Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ciz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A N ASP 56.A OD1 no hydrogen 2.477 N/A SER 4.A N PHE 55.A O no hydrogen 2.979 N/A SER 4.A OG VAL 53.A O no hydrogen 2.623 N/A SER 4.A OG PHE 55.A O no hydrogen 3.357 N/A THR 6.A N TYR 275.A O no hydrogen 2.956 N/A TRP 7.A NE1 THR 54.A OG1 no hydrogen 2.821 N/A THR 8.A N CYS 273.A O no hydrogen 2.849 N/A THR 8.A OG1 ASN 272.A O no hydrogen 2.653 N/A ALA 10.A N THR 8.A OG1 no hydrogen 3.121 N/A THR 13.A OG1 SER 268.A OG no hydrogen 2.609 N/A ASN 25.A N SER 28.A OG no hydrogen 3.004 N/A ASN 25.A ND2 THR 398.A O no hydrogen 3.043 N/A LEU 27.A N ASN 25.A OD1 no hydrogen 2.949 N/A SER 28.A OG ASN 25.A OD1 no hydrogen 3.392 N/A SER 30.A N LEU 27.A O no hydrogen 3.209 N/A SER 30.A OG LEU 27.A O no hydrogen 2.599 N/A LEU 31.A N SER 28.A O no hydrogen 3.138 N/A LEU 32.A N SER 28.A O no hydrogen 3.061 N/A ARG 33.A N GLY 492.A O no hydrogen 2.930 N/A HIS 34.A N LEU 491.A O no hydrogen 3.061 N/A HIS 34.A ND1 LYS 490.A O no hydrogen 2.981 N/A HIS 35.A NE2 LEU 32.A O no hydrogen 3.004 N/A MET 37.A N HIS 34.A O no hydrogen 3.166 N/A VAL 38.A N HIS 35.A O no hydrogen 3.138 N/A TYR 39.A N PHE 146.A O no hydrogen 3.112 N/A ALA 40.A N SER 20.A O no hydrogen 2.975 N/A THR 41.A N GLU 144.A O no hydrogen 2.843 N/A THR 41.A OG1 LYS 142.A O no hydrogen 2.643 N/A THR 41.A OG1 GLU 144.A O no hydrogen 3.529 N/A SER 43.A N GLU 18.A OE1 no hydrogen 3.343 N/A SER 43.A N GLU 18.A OE2 no hydrogen 2.956 N/A SER 43.A OG GLU 18.A OE1 no hydrogen 2.555 N/A ARG 44.A N THR 42.A OG1 no hydrogen 3.206 N/A ARG 44.A NH2 GLU 18.A O no hydrogen 3.053 N/A SER 45.A N THR 42.A O no hydrogen 3.127 N/A SER 45.A OG THR 42.A O no hydrogen 3.030 N/A ALA 46.A N SER 43.A O no hydrogen 3.080 N/A ARG 49.A N SER 45.A O no hydrogen 3.275 N/A ARG 49.A NE ALA 156.A O no hydrogen 3.091 N/A ARG 49.A NH2 PRO 155.A O no hydrogen 2.747 N/A GLN 50.A N ALA 46.A O no hydrogen 2.896 N/A LYS 51.A N GLY 47.A O no hydrogen 3.152 N/A LYS 52.A N LEU 48.A O no hydrogen 3.203 N/A VAL 53.A N ARG 49.A O no hydrogen 2.915 N/A THR 54.A OG1 GLN 50.A O no hydrogen 2.575 N/A PHE 55.A N SER 4.A OG no hydrogen 3.072 N/A ARG 57.A N HIS 2.A O no hydrogen 3.013 N/A ARG 57.A NE HIS 2.A O no hydrogen 2.855 N/A ARG 57.A NH1 SER 225.A O no hydrogen 2.703 N/A ARG 57.A NH1 VAL 227.A O no hydrogen 2.829 N/A ARG 57.A NH2 ARG 277.A O no hydrogen 2.910 N/A GLN 59.A NE2 ASP 231.A OD1 no hydrogen 2.799 N/A GLN 59.A NE2 ASP 231.A OD2 no hydrogen 3.481 N/A GLN 59.A NE2 TYR 345.A O no hydrogen 2.867 N/A VAL 60.A N ARG 344.A O no hydrogen 2.860 N/A TYR 65.A N ASP 62.A OD1 no hydrogen 3.218 N/A ARG 66.A N ASP 62.A O no hydrogen 3.279 N/A ARG 66.A NH1 LEU 61.A O no hydrogen 2.899 N/A ARG 66.A NH2 ASP 63.A OD1 no hydrogen 3.286 N/A ASP 67.A N ASP 63.A O no hydrogen 2.824 N/A VAL 68.A N HIS 64.A O no hydrogen 3.150 N/A LEU 69.A N TYR 65.A O no hydrogen 2.981 N/A LYS 70.A N ARG 66.A O no hydrogen 2.933 N/A GLU 71.A N ASP 67.A O no hydrogen 3.207 N/A MET 72.A N VAL 68.A O no hydrogen 2.835 N/A LYS 73.A N LEU 69.A O no hydrogen 2.872 N/A ALA 74.A N LYS 70.A O no hydrogen 2.945 N/A LYS 75.A N GLU 71.A O no hydrogen 3.164 N/A ALA 76.A N MET 72.A O no hydrogen 2.915 N/A SER 77.A N LYS 73.A O no hydrogen 2.986 N/A SER 77.A OG.A ALA 74.A O no hydrogen 2.710 N/A SER 77.A OG.B LYS 73.A O no hydrogen 2.839 N/A THR 78.A N LYS 75.A O no hydrogen 3.017 N/A THR 78.A OG1 LYS 75.A O no hydrogen 2.678 N/A VAL 79.A N ALA 76.A O no hydrogen 3.074 N/A ALA 81.A N ASP 243.A O no hydrogen 2.975 