Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5hmx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N ASN 1.A O no hydrogen 3.423 N/A ILE 5.A N ASN 1.A O no hydrogen 3.427 N/A GLY 6.A N MET 2.A O no hydrogen 2.774 N/A ARG 8.A NH1 CYS 167.A O no hydrogen 3.024 N/A ARG 8.A NH1 LEU 272.A O no hydrogen 2.901 N/A ARG 8.A NH2 VAL 4.A O no hydrogen 3.052 N/A ARG 8.A NH2 LEU 272.A O no hydrogen 2.802 N/A ILE 9.A N ILE 5.A O no hydrogen 3.273 N/A LYS 10.A N GLY 6.A O no hydrogen 2.807 N/A LYS 10.A NZ GLU 14.A OE1 no hydrogen 2.956 N/A ARG 11.A N GLU 7.A O no hydrogen 3.064 N/A ARG 11.A NE GLU 7.A OE2 no hydrogen 2.996 N/A ILE 12.A N ARG 8.A O no hydrogen 3.186 N/A LYS 13.A N ILE 9.A O no hydrogen 2.779 N/A GLU 14.A N LYS 10.A O no hydrogen 2.941 N/A GLU 15.A N ARG 11.A O no hydrogen 3.109 N/A HIS 16.A N ILE 12.A O no hydrogen 2.918 N/A THR 19.A N HIS 16.A O no hydrogen 3.250 N/A HIS 21.A N SER 36.A O no hydrogen 3.245 N/A HIS 21.A ND1 THR 19.A O no hydrogen 2.769 N/A ASP 23.A N TYR 33.A OH no hydrogen 3.137 N/A GLU 25.A N ASP 23.A OD1 no hydrogen 3.015 N/A TYR 28.A OH ASP 292.A OD2 no hydrogen 2.790 N/A LYS 29.A N ASP 88.A OD1 no hydrogen 2.981 N/A LYS 29.A N ASP 88.A OD2 no hydrogen 3.314 N/A THR 30.A N ASP 88.A OD2 no hydrogen 2.781 N/A THR 30.A OG1 ASP 88.A OD2 no hydrogen 2.701 N/A THR 30.A OG1 THR 89.A O no hydrogen 3.412 N/A TRP 31.A NE1 VAL 87.A O no hydrogen 2.911 N/A ALA 32.A N SER 295.A O no hydrogen 2.787 N/A TYR 33.A OH SER 36.A OG no hydrogen 2.620 N/A HIS 34.A N ILE 293.A O no hydrogen 2.776 N/A HIS 34.A NE2 SER 295.A OG no hydrogen 3.165 N/A SER 36.A N HIS 21.A O no hydrogen 3.125 N/A SER 36.A OG TYR 33.A OH no hydrogen 2.620 N/A SER 36.A OG ASP 292.A OD1 no hydrogen 2.767 N/A TYR 37.A N MET 291.A O no hydrogen 3.362 N/A GLU 38.A N THR 19.A OG1 no hydrogen 3.188 N/A VAL 39.A N THR 289.A O no hydrogen 2.976 N/A SER 44.A N THR 74.A OG1 no hydrogen 3.148 N/A SER 44.A OG SER 46.A O no hydrogen 2.989 N/A SER 47.A OG MET 71.A O no hydrogen 2.701 N/A ASN 50.A N ARG 441.A O no hydrogen 2.794 N/A ASN 50.A ND2 THR 453.A O no hydrogen 3.416 N/A VAL 53.A N ASN 50.A OD1 no hydrogen 3.495 N/A LYS 54.A N ASN 50.A O no hydrogen 2.927 N/A LEU 55.A N GLY 51.A O no hydrogen 2.896 N/A LEU 56.A N VAL 53.A O no hydrogen 3.159 N/A THR 57.A N LYS 54.A O no hydrogen 3.137 N/A THR 57.A OG1 VAL 53.A O no hydrogen 2.702 N/A TRP 60.A N THR 57.A O no hydrogen 3.217 N/A ASP 61.A N LYS 58.A O no hydrogen 2.872 N/A THR 67.A N VAL 63.A O no hydrogen 3.043 N/A THR 67.A OG1 VAL 63.A O no hydrogen 3.427 N/A GLN 68.A N PRO 64.A O no hydrogen 