SER 61.A O no hydrogen 2.828 N/A TYR 65.A OH ASP 232.A OD2 no hydrogen 2.683 N/A GLY 67.A N LEU 62.A O no hydrogen 3.195 N/A VAL 68.A N VAL 29.A O no hydrogen 2.718 N/A ILE 70.A N ALA 27.A O no hydrogen 2.619 N/A PHE 71.A N TYR 55.A OH no hydrogen 2.764 N/A LEU 73.A N LEU 25.A O no hydrogen 3.427 N/A TYR 74.A N ASN 79.A OD1 no hydrogen 2.808 N/A LYS 76.A N SER 101.A O no hydrogen 2.861 N/A PHE 77.A N THR 100.A OG1 no hydrogen 3.230 N/A ASN 79.A N VAL 98.A O no hydrogen 3.016 N/A ASN 79.A ND2 TYR 74.A O no hydrogen 3.117 N/A ASN 79.A ND2 PHE 77.A O no hydrogen 3.205 N/A ASN 79.A ND2 VAL 98.A O no hydrogen 3.123 N/A VAL 81.A N TYR 96.A O no hydrogen 2.789 N/A THR 82.A N THR 42.A O no hydrogen 2.921 N/A THR 82.A OG1 HIS 44.A NE2 no hydrogen 2.784 N/A THR 82.A OG1 ASP 95.A OD1 no hydrogen 2.682 N/A VAL 83.A N ASP 94.A O no hydrogen 2.888 N/A GLU 84.A N LYS 40.A O no hydrogen 2.967 N/A TRP 85.A N MET 92.A O no hydrogen 3.030 N/A TRP 85.A NE1 GLU 87.A OE1 no hydrogen 3.111 N/A LYS 86.A N SER 37.A O no hydrogen 2.816 N/A GLU 87.A N LYS 90.A O no hydrogen 3.030 N/A LYS 90.A N GLU 87.A O no hydrogen 3.006 N/A MET 92.A N TRP 85.A O no hydrogen 2.786 N/A LYS 93.A NZ ASP 95.A OD2 no hydrogen 2.954 N/A ASP 94.A N VAL 83.A O no hydrogen 2.898 N/A TYR 96.A N VAL 81.A O no hydrogen 2.657 N/A VAL 98.A N ASN 79.A O no hydrogen 2.785 N/A THR 100.A N PHE 77.A O no hydrogen 3.190 N/A THR 100.A OG1 TYR 74.A O no hydrogen 2.582 N/A THR 100.A OG1 PHE 77.A O no hydrogen 3.379 N/A ILE 103.A N GLN 75.A OE1 no hydrogen 3.220 N/A ASN 105.A ND2 ASP 115.A O no hydrogen 2.804 N/A ASN 105.A ND2 ASP 545.A OD2 no hydrogen 3.371 N/A ASN 106.A N GLN 192.A OE1 no hydrogen 2.751 N/A ASN 106.A ND2 GLN 192.A OE1 no hydrogen 3.000 N/A TYR 107.A N ASN 105.A OD1 no hydrogen 2.961 N/A ASP 109.A N SER 112.A OG no hydrogen 3.342 N/A ARG 111.A N ASP 109.A OD1 no hydrogen 3.004 N/A ARG 111.A NE ASP 109.A OD1 no hydrogen 2.951 N/A ARG 111.A NH2 ASP 109.A OD2 no hydrogen 2.854 N/A ARG 111.A NH2 THR 141.A O no hydrogen 2.948 N/A SER 112.A N ASP 109.A O no hydrogen 2.896 N/A SER 112.A OG ASP 109.A O no hydrogen 3.340 N/A ILE 113.A N ASP 545.A O no hydrogen 2.730 N/A SER 114.A OG LEU 116.A O no hydrogen 3.466 N/A GLN 117.A NE2 HIS 138.A O no hydrogen 3.546 N/A GLN 117.A NE2 ASP 545.A OD1 no hydrogen 2.795 N/A GLN 118.A N LEU 543.A O no hydrogen 3.236 N/A GLN 118.A NE2 LEU 116.A O no hydrogen 2.907 N/A THR 119.A OG1 GLY 184.A O no hydrogen 2.688 N/A LYS 120.A N ASP 541.A O no hydrogen 2.921 N/A ILE 122.A N GLU 539.A O no hydrogen 2.829 N/A LYS 123.A N GLU 539.A O no hydrogen 3.033 N/A LYS 123.A NZ GLU 535.A OE2 no hydrogen 3.538 N/A LYS 123.A NZ VAL 536.A O no hydrogen 2.739 N/A ALA 125.A N LYS 537.A O no hydrogen 2.711 N/A GLY 127.A N GLU 129.A OE1 no hydrogen 2.881 N/A PHE 128.A N ALA 125.A O no hydrogen 3.230 N/A GLU 129.A N GLU 129.A OE1 no hydrogen 2.886 N/A ARG 131.A N PHE 128.A O no hydrogen 3.468 N/A ARG 131.A NE GLU 528.A OE2 no hydrogen 2.805 N/A ARG 131.A NH1 ASP 502.A OD2 no hydrogen 2.988 N/A ARG 131.A NH2 ASP 502.A OD1 no hydrogen 3.176 N/A ARG 131.A NH2 GLU 528.A OE1 no hydrogen 3.025 N/A TYR 133.A N VAL 180.A O no hydrogen 3.183 N/A TYR 133.A OH