N/A LYS 82.A N ASP 176.A OD2 no hydrogen 2.818 N/A LEU 84.A N MET 172.A O no hydrogen 2.991 N/A SER 85.A N GLU 88.A OE1 no hydrogen 2.929 N/A SER 85.A OG GLU 87.A OE1 no hydrogen 3.350 N/A GLU 88.A N SER 85.A OG no hydrogen 3.190 N/A ALA 89.A N SER 85.A O no hydrogen 3.130 N/A CYS 90.A N VAL 86.A O no hydrogen 2.759 N/A CYS 90.A SG VAL 86.A O no hydrogen 3.219 N/A LYS 91.A N GLU 87.A O no hydrogen 2.944 N/A LYS 91.A NZ ARG 110.A O no hydrogen 2.647 N/A LEU 92.A N ALA 89.A O no hydrogen 3.219 N/A THR 93.A N CYS 90.A O no hydrogen 3.044 N/A THR 93.A OG1 ALA 89.A O no hydrogen 3.486 N/A THR 93.A OG1 CYS 90.A O no hydrogen 3.339 N/A SER 97.A N PRO 94.A O no hydrogen 2.902 N/A SER 97.A OG ASP 558.A OD1 no hydrogen 2.505 N/A SER 97.A OG ASP 558.A OD2 no hydrogen 3.094 N/A SER 100.A N TYR 104.A O no hydrogen 2.876 N/A SER 100.A OG ASP 163.A OD1 no hydrogen 3.460 N/A SER 100.A OG ASP 163.A OD2 no hydrogen 2.738 N/A LYS 101.A N ASP 163.A OD1 no hydrogen 2.782 N/A PHE 102.A N SER 100.A OG no hydrogen 3.045 N/A TYR 104.A OH HIS 119.A ND1 no hydrogen 2.626 N/A GLY 105.A N ASP 108.A OD2 no hydrogen 2.809 N/A VAL 109.A N GLY 105.A O no hydrogen 3.142 N/A ARG 110.A N ALA 106.A O no hydrogen 2.917 N/A ARG 110.A NH1 LYS 91.A O no hydrogen 2.715 N/A ARG 110.A NH1 THR 93.A O no hydrogen 2.781 N/A ASN 111.A N LYS 107.A O no hydrogen 2.965 N/A LEU 112.A N VAL 109.A O no hydrogen 2.965 N/A SER 113.A N ASP 108.A O no hydrogen 2.964 N/A VAL 117.A N SER 113.A O no hydrogen 3.053 N/A ASN 118.A N SER 114.A O no hydrogen 2.896 N/A HIS 119.A N LYS 115.A O no hydrogen 3.158 N/A HIS 119.A ND1 TYR 104.A OH no hydrogen 2.626 N/A ILE 120.A N ALA 116.A O no hydrogen 2.872 N/A HIS 121.A N VAL 117.A O no hydrogen 2.921 N/A SER 122.A N ASN 118.A O no hydrogen 3.084 N/A SER 122.A OG HIS 119.A O no hydrogen 2.613 N/A VAL 123.A N HIS 119.A O no hydrogen 2.817 N/A TRP 124.A N ILE 120.A O no hydrogen 2.838 N/A TRP 124.A NE1 GLU 247.A OE2 no hydrogen 2.906 N/A LYS 125.A N HIS 121.A O no hydrogen 2.923 N/A LYS 125.A NZ GLU 129.A OE1 no hydrogen 2.770 N/A ASP 126.A N SER 122.A O no hydrogen 3.099 N/A LEU 127.A N VAL 123.A O no hydrogen 2.927 N/A LEU 128.A N TRP 124.A O no hydrogen 3.103 N/A GLU 129.A N LYS 125.A O no hydrogen 3.064 N/A ASP 130.A N ASP 126.A O no hydrogen 2.960 N/A VAL 132.A N ASP 130.A OD1 no hydrogen 2.879 N/A THR 133.A N ASP 130.A OD1 no hydrogen 3.072 N/A THR 133.A OG1 ASP 130.A OD1 no hydrogen 3.258 N/A THR 133.A OG1 ASP 130.A OD2 no hydrogen 2.622 N/A ILE 135.A N ARG 258.A O no hydrogen 2.866 N/A THR 137.A N PRO 264.A O no hydrogen 3.271 N/A THR 137.A OG1 PRO 264.A O no hydrogen 2.729 N/A THR 138.A N PHE 161.A O no hydrogen 2.853 N/A ILE 139.A N THR 266.A O no hydrogen 2.912 N/A MET 140.A N ILE 159.A O no hydrogen 2.926 N/A LYS 142.A N ARG 157.A O no hydrogen 2.806 N/A ASN 143.A ND2 GLU 18.A OE2 no hydrogen 2.903 N/A ASN 143.A ND2 THR 41.A O no hydrogen 2.914 N/A GLU 144.A N THR 41.A OG1 no hydrogen 3.047 N/A PHE 146.A N TYR 39.A O no hydrogen 2.968 N/A CYS 147.A SG MET 37.A O no hydrogen 3.803 N/A CYS 147.A SG VAL 148.A O no hydrogen 3.747 N/A VAL 148.A N MET 37.A O no hydrogen 2.830 N/A GLN 149.A N GLY 152.A O no hydrogen 2.937 N/A LYS 154.A N TYR 39.A OH no hydrogen 2.807 N/A ALA 156.A N SER 45.A OG no hydrogen 2.838 N/A ILE 159.A N MET 140.A O no hydrogen 2.898 N/A VAL 160.A N SER 281.A OG no hydrogen 3.119 N/A PHE 161.A N THR 138.A O no hydrogen 3.112 N/A GLY 165.A N ASP 163.A OD2 no hydrogen 3.343 N/A ARG 167.A N ASP 163.A O no hydrogen 3.112 N/A ARG 167.A NE ASP 558.A OD2 no hydrogen 