2.891 N/A MET 69.A N MET 65.A O no hydrogen 3.180 N/A ALA 70.A N THR 67.A O no hydrogen 3.225 N/A MET 71.A N GLN 68.A O no hydrogen 3.294 N/A THR 74.A N SER 44.A O no hydrogen 2.976 N/A THR 74.A OG1 SER 44.A O no hydrogen 3.016 N/A THR 75.A N ASP 73.A OD2 no hydrogen 3.334 N/A THR 75.A OG1 ASP 73.A OD2 no hydrogen 2.673 N/A GLN 79.A N THR 75.A O no hydrogen 2.861 N/A GLN 80.A N PRO 76.A O no hydrogen 3.046 N/A VAL 82.A N GLY 78.A O no hydrogen 3.451 N/A PHE 83.A N GLN 79.A O no hydrogen 3.321 N/A LYS 84.A N GLN 80.A O no hydrogen 3.200 N/A GLU 85.A N ARG 81.A O no hydrogen 3.189 N/A ASP 88.A N PHE 83.A O no hydrogen 3.239 N/A THR 89.A OG1 LYS 86.A O no hydrogen 2.713 N/A THR 91.A OG1 THR 241.A O no hydrogen 3.304 N/A ARG 93.A NE ASP 246.A OD2 no hydrogen 3.033 N/A ARG 93.A NH2 ASP 246.A OD1 no hydrogen 2.989 N/A LEU 95.A N ASP 385.A OD2 no hydrogen 2.751 N/A GLY 97.A N LEU 335.A O no hydrogen 3.030 N/A THR 98.A OG1 ASP 385.A OD2 no hydrogen 2.663 N/A ARG 99.A N LEU 95.A O no hydrogen 3.004 N/A ARG 99.A NH1 PRO 94.A O no hydrogen 2.987 N/A LYS 100.A N PRO 96.A O no hydrogen 3.071 N/A LYS 100.A NZ GLU 103.A OE1 no hydrogen 2.834 N/A VAL 101.A N GLY 97.A O no hydrogen 2.951 N/A MET 102.A N THR 98.A O no hydrogen 2.947 N/A GLU 103.A N ARG 99.A O no hydrogen 3.098 N/A ILE 104.A N LYS 100.A O no hydrogen 2.933 N/A THR 105.A N VAL 101.A O no hydrogen 2.931 N/A THR 105.A OG1 VAL 101.A O no hydrogen 2.705 N/A ALA 106.A N MET 102.A O no hydrogen 2.765 N/A GLU 107.A N GLU 103.A O no hydrogen 3.075 N/A TRP 108.A N ILE 104.A O no hydrogen 3.244 N/A LEU 109.A N THR 105.A O no hydrogen 2.818 N/A TRP 110.A N ALA 106.A O no hydrogen 2.954 N/A TRP 110.A NE1 ASN 250.A O no hydrogen 3.079 N/A ARG 111.A N GLU 107.A O no hydrogen 3.271 N/A THR 112.A N TRP 108.A O no hydrogen 2.985 N/A THR 112.A OG1 TRP 108.A O no hydrogen 2.723 N/A LEU 113.A N LEU 109.A O no hydrogen 2.948 N/A GLY 114.A N TRP 110.A O no hydrogen 2.968 N/A ARG 115.A N THR 112.A O no hydrogen 3.452 N/A ARG 115.A NH1 THR 112.A O no hydrogen 2.771 N/A ARG 115.A NH1 ASN 203.A O no hydrogen 2.783 N/A ARG 115.A NH2 GLU 202.A O no hydrogen 3.231 N/A LYS 117.A NZ ASP 196.A O no hydrogen 2.888 N/A ARG 118.A NH1 ASP 259.A OD2 no hydrogen 3.514 N/A ARG 118.A NH2 ASP 259.A OD1 no hydrogen 3.114 N/A ARG 118.A NH2 ASP 259.A OD2 no hydrogen 2.778 N/A ARG 120.A NE ASP 196.A OD1 no hydrogen 3.364 N/A ARG 120.A NE ASP 196.A OD2 no hydrogen 2.825 N/A ARG 120.A NH1 LEU 121.A O no hydrogen 3.028 N/A ARG 120.A NH1 GLU 126.A OE1 no hydrogen 3.239 N/A ARG 120.A NH1 GLU 126.A OE2 no hydrogen 2.902 N/A ARG 