GLU 528.A OE2 no hydrogen 2.506 N/A LEU 134.A N LEU 555.A O no hydrogen 2.790 N/A VAL 135.A N PHE 178.A O no hydrogen 2.678 N/A ASN 136.A N ARG 553.A O no hydrogen 2.755 N/A ASN 136.A ND2 LEU 209.A O no hydrogen 3.129 N/A THR 137.A N PHE 176.A O no hydrogen 3.193 N/A THR 137.A OG1 HIS 551.A ND1 no hydrogen 2.788 N/A HIS 138.A N THR 137.A OG1 no hydrogen 2.713 N/A HIS 138.A NE2 LEU 209.A O no hydrogen 2.679 N/A THR 139.A N ALA 174.A O no hydrogen 2.845 N/A THR 139.A OG1 ASP 545.A OD1 no hydrogen 3.539 N/A THR 139.A OG1 ASP 545.A OD2 no hydrogen 2.809 N/A PHE 140.A N GLN 549.A OE1 no hydrogen 3.106 N/A GLY 144.A N THR 141.A OG1 no hydrogen 3.193 N/A SER 145.A OG PRO 170.A O no hydrogen 2.635 N/A TRP 149.A NE1 ASP 249.A OD1 no hydrogen 3.018 N/A GLY 151.A N PRO 164.A O no hydrogen 2.749 N/A LYS 153.A NZ GLY 158.A O no hydrogen 2.931 N/A LYS 153.A NZ ILE 159.A O no hydrogen 2.886 N/A LYS 153.A NZ ASP 161.A O no hydrogen 2.710 N/A ASN 156.A N ASP 154.A OD1 no hydrogen 2.859 N/A ALA 157.A N ASP 154.A O no hydrogen 2.959 N/A GLY 158.A N ASP 161.A OD2 no hydrogen 3.215 N/A ASP 161.A N GLY 158.A O no hydrogen 3.304 N/A THR 166.A N TRP 149.A O no hydrogen 3.132 N/A ALA 168.A N ASP 249.A OD2 no hydrogen 3.075 N/A PHE 171.A N ALA 168.A O no hydrogen 3.174 N/A ILE 173.A N GLY 207.A O no hydrogen 3.067 N/A PHE 176.A N THR 137.A O no hydrogen 2.705 N/A PHE 178.A N VAL 135.A O no hydrogen 3.403 N/A ILE 179.A N TRP 188.A O no hydrogen 3.189 N/A VAL 180.A N TYR 133.A O no hydrogen 2.923 N/A ASP 181.A N GLU 185.A O no hydrogen 2.966 N/A THR 182.A OG1 GLU 129.A O no hydrogen 2.724 N/A GLU 183.A N ASP 181.A OD1 no hydrogen 2.899 N/A GLY 184.A N ASP 181.A O no hydrogen 2.988 N/A GLU 185.A N ASP 181.A OD1 no hydrogen 2.863 N/A TYR 186.A OH GLN 117.A O no hydrogen 2.659 N/A ARG 187.A N ILE 179.A O no hydrogen 2.740 N/A ARG 187.A NE GLY 72.A O no hydrogen 2.868 N/A ARG 187.A NH1 VAL 51.A O no hydrogen 2.913 N/A ARG 187.A NH1 ASP 181.A OD2 no hydrogen 3.007 N/A ARG 187.A NH2 VAL 51.A O no hydrogen 3.184 N/A ARG 187.A NH2 GLY 72.A O no hydrogen 2.939 N/A TRP 188.A NE1 MET 233.A O no hydrogen 3.003 N/A LEU 190.A N THR 177.A O no hydrogen 3.069 N/A ASP 191.A N ASN 22.A O no hydrogen 2.799 N/A GLN 192.A NE2 ASN 105.A OD1 no hydrogen 3.090 N/A GLN 192.A NE2 PRO 175.A O no hydrogen 2.920 N/A ASP 193.A N ASP 191.A OD1 no hydrogen 3.135 N/A THR 194.A N ASP 191.A O no hydrogen 2.981 N/A THR 194.A OG1 ASP 191.A O no hydrogen 2.658 N/A TYR 196.A N GLN 192.A O no hydrogen 3.207 N/A TYR 196.A OH ASP 172.A OD1 no hydrogen 2.898 N/A ASP 197.A N LYS 205.A O no hydrogen 2.810 N/A GLY 198.A N TYR 107.A OH no hydrogen 2.889 N/A ARG 199.A N ASP 197.A OD1 no hydrogen 3.139 N/A ARG 199.A NH1 ASN 106.A O no hydrogen 2.834 N/A ARG 199.A NH2 ASN 106.A O no hydrogen 2.889 N/A ASP 200.A N ASP 197.A OD1 no hydrogen 3.142 N/A ASN 204.A N ASP 202.A OD1 no hydrogen 3.096 N/A ASN 204.A ND2 ASP 202.A OD1 no hydrogen 2.583 N/A LYS 205.A N ASP 202.A O no hydrogen 2.886 N/A ARG 206.A N ILE 203.A O no hydrogen 3.396 N/A ARG 206.A NE ASP 197.A O no hydrogen 3.146 N/A ARG 206.A NE ASP 200.A O no hydrogen 3.095 N/A ARG 206.A NH1 ASP 146.A OD1 no hydrogen 2.928 N/A ARG 206.A