2.887 N/A ARG 167.A NH1 PRO 162.A O no hydrogen 2.929 N/A ARG 167.A NH2 SER 97.A OG no hydrogen 2.816 N/A ARG 167.A NH2 ALA 98.A O no hydrogen 2.939 N/A VAL 168.A N LEU 164.A O no hydrogen 3.015 N/A CYS 169.A N GLY 165.A O no hydrogen 3.115 N/A CYS 169.A SG ILE 120.A O no hydrogen 3.641 N/A CYS 169.A SG GLY 165.A O no hydrogen 3.497 N/A GLU 170.A N VAL 166.A O no hydrogen 2.773 N/A LYS 171.A N ARG 167.A O no hydrogen 3.188 N/A LYS 171.A NZ ASP 558.A O no hydrogen 2.802 N/A LYS 171.A NZ ASP 558.A OD2 no hydrogen 3.301 N/A MET 172.A N VAL 168.A O no hydrogen 3.072 N/A ALA 173.A N CYS 169.A O no hydrogen 3.023 N/A LEU 174.A N GLU 170.A O no hydrogen 2.902 N/A TYR 175.A N LYS 171.A O no hydrogen 2.949 N/A TYR 175.A OH HIS 561.A NE2 no hydrogen 2.509 N/A VAL 178.A N LEU 174.A O no hydrogen 2.862 N/A SER 179.A N TYR 175.A O no hydrogen 3.132 N/A SER 179.A OG TYR 175.A O no hydrogen 2.601 N/A SER 179.A OG TYR 554.A OH no hydrogen 2.694 N/A THR 180.A N VAL 177.A O no hydrogen 3.192 N/A THR 180.A OG1 ASP 176.A O no hydrogen 2.692 N/A LEU 181.A N VAL 177.A O no hydrogen 2.843 N/A VAL 185.A N LEU 181.A O no hydrogen 2.922 N/A MET 186.A N PRO 182.A O no hydrogen 2.811 N/A GLY 187.A N GLN 183.A O no hydrogen 2.826 N/A SER 189.A N MET 186.A O no hydrogen 3.135 N/A SER 189.A OG MET 312.A O no hydrogen 2.912 N/A TYR 190.A N GLY 187.A O no hydrogen 3.106 N/A GLY 191.A N VAL 314.A O no hydrogen 2.873 N/A GLN 193.A NE2 GLY 187.A O no hydrogen 2.740 N/A GLN 193.A NE2 TYR 190.A O no hydrogen 2.780 N/A TYR 194.A N GLY 191.A O no hydrogen 3.293 N/A TYR 194.A OH SER 188.A O no hydrogen 2.655 N/A SER 195.A N GLN 198.A OE1 no hydrogen 2.922 N/A GLN 198.A N SER 195.A OG no hydrogen 3.320 N/A ARG 199.A N SER 195.A O no hydrogen 2.861 N/A ARG 199.A NH1 ASN 315.A OD1 no hydrogen 2.864 N/A ARG 199.A NH2 SER 364.A OG no hydrogen 3.004 N/A VAL 200.A N PRO 196.A O no hydrogen 3.002 N/A GLU 201.A N GLY 197.A O no hydrogen 2.926 N/A PHE 202.A N GLN 198.A O no hydrogen 2.927 N/A LEU 203.A N ARG 199.A O no hydrogen 2.961 N/A VAL 204.A N VAL 200.A O no hydrogen 2.837 N/A ASN 205.A N GLU 201.A O no hydrogen 2.775 N/A THR 206.A N PHE 202.A O no hydrogen 2.788 N/A THR 206.A OG1 PHE 202.A O no hydrogen 2.708 N/A TRP 207.A N LEU 203.A O no hydrogen 2.914 N/A LYS 208.A N VAL 204.A O no hydrogen 2.968 N/A SER 209.A N ASN 205.A O no hydrogen 3.020 N/A SER 209.A N THR 206.A O no hydrogen 3.142 N/A SER 209.A OG THR 206.A O no hydrogen 2.530 N/A LYS 210.A N TRP 207.A O no hydrogen 3.282 N/A LYS 210.A NZ ASP 309.A O no hydrogen 2.750 N/A LYS 210.A NZ ASP 309.A OD1 no hydrogen 3.513 N/A LYS 210.A NZ ASP 309.A OD2 no hydrogen 3.505 N/A LYS 210.A NZ THR 311.A OG1 no hydrogen 2.966 N/A LYS 211.A N GLU 324.A OE1 no hydrogen 3.035 N/A ASN 212.A N GLU 324.A OE2 no hydrogen 2.593 N/A MET 214.A N CYS 323.A O no hydrogen 2.955 N/A GLY 215.A N GLU 356.A O no hydrogen 2.894 N/A PHE 216.A N VAL 321.A O no hydrogen 2.960 N/A SER 217.A OG THR 363.A O no hydrogen 3.391 N/A TYR 218.A N LEU 319.A O no hydrogen 2.915 N/A TYR 218.A OH ALA 347.A O no hydrogen 2.636 N/A ARG 221.A N PRO 348.A O no hydrogen 3.072 N/A CYS 222.A SG LYS 52.A O no hydrogen 4.001 N/A SER 225.A OG VAL 53.A O no hydrogen 3.131 N/A THR 226.A N CYS 222.A O no hydrogen 3.177 N/A THR 226.A N PHE 223.A O no hydrogen 2.898 N/A THR 226.A OG1 PHE 223.A O no hydrogen 2.759 N/A VAL 227.A N ASP 224.A O no hydrogen 3.400 N/A THR 228.A N ASP 231.A OD2 no hydrogen 3.093 N/A THR 228.A OG1 GLN 59.A OE1 no hydrogen 2.805 N/A ASN 230.A ND2 GLN 59.A OE1 no hydrogen 3.428 N/A ASN 230.A ND2 