120.A NH2 GLU 126.A OE1 no hydrogen 2.809 N/A ARG 120.A NH2 ASP 196.A OD1 no hydrogen 2.807 N/A CYS 122.A N GLU 188.A O no hydrogen 2.807 N/A THR 123.A N GLU 126.A OE2 no hydrogen 2.934 N/A THR 123.A OG1 GLU 126.A OE2 no hydrogen 3.453 N/A ARG 124.A NH1 GLU 146.A OE1 no hydrogen 3.538 N/A ARG 124.A NH1 GLU 146.A OE2 no hydrogen 3.410 N/A ARG 124.A NH2 GLU 146.A OE2 no hydrogen 3.072 N/A GLU 125.A N GLU 125.A OE1 no hydrogen 2.833 N/A GLU 126.A N THR 123.A O no hydrogen 3.180 N/A GLU 126.A N THR 123.A OG1 no hydrogen 3.016 N/A PHE 127.A N THR 123.A O no hydrogen 3.093 N/A THR 128.A N ARG 124.A O no hydrogen 2.993 N/A THR 128.A OG1 ARG 124.A O no hydrogen 2.790 N/A LYS 129.A N GLU 125.A O no hydrogen 3.068 N/A LYS 130.A N GLU 126.A O no hydrogen 2.985 N/A LYS 130.A NZ GLU 195.A OE1 no hydrogen 3.293 N/A LYS 130.A NZ GLU 195.A OE2 no hydrogen 3.057 N/A VAL 131.A N PHE 127.A O no hydrogen 2.889 N/A ARG 132.A N THR 128.A O no hydrogen 2.987 N/A ARG 132.A NH2 GLU 144.A OE2 no hydrogen 2.778 N/A THR 133.A N LYS 129.A O no hydrogen 3.043 N/A THR 133.A OG1 LYS 129.A O no hydrogen 2.721 N/A THR 133.A OG1 LYS 130.A O no hydrogen 3.352 N/A ASN 134.A N VAL 131.A O no hydrogen 3.382 N/A ASN 134.A ND2 LYS 130.A O no hydrogen 3.415 N/A ALA 136.A N ARG 132.A O no hydrogen 3.282 N/A LYS 140.A NZ GLU 144.A OE1 no hydrogen 3.393 N/A ALA 142.A N SER 138.A O no hydrogen 3.348 N/A VAL 143.A N ALA 139.A O no hydrogen 2.935 N/A GLU 144.A N LYS 140.A O no hydrogen 3.189 N/A ASP 145.A N ALA 141.A O no hydrogen 3.177 N/A ASP 145.A N ALA 142.A O no hydrogen 3.169 N/A GLU 147.A N ASP 145.A OD1 no hydrogen 3.043 N/A PHE 148.A N ASP 145.A O no hydrogen 3.255 N/A TRP 149.A NE1 VAL 143.A O no hydrogen 2.800 N/A LYS 150.A N GLU 146.A O no hydrogen 3.264 N/A VAL 152.A N PHE 148.A O no hydrogen 3.272 N/A ASP 153.A N TRP 149.A O no hydrogen 3.190 N/A ARG 154.A N LYS 150.A O no hydrogen 3.065 N/A GLU 155.A N LEU 151.A O no hydrogen 2.860 N/A ARG 156.A N VAL 152.A O no hydrogen 2.789 N/A ARG 156.A NE GLU 188.A OE1 no hydrogen 3.129 N/A ARG 156.A NE GLU 188.A OE2 no hydrogen 3.117 N/A ARG 156.A NH1 ASP 153.A OD2 no hydrogen 2.867 N/A ARG 156.A NH2 GLU 188.A OE1 no hydrogen 2.760 N/A GLU 157.A N ASP 153.A O no hydrogen 2.888 N/A LEU 158.A N ARG 154.A O no hydrogen 3.133 N/A HIS 159.A N GLU 155.A O no hydrogen 2.871 N/A LYS 160.A N ARG 156.A O no hydrogen 2.984 N/A LYS 160.A NZ GLU 157.A OE1 no hydrogen 3.168 N/A LYS 160.A NZ GLU 157.A OE2 no hydrogen 2.884 N/A LEU 161.A N GLU 157.A O no hydrogen 3.247 N/A LEU 161.A N LEU 158.A O no hydrogen 3.022 N/A GLY 162.A N