NH1 ASP 172.A OD2 no hydrogen 2.812 N/A ARG 206.A NH2 ASP 146.A OD2 no hydrogen 2.948 N/A ARG 206.A NH2 ASP 200.A O no hydrogen 2.868 N/A GLY 207.A N ASP 172.A OD1 no hydrogen 2.797 N/A MET 210.A N VAL 223.A O no hydrogen 2.908 N/A ARG 213.A N THR 221.A O no hydrogen 3.130 N/A ARG 213.A NH1 GLU 253.A OE2 no hydrogen 2.954 N/A THR 215.A N THR 219.A O no hydrogen 2.661 N/A THR 215.A OG1 THR 219.A O no hydrogen 3.417 N/A THR 215.A OG1 THR 219.A OG1 no hydrogen 2.674 N/A ARG 217.A N THR 215.A OG1 no hydrogen 2.962 N/A ARG 217.A NE GLU 230.A OE2 no hydrogen 3.267 N/A ARG 217.A NH1 GLU 256.A OE2 no hydrogen 3.134 N/A ARG 217.A NH2 GLU 230.A OE2 no hydrogen 2.899 N/A ARG 217.A NH2 GLU 256.A OE1 no hydrogen 2.834 N/A GLY 218.A N THR 215.A O no hydrogen 3.085 N/A THR 219.A N THR 215.A OG1 no hydrogen 3.267 N/A THR 219.A OG1 THR 215.A OG1 no hydrogen 2.674 N/A THR 219.A OG1 GLU 230.A OE2 no hydrogen 2.509 N/A PHE 220.A N PHE 231.A O no hydrogen 2.764 N/A THR 221.A N ARG 213.A O no hydrogen 2.966 N/A THR 221.A OG1 ARG 213.A O no hydrogen 3.403 N/A THR 221.A OG1 SER 254.A O no hydrogen 3.529 N/A THR 221.A OG1 SER 254.A OG no hydrogen 2.870 N/A ALA 222.A N TYR 229.A O no hydrogen 3.067 N/A VAL 223.A N MET 210.A O no hydrogen 2.926 N/A GLN 224.A N HIS 227.A O no hydrogen 3.087 N/A GLN 224.A NE2 PHE 195.A O no hydrogen 2.865 N/A GLN 226.A NE2 ASP 249.A OD1 no hydrogen 2.892 N/A HIS 227.A N GLN 224.A O no hydrogen 3.177 N/A HIS 227.A ND1 ASP 240.A OD1 no hydrogen 2.844 N/A HIS 227.A NE2 ASN 204.A OD1 no hydrogen 2.730 N/A TRP 228.A N HIS 241.A O no hydrogen 2.918 N/A TYR 229.A N ALA 222.A O no hydrogen 2.800 N/A GLU 230.A N GLU 239.A O no hydrogen 3.091 N/A PHE 231.A N PHE 220.A O no hydrogen 2.759 N/A ASP 232.A N GLN 236.A O no hydrogen 3.134 N/A MET 234.A N ASP 232.A OD1 no hydrogen 3.081 N/A GLY 235.A N ASP 232.A O no hydrogen 2.909 N/A GLN 236.A N ASP 232.A OD1 no hydrogen 3.108 N/A LEU 238.A N GLU 230.A O no hydrogen 2.860 N/A GLU 239.A N GLU 230.A O no hydrogen 3.242 N/A HIS 241.A N TRP 228.A O no hydrogen 2.890 N/A HIS 241.A NE2 GLU 239.A OE1 no hydrogen 2.764 N/A LEU 243.A N GLN 226.A O no hydrogen 2.949 N/A PHE 247.A N PRO 244.A O no hydrogen 3.041 N/A ALA 248.A N GLY 267.A O no hydrogen 2.961 N/A ASP 249.A N GLN 226.A OE1 no hydrogen 2.835 N/A ALA 250.A N GLY 225.A O no hydrogen 2.688 N/A THR 251.A N ARG 265.A O no hydrogen 3.198 N/A THR 251.A OG1 HIS 252.A ND1 no hydrogen 2.619 N/A HIS 252.A ND1 THR 251.A OG1 no hydrogen 2.619 N/A GLU 253.A N THR 251.A O no hydrogen 2.774 N/A SER 254.A OG GLY 211.A O no hydrogen 2.644 N/A SER 254.A OG THR 221.A OG1 no hydrogen 2.870 N/A ILE 255.A N LEU 263.A O no hydrogen 3.212 N/A THR 257.A N THR 261.A O no hydrogen 2.895 N/A THR 257.A OG1 THR 261.A O no hydrogen 3.460 N/A THR 257.A OG1 THR 261.A OG1 no hydrogen 2.623 N/A ASN 259.A N THR 257.A OG1 no hydrogen 3.183 N/A ASN 259.A ND2 TYR 355.A OH no hydrogen 3.393 N/A THR 261.A OG1 THR 257.A OG1 no hydrogen 2.623 N/A THR 261.A OG1 GLU 288.A OE2 no hydrogen 2.575 N/A VAL 262.A N VAL 289.A O no hydrogen 2.737 N/A LEU 263.A N ILE 255.A O no hydrogen 2.928 N/A LEU 264.A N LEU 287.A O no hydrogen 2.923 N/A ARG 265.A NE VAL 266.A O no