TYR 65.A OH no hydrogen 3.168 N/A ASN 230.A ND2 ASP 231.A OD1 no hydrogen 3.278 N/A ASP 231.A N THR 228.A OG1 no hydrogen 3.060 N/A ILE 232.A N THR 228.A O no hydrogen 3.148 N/A ARG 233.A N GLU 229.A O no hydrogen 3.008 N/A ARG 233.A NE GLU 229.A OE2 no hydrogen 2.762 N/A ARG 233.A NH1 GLU 257.A OE2 no hydrogen 2.858 N/A ARG 233.A NH2 GLU 229.A OE2 no hydrogen 3.150 N/A ARG 233.A NH2 GLU 257.A OE1 no hydrogen 3.097 N/A VAL 234.A N ASN 230.A O no hydrogen 2.870 N/A GLU 235.A N ASP 231.A O no hydrogen 2.828 N/A GLU 236.A N ILE 232.A O no hydrogen 3.050 N/A SER 237.A N ARG 233.A O no hydrogen 2.885 N/A SER 237.A OG VAL 234.A O no hydrogen 2.642 N/A ILE 238.A N VAL 234.A O no hydrogen 3.048 N/A TYR 239.A N GLU 235.A O no hydrogen 3.010 N/A GLN 240.A N GLU 236.A O no hydrogen 2.979 N/A GLN 240.A NE2 GLU 236.A OE2 no hydrogen 2.770 N/A GLN 240.A NE2 ARG 249.A O no hydrogen 3.106 N/A CYS 241.A N ILE 238.A O no hydrogen 3.024 N/A CYS 241.A SG LYS 73.A O no hydrogen 3.740 N/A CYS 241.A SG SER 237.A O no hydrogen 3.263 N/A CYS 242.A N TYR 239.A O no hydrogen 3.085 N/A CYS 242.A SG ALA 76.A O no hydrogen 3.868 N/A CYS 242.A SG TYR 239.A O no hydrogen 3.280 N/A ASP 243.A N VAL 79.A O no hydrogen 2.790 N/A ARG 249.A N ALA 245.A O no hydrogen 2.947 N/A ARG 249.A NH1 GLN 240.A O no hydrogen 2.684 N/A ARG 249.A NH1 GLN 240.A OE1 no hydrogen 3.131 N/A ARG 249.A NH2 CYS 242.A O no hydrogen 2.789 N/A GLN 250.A N PRO 246.A O no hydrogen 2.936 N/A GLN 250.A NE2 LEU 128.A O no hydrogen 2.792 N/A ALA 251.A N GLU 247.A O no hydrogen 3.003 N/A ILE 252.A N ALA 248.A O no hydrogen 2.978 N/A LYS 253.A N ARG 249.A O no hydrogen 3.016 N/A SER 254.A N GLN 250.A O no hydrogen 3.020 N/A SER 254.A OG LEU 127.A O no hydrogen 2.799 N/A SER 254.A OG ASP 130.A O no hydrogen 2.720 N/A LEU 255.A N ALA 251.A O no hydrogen 2.823 N/A THR 256.A N ILE 252.A O no hydrogen 2.892 N/A THR 256.A OG1 ILE 252.A O no hydrogen 2.913 N/A GLU 257.A N LYS 253.A O no hydrogen 2.971 N/A ARG 258.A N SER 254.A O no hydrogen 2.867 N/A ARG 258.A NE THR 133.A O no hydrogen 2.614 N/A ARG 258.A NH1 ASP 126.A O no hydrogen 3.289 N/A ARG 258.A NH1 ASP 126.A OD2 no hydrogen 3.097 N/A ARG 258.A NH1 ASP 130.A O no hydrogen 2.892 N/A ARG 258.A NH2 ASP 126.A OD2 no hydrogen 3.068 N/A LEU 259.A N LEU 255.A O no hydrogen 2.825 N/A TYR 260.A N LEU 255.A O no hydrogen 2.899 N/A TYR 260.A OH GLU 170.A OE1 no hydrogen 2.785 N/A ILE 261.A N THR 256.A O no hydrogen 3.091 N/A GLY 263.A N ARG 276.A O no hydrogen 3.001 N/A LEU 265.A N GLY 274.A O no hydrogen 2.779 N/A THR 266.A N THR 137.A O no hydrogen 2.846 N/A THR 266.A OG1 ASP 136.A OD1 no hydrogen 2.559 N/A ASN 267.A N GLN 271.A O no hydrogen 2.874 N/A ASN 267.A ND2 LEU 11.A O no hydrogen 2.903 N/A ASN 267.A ND2 GLN 271.A OE1 no hydrogen 2.824 N/A SER 268.A N THR 13.A OG1 no hydrogen 3.236 N/A SER 268.A OG THR 13.A O no hydrogen 3.275 N/A SER 268.A OG THR 13.A OG1 no hydrogen 2.609 N/A SER 268.A OG PRO 14.A O no hydrogen 3.188 N/A LYS 269.A N ASN 267.A OD1 no hydrogen 2.809 N/A GLY 270.A N ASN 267.A O no hydrogen 3.076 N/A GLN 271.A N ASN 267.A OD1 no hydrogen 2.877 N/A ASN 272.A ND2 LEU 265.A O no hydrogen 3.126 N/A ASN 272.A ND2 GLY 274.A O no hydrogen 3.142 N/A CYS 273.A N LEU 265.A O no hydrogen 2.761 N/A CYS 273.A SG ALA 10.A O no hydrogen 3.875 N/A CYS 273.A SG LEU 11.A O no hydrogen 3.570 N/A TYR 275.A N THR 6.A O no hydrogen 2.818 N/A ARG 276.A N GLY 263.A O no hydrogen 2.944 N/A ARG 276.A NH1 LEU 259.A O no hydrogen 3.237 N/A ARG 276.A NH1 TYR 260.A O no hydrogen 3.173 N/A ARG 276.A NH1 CYS 278.A O no hydrogen 3.020 N/A ARG 276.A NH2 LEU 259.A O no hydrogen 2.654 N/A ARG 277.A N SER 4.A O no hydrogen 2.854 N/A ARG 277.A NH1 MET 3.A O no hydrogen 3.159 N/A CYS 278.A SG SER 4.A O no hydrogen 3.855 N/A CYS 278.A SG TYR 5.A OH no hydrogen 3.390 N/A CYS 278.A SG ARG 279.A O no hydrogen 3.876 N/A ARG 279.A N ASP 224.A O no hydrogen 3.158 N/A ARG 279.A NE ASN 290.A OD1 no hydrogen 2.761 N/A ARG 279.A NH1 GLU 235.A OE1 no hydrogen 2.855 N/A ARG 279.A NH2 GLU 235.A OE1 no hydrogen 3.336 N/A ARG 279.A NH2 GLU 235.A OE2 no hydrogen 2.410 N/A ARG 279.A NH2 ASN 290.A OD1 no hydrogen 3.219 N/A SER 281.A OG LEU 158.A O no hydrogen 3.010 N/A GLY 282.A N VAL 160.A O no hydrogen 2.779 N/A VAL 283.A N THR 286.A OG1 no hydrogen 3.089 N/A LEU 284.A N GLU 170.A OE1 no hydrogen 2.967 N/A THR 286.A N VAL 283.A O no hydrogen 3.208 N/A THR 286.A OG1 ALA 280.A O no hydrogen 2.843 N/A THR 286.A OG1 VAL 283.A O no hydrogen 2.983 N/A GLY 289.A N THR 285.A O no hydrogen 2.742 N/A ASN 290.A N THR 286.A O no hydrogen 3.097 N/A ASN 290.A ND2 ASP 224.A OD1 no hydrogen 2.954 N/A THR 291.A N SER 287.A O no hydrogen 2.965 N/A THR 291.A OG1 SER 287.A O no hydrogen 2.799 N/A LEU 292.A N CYS 288.A O no hydrogen 2.963 N/A THR 293.A N GLY 289.A O no hydrogen 2.912 N/A THR 293.A OG1 GLU 235.A OE2 no hydrogen 2.480 N/A THR 293.A OG1 GLY 289.A O no hydrogen 2.868 N/A CYS 294.A N ASN 290.A O no hydrogen 2.776 N/A TYR 295.A N THR 291.A O no hydrogen 2.866 N/A LEU 296.A N LEU 292.A O no hydrogen 2.786 N/A LYS 297.A N THR 293.A O no hydrogen 3.001 N/A LYS 297.A NZ ASP 231.A OD2 no hydrogen 2.791 N/A LYS 297.A NZ TYR 345.A O no hydrogen 2.839 N/A LYS 297.A NZ SER 346.A OG.A no hydrogen 2.862 N/A ALA 298.A N CYS 294.A O no hydrogen 2.880 N/A SER 299.A N TYR 295.A O no hydrogen 2.833 N/A SER 299.A OG TYR 295.A O no hydrogen 2.715 N/A ALA 300.A N LEU 296.A O no hydrogen 3.178 N/A ALA 301.A N LYS 297.A O no hydrogen 2.892 N/A CYS 302.A N ALA 298.A O no hydrogen 2.897 N/A CYS 302.A SG ALA 298.A O no hydrogen 3.269 N/A ARG 303.A N SER 299.A O no hydrogen 3.263 N/A ARG 303.A NH1 GLU 71.A OE2 no hydrogen 3.225 N/A ARG 303.A NH2 GLU 71.A OE1 no hydrogen 3.032 N/A ARG 303.A NH2 GLU 71.A OE2 no hydrogen 3.038 N/A ALA 304.A N ALA 300.A O no hydrogen 2.975 N/A ALA 305.A N ALA 301.A O no hydrogen 2.901 N/A LYS 306.A N ARG 303.A O no hydrogen 3.047 N/A LEU 307.A N CYS 302.A O no hydrogen 3.092 N/A THR 311.A N ILE 322.A O no hydrogen 2.815 N/A LEU 313.A N VAL 320.A O no hydrogen 2.844 N/A VAL 314.A N SER 189.A O no hydrogen 2.916 N/A ASN 315.A N ASP 318.A O no hydrogen 2.925 N/A GLY 316.A N THR 291.A OG1 no hydrogen 2.773 N/A ASP 318.A N ASN 315.A O no hydrogen 2.852 N/A VAL 320.A N LEU 313.A O no hydrogen 2.970 N/A VAL 321.A N PHE 216.A O no hydrogen 2.942 N/A ILE 322.A N THR 311.A O no hydrogen 2.857 N/A CYS 323.A N MET 214.A O no hydrogen 2.784 N/A CYS 323.A SG MET 214.A O no hydrogen 3.902 N/A CYS 323.A SG GLU 324.A O no hydrogen 3.998 N/A GLU 324.A N GLN 308.A O no hydrogen 2.861 N/A SER 325.A N ASN 212.A O no hydrogen 2.739 N/A SER 325.A OG ASP 331.A OD2 no hydrogen 2.647 N/A ALA 326.A N ASP 331.A OD1 no hydrogen 3.051 N/A GLY 327.A N SER 325.A OG no hydrogen 3.086 N/A GLU 330.A N GLU 330.A OE2 no hydrogen 2.768 N/A ASP 331.A N GLY 327.A O no hydrogen 2.954 N/A ALA 332.A N THR 328.A O no hydrogen 3.158 N/A ALA 333.A N GLN 329.A O no hydrogen 3.104 N/A SER 334.A N GLU 330.A O no hydrogen 3.007 N/A SER 334.A OG GLU 330.A O no hydrogen 3.066 N/A LEU 335.A N ASP 331.A O no hydrogen 3.065 N/A ARG 336.A N ALA 332.A O