hydrogen 3.416 N/A ARG 265.A NH1 THR 251.A OG1 no hydrogen 2.952 N/A ARG 265.A NH1 HIS 252.A ND1 no hydrogen 3.420 N/A ARG 265.A NH1 VAL 350.A O no hydrogen 2.875 N/A ARG 265.A NH2 ASP 249.A O no hydrogen 3.156 N/A ARG 265.A NH2 THR 251.A OG1 no hydrogen 2.823 N/A VAL 266.A N HIS 285.A O no hydrogen 2.932 N/A GLY 267.A N ALA 248.A O no hydrogen 2.838 N/A LYS 268.A N THR 281.A OG1 no hydrogen 2.938 N/A LYS 268.A NZ GLY 246.A O no hydrogen 3.002 N/A LYS 268.A NZ SER 269.A O no hydrogen 2.735 N/A SER 269.A N GLY 246.A O no hydrogen 2.925 N/A SER 269.A OG GLY 246.A O no hydrogen 2.805 N/A TYR 271.A N VAL 279.A O no hydrogen 2.759 N/A TYR 271.A OH THR 302.A OG1 no hydrogen 2.632 N/A ARG 273.A N VAL 277.A O no hydrogen 2.944 N/A ARG 273.A NE ASP 275.A OD1 no hydrogen 3.070 N/A ARG 273.A NH1 PRO 343.A O no hydrogen 2.937 N/A ARG 273.A NH2 ASP 275.A OD2 no hydrogen 3.178 N/A GLY 276.A N ARG 273.A O no hydrogen 2.683 N/A VAL 277.A N ASP 275.A OD1 no hydrogen 3.333 N/A HIS 278.A N GLU 152.A OE1 no hydrogen 2.682 N/A HIS 278.A ND1 GLU 152.A OE1 no hydrogen 2.687 N/A VAL 279.A N TYR 271.A O no hydrogen 2.959 N/A THR 280.A N THR 166.A OG1 no hydrogen 2.988 N/A THR 281.A N LYS 268.A O no hydrogen 2.857 N/A THR 281.A OG1 ASP 284.A OD1 no hydrogen 2.711 N/A THR 281.A OG1 HIS 285.A ND1 no hydrogen 3.293 N/A ARG 283.A NH1 ASP 337.A OD1 no hydrogen 3.453 N/A ARG 283.A NH1 ASP 337.A OD2 no hydrogen 2.929 N/A ARG 283.A NH2 ASP 337.A OD1 no hydrogen 2.854 N/A HIS 285.A N VAL 266.A O no hydrogen 3.130 N/A HIS 285.A ND1 ASP 284.A OD1 no hydrogen 2.622 N/A ILE 286.A N TRP 299.A O no hydrogen 2.993 N/A LEU 287.A N LEU 264.A O no hydrogen 2.917 N/A GLU 288.A N ASP 297.A O no hydrogen 2.827 N/A VAL 289.A N VAL 262.A O no hydrogen 2.930 N/A ASP 290.A N ARG 294.A O no hydrogen 3.073 N/A LYS 291.A NZ GLU 256.A OE2 no hydrogen 3.056 N/A SER 292.A N ASP 290.A OD1 no hydrogen 2.992 N/A GLY 293.A N ASP 290.A O no hydrogen 2.845 N/A ARG 294.A N ASP 290.A OD1 no hydrogen 2.901 N/A ARG 294.A NE ASP 290.A OD2 no hydrogen 3.289 N/A ARG 294.A NH1 ASP 290.A OD2 no hydrogen 3.179 N/A VAL 296.A N GLU 288.A O no hydrogen 2.607 N/A ASP 297.A N GLU 288.A O no hydrogen 3.148 N/A VAL 298.A N ASP 297.A OD1 no hydrogen 2.692 N/A TRP 299.A N ILE 286.A O no hydrogen 2.837 N/A TRP 299.A NE1 GLY 375.A O no hydrogen 3.102 N/A LEU 301.A N ASP 284.A O no hydrogen 3.047 N/A THR 302.A N ASP 300.A OD1 no hydrogen 3.010 N/A THR 302.A OG1 TYR 271.A OH no hydrogen 2.632 N/A THR 302.A OG1 ASP 300.A OD1 no hydrogen 2.790 N/A THR 302.A OG1 ASP 300.A OD2 no hydrogen 3.535 N/A LYS 303.A N ASP 300.A O no hydrogen 3.157 N/A LYS 303.A NZ TYR 271.A OH no hydrogen 2.846 N/A LYS 303.A NZ ASP 300.A OD2 no hydrogen 3.209 N/A ILE 304.A N LEU 301.A O no hydrogen 3.148 N/A LEU 305.A N LEU 301.A O no hydrogen 2.789 N/A LYS 308.A N ASP 306.A OD1 no hydrogen 2.876 N/A ARG 309.A N ASP 306.A O no hydrogen 3.377 N/A ARG 309.A NE LYS 388.A O no hydrogen 3.010 N/A ARG 309.A NH1 GLN 369.A OE1 no hydrogen 3.044 N/A ARG 309.A NH2 PRO 386.A O no hydrogen 3.279 N/A ARG 309.A NH2 LYS 388.A O no hydrogen 2.986 N/A GLY 314.A N ASP 310.A O no hydrogen 2.972 N/A ALA 315.A N LEU 312.A O no hydrogen 3.014 N/A ASP 317.A N ASP 446.A OD2 no hydrogen 3.037 N/A ALA 318.A N GLN 325.A O no hydrogen 2.856 N/A GLY 319.A N ASP 317.A OD1 no hydrogen 2.748 N/A ALA 320.A N ASP 317.A O no hydrogen 3.169 N/A GLY 324.A N ASP 317.A OD1 no hydrogen 3.110 N/A GLY 324.A N ASP 317.A OD2 no hydrogen 3.224 N/A GLN 326.A NE2 GLY 314.A O no hydrogen 3.025 N/A ALA 327.A N LEU 316.A O no hydrogen 2.743 N/A LYS 328.A NZ GLU 330.A OE2 no hydrogen 2.862 N/A THR 333.A OG1 GLU 330.A O no hydrogen 3.138 N/A GLY 336.A N GLY 344.A O no hydrogen 2.801 N/A GLY 342.A N PRO 307.A O no hydrogen 2.833 N/A ARG 345.A N GLY 342.A O no hydrogen 3.146 N/A ARG 345.A NE THR 333.A O no hydrogen 2.789 N/A ARG 345.A NH1 VAL 341.A O no hydrogen 2.633 N/A ARG 345.A NH2 THR 333.A O no hydrogen 3.340 N/A ASN 346.A N ALA 338.A O no hydrogen 2.901 N/A ASN 346.A ND2 HIS 349.A ND1 no hydrogen 2.968 N/A TRP 347.A N ARG 345.A O no hydrogen 2.855 N/A TRP 347.A NE1 ASP 284.A OD2 no hydrogen 3.097 N/A VAL 350.A N ARG 283.A O no hydrogen 3.118 N/A ASN 351.A N SER 365.A O no hydrogen 2.974 N/A ASN 351.A ND2 GLN 428.A O no hydrogen 3.095 N/A ILE 353.A N GLU 253.A OE1 no hydrogen 3.050 N/A ALA 354.A N ILE 363.A O no hydrogen 2.927 N/A TYR 355.A OH ASP 360.A OD1 no hydrogen 2.582 N/A ASP 356.A N SER 361.A O no hydrogen 2.814 N/A LYS 358.A N ASP 356.A OD1 no hydrogen 2.989 N/A ASP 359.A N ASP 356.A O no hydrogen 3.371 N/A SER 361.A N ASP 356.A O no hydrogen 3.327 N/A SER 361.A OG ASP 359.A OD1 no hydrogen 2.548 N/A ILE 362.A N ILE 374.A O no hydrogen 2.949 N/A ILE 363.A N ALA 354.A O no hydrogen 2.890 N/A LEU 364.A N VAL 372.A O no hydrogen 2.805 N/A SER 365.A N SER 352.A O no hydrogen 3.297 N/A SER 365.A OG ASN 351.A OD1 no hydrogen 2.787 N/A SER 366.A N GLY 370.A O no hydrogen 2.646 N/A SER 366.A OG ALA 348.A O no hydrogen 2.577 N/A ARG 367.A N HIS 349.A O no hydrogen 2.996 N/A ARG 367.A NH1 HIS 368.A NE2 no hydrogen 3.065 N/A HIS 368.A N ALA 348.A O no hydrogen 3.301 N/A HIS 368.A ND1 ASN 346.A O no hydrogen 2.894 N/A GLN 369.A N SER 366.A O no hydrogen 3.165 N/A GLN 369.A NE2 ARG 309.A O no hydrogen 3.071 N/A GLN 369.A NE2 TRP 347.A O no hydrogen 2.833 N/A GLY 370.A N SER 366.A O no hydrogen 2.732 N/A VAL 371.A N LEU 384.A O no hydrogen 3.241 N/A VAL 372.A N LEU 364.A O no hydrogen 3.017 N/A LYS 373.A N TRP 382.A O no hydrogen 2.871 N/A LYS 373.A NZ ASP 356.A OD2 no hydrogen 2.867 N/A LYS 373.A NZ ASP 359.A OD1 no hydrogen 3.500 N/A LYS 373.A NZ ASP 359.A OD2 no hydrogen 2.951 N/A LYS 373.A NZ GLU 470.A OE1 no hydrogen 3.383 N/A LYS 373.A NZ GLU 470.A OE2 no hydrogen 2.612 N/A ILE 374.A N ILE 362.A O no hydrogen 2.811 N/A GLY 375.A N GLN 379.A O no hydrogen 2.850 N/A ARG 376.A NE ASP 360.A OD2 no hydrogen 2.945 N/A ARG 376.A NH1 GLU 288.A OE1 no hydrogen 2.759 N/A ARG 376.A NH1 ASP 297.A OD2 no hydrogen 3.029 N/A ARG 376.A NH2 GLU 288.A OE1 no hydrogen 2.848 N/A ARG 376.A NH2 ASP 360.A OD1 no hydrogen 3.017 N/A LYS 378.A N GLY 375.A O no hydrogen 2.872 N/A LYS 378.A NZ ASP 297.A OD1 no hydrogen 3.133 N/A LYS 378.A NZ ASP 297.A OD2 no hydrogen 2.880 N/A LYS 378.A NZ ARG 376.A O no hydrogen 2.710 N/A GLN 379.A N ASP 377.A OD1 no hydrogen 2.776 N/A LYS 381.A N LYS 373.A O no