no hydrogen 3.116 N/A VAL 337.A N ALA 333.A O no hydrogen 3.134 N/A PHE 338.A N SER 334.A O no hydrogen 2.796 N/A THR 339.A N LEU 335.A O no hydrogen 2.879 N/A THR 339.A OG1 LEU 335.A O no hydrogen 2.694 N/A GLU 340.A N ARG 336.A O no hydrogen 3.010 N/A ALA 341.A N VAL 337.A O no hydrogen 2.911 N/A MET 342.A N PHE 338.A O no hydrogen 2.954 N/A THR 343.A N THR 339.A O no hydrogen 2.881 N/A THR 343.A OG1 THR 339.A O no hydrogen 2.775 N/A ARG 344.A N GLU 340.A O no hydrogen 3.013 N/A TYR 345.A N ALA 341.A O no hydrogen 3.005 N/A TYR 345.A OH ASP 62.A OD1 no hydrogen 2.645 N/A SER 346.A N THR 343.A O no hydrogen 2.963 N/A SER 346.A OG.A THR 226.A O no hydrogen 2.779 N/A SER 346.A OG.A TYR 345.A O no hydrogen 2.722 N/A SER 346.A OG.B THR 226.A O no hydrogen 2.989 N/A ALA 347.A N MET 342.A O no hydrogen 2.847 N/A GLY 350.A N ASP 219.A O no hydrogen 2.765 N/A ASP 351.A N ASP 219.A OD2 no hydrogen 3.460 N/A GLU 356.A N GLY 215.A O no hydrogen 2.729 N/A TYR 357.A N GLU 356.A OE1 no hydrogen 3.177 N/A TYR 357.A OH ASP 331.A OD2 no hydrogen 2.656 N/A GLU 360.A N ASP 358.A OD1 no hydrogen 3.095 N/A LEU 361.A N ASP 358.A O no hydrogen 2.963 N/A ILE 362.A N LEU 359.A O no hydrogen 3.030 N/A SER 364.A N SER 367.A O no hydrogen 2.861 N/A CYS 365.A N ASP 318.A OD1 no hydrogen 2.713 N/A CYS 365.A N ASP 318.A OD2 no hydrogen 3.152 N/A SER 367.A N SER 364.A O no hydrogen 3.184 N/A SER 367.A OG CYS 365.A O no hydrogen 2.956 N/A SER 367.A OG TYR 414.A OH no hydrogen 2.522 N/A ASN 368.A N THR 384.A O no hydrogen 2.898 N/A ASN 368.A ND2 VAL 369.A O no hydrogen 2.930 N/A SER 370.A N TYR 382.A O no hydrogen 3.042 N/A ALA 372.A N VAL 380.A O no hydrogen 2.870 N/A HIS 373.A N HIS 474.A O no hydrogen 2.907 N/A HIS 373.A ND1.A SER 475.A O no hydrogen 2.922 N/A HIS 373.A ND1.B GLY 377.A O no hydrogen 2.742 N/A ASP 374.A N LYS 378.A O no hydrogen 2.991 N/A SER 376.A N ASP 374.A OD1 no hydrogen 2.975 N/A SER 376.A OG ASP 374.A OD1 no hydrogen 2.695 N/A GLY 377.A N ASP 374.A O no hydrogen 2.976 N/A LYS 378.A N ASP 374.A OD1 no hydrogen 3.095 N/A ARG 379.A NH2 TYR 381.A OH no hydrogen 3.154 N/A VAL 380.A N ALA 372.A O no hydrogen 2.764 N/A TYR 382.A N SER 370.A O no hydrogen 3.061 N/A THR 384.A N ASN 368.A O no hydrogen 2.910 N/A THR 384.A OG1 GLU 480.A OE2 no hydrogen 2.684 N/A ARG 385.A NE ASP 386.A O no hydrogen 2.882 N/A THR 388.A N ASP 386.A OD1 no hydrogen 2.929 N/A THR 388.A OG1 ASP 386.A OD1 no hydrogen 2.670 N/A LEU 391.A N PRO 387.A O no hydrogen 2.882 N/A ALA 392.A N THR 388.A O no hydrogen 2.847 N/A ARG 393.A N THR 389.A O no hydrogen 2.866 N/A ARG 393.A NE VAL 145.A O no hydrogen 2.793 N/A ARG 393.A NH2 VAL 145.A O no hydrogen 3.107 N/A ALA 394.A N PRO 390.A O no hydrogen 2.908 N/A ALA 395.A N LEU 391.A O no hydrogen 2.953 N/A TRP 396.A N ALA 392.A O no hydrogen 3.158 N/A GLU 397.A N ARG 393.A O no hydrogen 3.011 N/A THR 398.A N ALA 394.A O no hydrogen 2.904 N/A THR 398.A N ALA 395.A O no hydrogen 3.278 N/A THR 398.A OG1 ALA 394.A O no hydrogen 2.783 N/A THR 398.A OG1 HIS 427.A NE2 no hydrogen 2.879 N/A ALA 399.A N TRP 396.A O no hydrogen 3.130 N/A ARG 400.A NE GLU 19.A OE1 no hydrogen 3.237 N/A ARG 400.A NE GLU 19.A OE2 no hydrogen 2.747 N/A ARG 400.A NH1 ALA 399.A O no hydrogen 3.392 N/A ARG 400.A NH2 GLU 19.A OE1 no hydrogen 2.760 N/A THR 402.A OG1 VAL 404.A O no hydrogen 2.842 N/A ASN 405.A N ASP 443.A O no hydrogen 2.917 N/A ASN 405.A ND2 ASP 443.A O no hydrogen 2.863 N/A SER 406.A N GLU 397.A OE2 no hydrogen 2.746 N/A SER 406.A OG GLU 397.A OE1 no hydrogen 3.244 N/A SER 406.A OG GLU 397.A