hydrogen 2.821 N/A LYS 381.A NZ ASP 377.A OD1 no hydrogen 3.258 N/A LYS 381.A NZ ASP 377.A OD2 no hydrogen 2.577 N/A LYS 381.A NZ GLN 379.A OE1.A no hydrogen 3.565 N/A TRP 382.A NE1 GLU 470.A OE2 no hydrogen 3.227 N/A ILE 383.A N LYS 397.A O no hydrogen 3.111 N/A LEU 384.A N VAL 371.A O no hydrogen 2.728 N/A LYS 388.A N GLU 413.A O no hydrogen 2.980 N/A LYS 388.A NZ GLU 413.A OE2 no hydrogen 3.282 N/A TRP 390.A N SER 387.A O no hydrogen 3.392 N/A ALA 395.A N GLU 391.A O no hydrogen 2.818 N/A SER 396.A OG PRO 393.A O no hydrogen 3.082 N/A LYS 397.A N LEU 394.A O no hydrogen 2.799 N/A LYS 397.A NZ VAL 380.A O no hydrogen 2.828 N/A LEU 398.A N ALA 395.A O no hydrogen 3.253 N/A LEU 399.A N ILE 383.A O no hydrogen 2.804 N/A LYS 400.A N GLY 473.A O no hydrogen 2.942 N/A LYS 400.A NZ LYS 472.A O no hydrogen 3.552 N/A LYS 400.A NZ GLY 473.A O no hydrogen 3.463 N/A VAL 402.A N VAL 475.A O no hydrogen 2.993 N/A ASP 403.A N LYS 407.A O no hydrogen 2.971 N/A ASN 405.A N ASP 403.A OD1 no hydrogen 2.985 N/A GLY 406.A N ASP 403.A O no hydrogen 2.933 N/A LYS 407.A N ASP 403.A OD1 no hydrogen 2.853 N/A ILE 409.A N PRO 401.A O no hydrogen 3.108 N/A ASN 412.A N LEU 416.A O no hydrogen 2.965 N/A GLY 415.A N ASN 412.A O no hydrogen 3.043 N/A LEU 416.A N ASN 412.A OD1 no hydrogen 2.921 N/A CYS 417.A SG GLY 415.A O no hydrogen 4.045 N/A CYS 417.A SG PHE 422.A O no hydrogen 3.612 N/A GLU 418.A N THR 410.A O no hydrogen 2.838 N/A PHE 422.A N SER 420.A OG no hydrogen 3.135 N/A ASP 423.A N GLN 477.A OE1 no hydrogen 3.064 N/A THR 425.A OG1 GLN 428.A OE1 no hydrogen 2.877 N/A TYR 426.A N ASP 443.A OD1 no hydrogen 2.884 N/A TYR 426.A OH ASN 414.A O no hydrogen 3.267 N/A TYR 426.A OH ASP 423.A OD1 no hydrogen 3.202 N/A THR 427.A OG1 TYR 426.A O no hydrogen 2.693 N/A THR 427.A OG1 ASP 446.A O no hydrogen 3.382 N/A GLN 428.A NE2 SER 365.A OG no hydrogen 3.021 N/A GLN 428.A NE2 SER 366.A O no hydrogen 2.861 N/A HIS 429.A N PHE 442.A O no hydrogen 2.963 N/A HIS 429.A ND1 ASN 444.A OD1 no hydrogen 2.778 N/A ALA 431.A N SER 352.A OG no hydrogen 3.153 N/A TRP 432.A N THR 440.A O no hydrogen 3.013 N/A TRP 432.A NE1 GLU 253.A OE1 no hydrogen 3.241 N/A SER 434.A N THR 438.A O no hydrogen 2.870 N/A SER 434.A OG THR 438.A O no hydrogen 3.467 N/A SER 434.A OG THR 438.A OG1 no hydrogen 2.738 N/A LYS 436.A N SER 434.A OG no hydrogen 3.260 N/A LYS 436.A NZ TYR 499.A OH no hydrogen 3.023 N/A GLY 437.A N SER 434.A O no hydrogen 2.918 N/A THR 438.A OG1 SER 434.A OG no hydrogen 2.738 N/A THR 438.A OG1 GLU 465.A OE2 no hydrogen 2.587 N/A LEU 439.A N TYR 466.A O no hydrogen 3.026 N/A THR 440.A N TRP 432.A O no hydrogen 2.892 N/A THR 440.A OG1 TRP 432.A O no hydrogen 3.507 N/A ILE 441.A N VAL 464.A O no hydrogen 2.898 N/A PHE 442.A N HIS 429.A O no hydrogen 3.100 N/A ASP 443.A N ARG 462.A O no hydrogen 2.800 N/A ASN 444.A ND2 SER 491.A O no hydrogen 2.905 N/A ASN 444.A ND2 THR 494.A O no hydrogen 2.923 N/A GLY 445.A N TYR 426.A O no hydrogen 3.106 N/A ASP 446.A N THR 427.A OG1 no hydrogen 3.268 N/A ARG 448.A NH1 ASP 423.A OD2 no hydrogen 2.901 N/A ARG 448.A NH1 ASP 443.A OD2 no hydrogen 2.959 N/A ARG 448.A NH2 ASP 443.A OD2 no hydrogen 3.109 N/A ARG 448.A NH2 TYR 460.A O no hydrogen 3.046 N/A LEU 450.A N GLY 447.A O no hydrogen 2.908 N/A GLU 451.A N ARG 448.A O no hydrogen 3.387 N/A GLN 452.A N GLN 326.A OE1 no hydrogen 3.479 N/A GLN 452.A NE2 ALA 315.A O no hydrogen 2.941 N/A GLN 452.A NE2 ASP 446.A OD1 no hydrogen 2.869 N/A MET 458.A N LEU 455.A O no hydrogen 3.073 N/A LYS 459.A N PRO 456.A O no hydrogen 3.339 N/A LYS 459.A NZ ASP 317.A OD2 no hydrogen 3.243 N/A LYS 459.A NZ ASP 446.A OD1 no hydrogen 2.860 N/A LYS 459.A NZ GLN 452.A OE1 no hydrogen 2.700 N/A SER 461.A OG ASN 444.A O no hydrogen 2.657 N/A SER 461.A OG SER 491.A O no hydrogen 3.440 N/A ARG 462.A N ASP 443.A O no hydrogen 2.966 N/A ARG 462.A NE ASP 443.A OD2 no hydrogen 3.001 N/A ARG 462.A NH1 GLN 477.A OE1 no hydrogen 2.961 N/A ARG 462.A NH1 GLU 480.A OE1 no hydrogen 3.164 N/A ARG 462.A NH2 ASP 423.A O no hydrogen 3.044 N/A ARG 462.A NH2 ASP 443.A OD2 no hydrogen 3.154 N/A PHE 463.A N TYR 481.A O no hydrogen 2.792 N/A VAL 464.A N ILE 441.A O no hydrogen 3.030 N/A GLU 465.A N TRP 479.A O no hydrogen 2.942 N/A TYR 466.A N LEU 439.A O no hydrogen 2.852 N/A TYR 466.A OH ASP 423.A O no hydrogen 2.628 N/A LYS 467.A N GLN 476.A O no hydrogen 2.756 N/A ASP 469.A N THR 474.A O no hydrogen 2.892 N/A LYS 472.A N ASP 469.A OD1 no hydrogen 2.819 N/A GLY 473.A N ASP 469.A O no hydrogen 2.843 N/A THR 474.A N ASP 469.A O no hydrogen 3.198 N/A VAL 475.A N LYS 400.A O no hydrogen 3.058 N/A GLN 476.A N LYS 467.A O no hydrogen 2.836 N/A GLN 477.A NE2 ASP 421.A O no hydrogen 3.213 N/A VAL 478.A N GLU 465.A O no hydrogen 3.020 N/A TRP 479.A NE1 TYR 531.A O no hydrogen 2.908 N/A TYR 481.A N PHE 463.A O no hydrogen 2.914 N/A LYS 483.A NZ TYR 460.A OH no hydrogen 3.271 N/A ARG 485.A N GLY 482.A O no hydrogen 3.069 N/A ARG 485.A NH1 TYR 481.A OH no hydrogen 2.957 N/A ARG 485.A NH1 GLU 539.A OE2 no hydrogen 3.073 N/A ARG 485.A NH2 GLU 539.A OE1 no hydrogen 3.226 N/A ARG 485.A NH2 GLU 539.A OE2 no hydrogen 3.423 N/A PHE 489.A N GLY 486.A O no hydrogen 2.938 N/A TYR 490.A N TYR 487.A O no hydrogen 3.361 N/A SER 491.A N SER 461.A OG no hydrogen 2.933 N/A ILE 493.A N SER 512.A OG no hydrogen 3.063 N/A THR 494.A OG1 ILE 493.A O no hydrogen 3.033 N/A THR 494.A OG1 HIS 551.A O no hydrogen 2.646 N/A THR 494.A OG1 TYR 552.A O no hydrogen 3.436 N/A SER 495.A N TYR 552.A O no hydrogen 3.080 N/A SER 495.A OG ILE 493.A O no hydrogen 2.980 N/A ILE 496.A N PHE 509.A O no hydrogen 3.033 N/A ILE 497.A N THR 430.A OG1 no hydrogen 3.129 N/A GLU 498.A N PHE 507.A O no hydrogen 3.020 N/A TYR 499.A OH ASN 504.A OD1 no hydrogen 2.498 N/A GLN 500.A N THR 505.A O no hydrogen 2.762 N/A GLN 500.A NE2 GLU 498.A O no hydrogen 2.894 N/A GLN 500.A NE2 GLU 498.A OE1 no hydrogen 2.901 N/A ARG 503.A NH1 ASP 130.A OD1 no hydrogen 2.854 N/A ARG 503.A NH2 ASP 130.A OD1 no hydrogen 3.149 N/A ARG 503.A NH2 ASP 130.A OD2 no hydrogen 2.856 N/A THR 505.A N GLN 500.A O no hydrogen 3.111 N/A THR 505.A OG1 GLU 528.A OE1 no hydrogen 2.688 N/A MET 506.A N ILE 529.A O no hydrogen 2.852 N/A PHE 507.A N GLU 498.A O no hydrogen 2.943 N/A GLY 508.A N ASN 527.A O no hydrogen 2.841 N/A PHE 509.A N ILE 496.A O no hydrogen 2.866 N/A GLY 510.A N LYS 525.A O no hydrogen 3.130 N/A GLY 