OE2 no hydrogen 2.817 N/A TRP 407.A N GLU 397.A OE1 no hydrogen 2.970 N/A LEU 408.A N ASN 405.A O no hydrogen 3.205 N/A GLY 409.A N ASN 405.A O no hydrogen 3.385 N/A ASN 410.A N SER 406.A O no hydrogen 2.838 N/A ILE 411.A N TRP 407.A O no hydrogen 2.992 N/A ILE 412.A N LEU 408.A O no hydrogen 3.091 N/A MET 413.A N GLY 409.A O no hydrogen 2.915 N/A TYR 414.A N ASN 410.A O no hydrogen 2.796 N/A TYR 414.A OH SER 367.A OG no hydrogen 2.522 N/A THR 417.A N TYR 414.A O no hydrogen 3.036 N/A THR 417.A OG1 TYR 414.A O no hydrogen 2.804 N/A TRP 419.A NE1 THR 384.A OG1 no hydrogen 3.230 N/A ALA 420.A N THR 417.A OG1 no hydrogen 3.148 N/A ARG 421.A N THR 417.A O no hydrogen 3.275 N/A ARG 421.A NH1 LEU 473.A O no hydrogen 2.890 N/A ARG 421.A NH1 TYR 476.A OH no hydrogen 2.979 N/A MET 422.A N LEU 418.A O no hydrogen 3.010 N/A ILE 423.A N TRP 419.A O no hydrogen 2.958 N/A LEU 424.A N TRP 419.A O no hydrogen 3.399 N/A MET 425.A N ALA 420.A O no hydrogen 2.896 N/A THR 426.A OG1 MET 422.A O no hydrogen 2.755 N/A HIS 427.A N ILE 423.A O no hydrogen 2.820 N/A HIS 427.A NE2 THR 398.A OG1 no hydrogen 2.879 N/A PHE 428.A N LEU 424.A O no hydrogen 2.993 N/A PHE 429.A N MET 425.A O no hydrogen 2.997 N/A SER 430.A N THR 426.A O no hydrogen 3.073 N/A ILE 431.A N HIS 427.A O no hydrogen 3.168 N/A LEU 432.A N PHE 428.A O no hydrogen 2.929 N/A LEU 433.A N PHE 429.A O no hydrogen 2.992 N/A ALA 434.A N SER 430.A O no hydrogen 3.061 N/A GLN 435.A N ILE 431.A O no hydrogen 3.201 N/A GLN 435.A N LEU 432.A O no hydrogen 3.329 N/A GLU 436.A N LEU 433.A O no hydrogen 3.001 N/A GLN 437.A N LEU 432.A O no hydrogen 2.799 N/A LYS 440.A N GLN 437.A O no hydrogen 3.177 N/A LEU 442.A N ILE 453.A O no hydrogen 2.764 N/A CYS 444.A N TYR 451.A O no hydrogen 2.894 N/A ILE 446.A N ALA 449.A O no hydrogen 2.914 N/A TYR 447.A OH TYR 194.A O no hydrogen 2.542 N/A ALA 449.A N ILE 446.A O no hydrogen 3.117 N/A CYS 450.A N ILE 559.A O no hydrogen 2.756 N/A CYS 450.A SG.A CYS 444.A O no hydrogen 3.904 N/A CYS 450.A SG.B ILE 559.A O no hydrogen 3.569 N/A TYR 451.A N CYS 444.A O no hydrogen 2.838 N/A SER 452.A N SER 562.A OG no hydrogen 2.781 N/A ILE 453.A N LEU 442.A O no hydrogen 2.903 N/A ASP 457.A N GLU 454.A O no hydrogen 2.946 N/A LEU 458.A N PRO 455.A O no hydrogen 3.082 N/A GLN 460.A N GLN 460.A OE1 no hydrogen 2.982 N/A GLN 460.A NE2 ASP 457.A OD1 no hydrogen 3.149 N/A ILE 461.A N ASP 457.A O no hydrogen 3.040 N/A ILE 462.A N LEU 458.A O no hydrogen 2.932 N/A GLU 463.A N PRO 459.A O no hydrogen 3.038 N/A ARG 464.A N GLN 460.A O no hydrogen 3.032 N/A ARG 464.A NH1 ALA 541.A O no hydrogen 2.591 N/A ARG 464.A NH1 LEU 544.A O no hydrogen 2.717 N/A ARG 464.A NH2 LEU 544.A O no hydrogen 3.302 N/A LEU 465.A N ILE 461.A O no hydrogen 3.026 N/A HIS 466.A N ILE 462.A O no hydrogen 2.753 N/A HIS 466.A NE2 ILE 412.A O no hydrogen 2.726 N/A GLY 467.A N GLU 463.A O no hydrogen 2.827 N/A ALA 470.A N GLY 467.A O no hydrogen 3.361 N/A PHE 471.A N LEU 468.A O no hydrogen 3.076 N/A SER 472.A N SER 469.A O no hydrogen 2.892 N/A SER 472.A OG SER 469.A O no hydrogen 3.525 N/A HIS 474.A N HIS 373.A O no hydrogen 2.894 N/A HIS 474.A ND1 SER 475.A OG no hydrogen 2.666 N/A HIS 474.A NE2 ASP 374.A O no hydrogen 2.895 N/A SER 475.A OG HIS 474.A ND1 no hydrogen 2.666 N/A TYR 476.A OH PRO 416.A O no hydrogen 2.605 N/A SER 477.A OG SER 370.A OG no hydrogen 3.329 N/A GLU 480.A N SER 477.A OG no hydrogen 3.312 N/A ILE 481.A N SER 477.A O no hydrogen 2.947 N/A ASN 482.A N PRO 478.A O no hydrogen 2.870 N/A ARG 483.A N GLY 479.A O no hydrogen 3.057 N/A