511.A N SER 495.A OG no hydrogen 3.028 N/A SER 512.A N SER 491.A OG no hydrogen 3.304 N/A SER 512.A OG ILE 493.A O no hydrogen 2.862 N/A ILE 513.A N VAL 523.A O no hydrogen 3.083 N/A HIS 514.A NE2 ASP 488.A OD1 no hydrogen 3.025 N/A LEU 515.A N SER 512.A O no hydrogen 3.241 N/A ASP 517.A N HIS 514.A O no hydrogen 3.063 N/A GLY 519.A N ASN 548.A OD1 no hydrogen 2.840 N/A GLN 520.A N ASP 517.A O no hydrogen 2.940 N/A THR 522.A N SER 544.A OG no hydrogen 2.856 N/A VAL 523.A N ILE 513.A O no hydrogen 2.817 N/A GLY 524.A N VAL 542.A O no hydrogen 2.701 N/A LYS 525.A N GLY 510.A O no hydrogen 2.855 N/A LYS 525.A NZ GLU 539.A OE1 no hydrogen 3.052 N/A LYS 525.A NZ ASP 541.A OD1 no hydrogen 2.585 N/A LYS 525.A NZ ASP 541.A OD2 no hydrogen 3.120 N/A LEU 526.A N ILE 540.A O no hydrogen 2.716 N/A ASN 527.A N GLY 508.A O no hydrogen 2.902 N/A ASN 527.A ND2 VAL 538.A O no hydrogen 3.036 N/A ASN 527.A ND2 GLU 539.A OE2 no hydrogen 2.899 N/A GLU 528.A N VAL 538.A O no hydrogen 3.063 N/A ILE 529.A N MET 506.A O no hydrogen 2.985 N/A ASP 530.A N GLU 535.A O no hydrogen 2.849 N/A TYR 531.A N ASN 504.A O no hydrogen 2.809 N/A TYR 531.A OH GLU 465.A OE1 no hydrogen 2.521 N/A LYS 532.A N ASP 530.A OD1 no hydrogen 2.796 N/A THR 533.A N ASP 530.A OD1 no hydrogen 3.135 N/A LYS 534.A N ASP 530.A O no hydrogen 2.855 N/A LYS 534.A NZ GLU 480.A O no hydrogen 3.302 N/A GLU 535.A N THR 533.A OG1 no hydrogen 2.966 N/A LYS 537.A N GLU 528.A O no hydrogen 2.762 N/A LYS 537.A NZ GLU 535.A OE1 no hydrogen 2.792 N/A VAL 538.A N GLU 528.A O no hydrogen 3.152 N/A GLU 539.A N LYS 123.A O no hydrogen 2.778 N/A ILE 540.A N LEU 526.A O no hydrogen 2.997 N/A ASP 541.A N LYS 120.A O no hydrogen 2.927 N/A VAL 542.A N GLY 524.A O no hydrogen 2.643 N/A LEU 543.A N GLN 118.A O no hydrogen 2.767 N/A SER 544.A N THR 522.A O no hydrogen 2.979 N/A SER 544.A OG LYS 546.A O no hydrogen 2.538 N/A LYS 546.A NZ TYR 107.A O no hydrogen 2.601 N/A LYS 546.A NZ THR 139.A OG1 no hydrogen 2.701 N/A LYS 546.A NZ PHE 140.A O no hydrogen 2.898 N/A ASN 548.A N GLN 520.A O no hydrogen 3.057 N/A ASN 548.A ND2 LEU 515.A O no hydrogen 2.612 N/A ASN 548.A ND2 ASP 517.A O no hydrogen 3.030 N/A GLN 549.A N THR 522.A OG1 no hydrogen 2.989 N/A GLN 549.A NE2 ASP 545.A OD1 no hydrogen 3.017 N/A THR 550.A OG1 GLY 511.A O no hydrogen 3.254 N/A THR 550.A OG1 HIS 551.A O no hydrogen 2.879 N/A HIS 551.A N GLY 511.A O no hydrogen 2.881 N/A HIS 551.A ND1 THR 137.A OG1 no hydrogen 2.788 N/A HIS 551.A NE2 THR 522.A O no hydrogen 3.108 N/A TYR 552.A N ASN 136.A O no hydrogen 3.209 N/A TYR 552.A OH HIS 252.A O no hydrogen 2.709 N/A ARG 553.A N ASN 136.A O no hydrogen 3.201 N/A ARG 553.A NH1 GLU 253.A OE2 no hydrogen 2.996 N/A ARG 553.A NH2 GLU 253.A OE1 no hydrogen 3.149 N/A ARG 553.A NH2 ASN 351.A O no hydrogen 3.219 N/A LEU 555.A N LEU 134.A O no hydrogen 2.767 N/A VAL 557.A N LEU 132.A O no hydrogen 3.042 N/A ARG 558.A NH1 GLN 500.A OE1 no hydrogen 3.264 N/A ARG 558.A NH2 GLN 500.A OE1 no hydrogen 2.869 N/A ARG 558.A NH2 ASP 502.A OD1 no hydrogen 3.332 N/A ARG 558.A NH2 ASP 502.A OD2 no hydrogen 3.178 N/A GLN 561.A N ARG 558.A O no hydrogen 2.866 N/A MET 562.A N PRO 559.A O no hydrogen 3.087 N/A