ARG 483.A NH1 ASN 368.A OD1 no hydrogen 3.206 N/A ARG 483.A NH2 ASN 368.A OD1 no hydrogen 2.755 N/A ARG 483.A NH2 GLU 480.A OE1 no hydrogen 3.018 N/A VAL 484.A N GLU 480.A O no hydrogen 2.994 N/A ALA 485.A N ILE 481.A O no hydrogen 2.906 N/A SER 486.A N ASN 482.A O no hydrogen 2.872 N/A CYS 487.A N ARG 483.A O no hydrogen 3.059 N/A CYS 487.A SG.A THR 388.A OG1 no hydrogen 3.474 N/A CYS 487.A SG.B ASP 386.A OD1 no hydrogen 3.516 N/A CYS 487.A SG.B ASP 386.A OD2 no hydrogen 3.468 N/A CYS 487.A SG.B THR 388.A OG1 no hydrogen 3.108 N/A CYS 487.A SG.B ARG 483.A O no hydrogen 3.213 N/A LEU 488.A N VAL 484.A O no hydrogen 2.986 N/A ARG 489.A N ALA 485.A O no hydrogen 3.056 N/A LYS 490.A N SER 486.A O no hydrogen 3.083 N/A LYS 490.A NZ THR 388.A OG1 no hydrogen 2.826 N/A LEU 491.A N CYS 487.A O no hydrogen 2.978 N/A VAL 493.A N LEU 488.A O no hydrogen 2.822 N/A VAL 498.A N PRO 495.A O no hydrogen 3.060 N/A TRP 499.A N PRO 495.A O no hydrogen 3.442 N/A ARG 500.A N LEU 496.A O no hydrogen 2.992 N/A ARG 500.A NH2 TRP 527.A O no hydrogen 2.908 N/A HIS 501.A N ARG 497.A O no hydrogen 3.189 N/A ARG 502.A N VAL 498.A O no hydrogen 2.912 N/A ARG 502.A NH1 SER 30.A O no hydrogen 2.634 N/A ARG 502.A NH2 SER 30.A O no hydrogen 3.486 N/A ALA 503.A N TRP 499.A O no hydrogen 2.813 N/A ARG 504.A N ARG 500.A O no hydrogen 3.183 N/A VAL 506.A N ARG 502.A O no hydrogen 2.915 N/A ARG 507.A N ALA 503.A O no hydrogen 2.739 N/A ALA 508.A N ARG 504.A O no hydrogen 3.062 N/A ARG 509.A N SER 505.A O no hydrogen 3.036 N/A LEU 510.A N VAL 506.A O no hydrogen 2.987 N/A LEU 511.A N ARG 507.A O no hydrogen 2.919 N/A SER 512.A N ALA 508.A O no hydrogen 3.023 N/A SER 512.A OG ALA 508.A O no hydrogen 3.078 N/A GLN 513.A N LEU 510.A O no hydrogen 3.049 N/A GLY 514.A N LEU 511.A O no hydrogen 3.266 N/A ARG 516.A NH1 GLU 454.A OE2 no hydrogen 3.161 N/A ARG 516.A NH2 GLU 454.A OE2 no hydrogen 3.154 N/A ARG 516.A NH2 ASP 457.A OD1 no hydrogen 2.785 N/A ALA 518.A N GLY 514.A O no hydrogen 3.312 N/A ALA 518.A N GLY 515.A O no hydrogen 3.261 N/A THR 519.A N GLY 515.A O no hydrogen 3.327 N/A THR 519.A OG1 GLY 515.A O no hydrogen 3.278 N/A CYS 520.A N ARG 516.A O no hydrogen 3.088 N/A CYS 520.A SG LEU 456.A O no hydrogen 3.789 N/A CYS 520.A SG ARG 516.A O no hydrogen 3.645 N/A GLY 521.A N ALA 517.A O no hydrogen 2.990 N/A LYS 522.A N ALA 518.A O no hydrogen 2.733 N/A TYR 523.A N THR 519.A O no hydrogen 2.825 N/A TYR 523.A OH THR 536.A O no hydrogen 2.503 N/A LEU 524.A N CYS 520.A O no hydrogen 2.952 N/A ASN 526.A ND2 LEU 533.A O no hydrogen 3.274 N/A ALA 528.A N PHE 525.A O no hydrogen 3.127 N/A LYS 532.A N LYS 530.A O no hydrogen 3.048 N/A LEU 533.A N ASN 526.A OD1 no hydrogen 3.005 N/A THR 536.A N TYR 523.A OH no hydrogen 3.165 N/A THR 536.A OG1 TYR 523.A OH no hydrogen 3.382 N/A ILE 538.A N GLU 463.A OE1 no hydrogen 2.940 N/A ALA 541.A N ILE 538.A O no hydrogen 3.031 N/A SER 542.A N PRO 539.A O no hydrogen 3.287 N/A SER 542.A OG PRO 539.A O no hydrogen 3.093 N/A ARG 543.A N ALA 540.A O no hydrogen 2.995 N/A LEU 544.A N ALA 541.A O no hydrogen 3.219 N/A SER 547.A N ASP 545.A OD1 no hydrogen 3.358 N/A SER 547.A OG ASP 545.A OD1 no hydrogen 2.813 N/A GLY 553.A N TYR 190.A OH no hydrogen 3.108 N/A TYR 554.A N TYR 447.A O no hydrogen 2.928 N/A TYR 554.A OH SER 179.A OG no hydrogen 2.694 N/A GLY 557.A N TYR 554.A O no hydrogen 2.745 N/A TYR 560.A N LEU 92.A O no hydrogen 2.817 N/A HIS 561.A N CYS 450.A O no hydrogen 2.749 N/A HIS 561.A ND1 TYR 451.A OH no hydrogen 2.957 N/A HIS 561.A NE2 TYR 175.A OH no hydrogen 2.509 N/A