HIS 159.A O no hydrogen 3.017 N/A LYS 163.A N LEU 158.A O no hydrogen 2.794 N/A CYS 164.A SG GLU 155.A OE1 no hydrogen 3.469 N/A CYS 164.A SG HIS 159.A NE2 no hydrogen 3.680 N/A GLY 165.A N GLU 155.A OE1 no hydrogen 2.849 N/A SER 166.A N GLU 155.A OE1 no hydrogen 3.500 N/A SER 166.A OG GLU 155.A OE2 no hydrogen 2.890 N/A CYS 167.A SG HIS 159.A NE2 no hydrogen 3.537 N/A VAL 168.A N SER 166.A O no hydrogen 3.209 N/A TYR 169.A N VAL 278.A O no hydrogen 3.132 N/A MET 171.A N LYS 280.A O no hydrogen 2.968 N/A ARG 173.A N SER 172.A OG no hydrogen 2.807 N/A TYR 177.A N ARG 173.A O no hydrogen 2.810 N/A TYR 177.A OH ASP 145.A OD2 no hydrogen 2.699 N/A MET 178.A N ALA 174.A O no hydrogen 3.109 N/A TRP 179.A N ILE 175.A O no hydrogen 3.017 N/A LEU 180.A N TRP 176.A O no hydrogen 2.962 N/A GLY 181.A N TYR 177.A O no hydrogen 2.975 N/A VAL 182.A N MET 178.A O no hydrogen 3.113 N/A ARG 183.A N TRP 179.A O no hydrogen 2.928 N/A ARG 183.A NH1 VAL 168.A O no hydrogen 3.424 N/A TYR 184.A N LEU 180.A O no hydrogen 2.858 N/A TYR 184.A OH GLU 188.A OE1 no hydrogen 2.894 N/A LEU 185.A N GLY 181.A O no hydrogen 2.935 N/A GLU 186.A N VAL 182.A O no hydrogen 3.164 N/A PHE 187.A N ARG 183.A O no hydrogen 2.941 N/A GLU 188.A N TYR 184.A O no hydrogen 2.752 N/A ALA 189.A N LEU 185.A O no hydrogen 3.128 N/A LEU 190.A N GLU 186.A O no hydrogen 2.795 N/A GLY 191.A N PHE 187.A O no hydrogen 2.800 N/A LEU 193.A N LEU 190.A O no hydrogen 3.393 N/A ASN 194.A N GLY 191.A O no hydrogen 3.013 N/A ASN 194.A ND2 GLY 191.A O no hydrogen 3.671 N/A ASN 194.A ND2 VAL 305.A O no hydrogen 3.453 N/A GLU 195.A N GLY 191.A O no hydrogen 2.854 N/A ASP 196.A N PHE 192.A O no hydrogen 2.846 N/A HIS 197.A N ASN 194.A O no hydrogen 3.029 N/A HIS 197.A ND1 GLU 209.A OE1 no hydrogen 2.809 N/A TRP 198.A N LEU 193.A O no hydrogen 2.882 N/A SER 200.A N HIS 197.A O no hydrogen 3.290 N/A SER 200.A OG HIS 197.A O no hydrogen 3.320 N/A ARG 201.A N GLU 211.A OE2 no hydrogen 2.848 N/A ARG 201.A NH1 SER 206.A O no hydrogen 2.924 N/A ARG 201.A NH1 GLY 207.A O no hydrogen 3.083 N/A ARG 201.A NH1 MET 360.A O no hydrogen 3.141 N/A ARG 201.A NH2 MET 360.A O no hydrogen 2.900 N/A ASN 203.A N SER 200.A OG no hydrogen 3.163 N/A ASN 203.A ND2 LEU 113.A O no hydrogen 2.814 N/A ASN 203.A ND2 TRP 198.A O no hydrogen 2.991 N/A SER 204.A N SER 200.A O no hydrogen 2.897 N/A SER 204.A OG SER 200.A O no hydrogen 2.645 N/A TYR 205.A N ARG 201.A O no hydrogen 2.843 N/A SER 206.A OG LEU 357.A O no hydrogen 2.629 N/A GLU 209.A N PHE 199.A O no hydrogen 3.069 N/A GLU 211.A N VAL 208.A O no hydrogen 3.352 N/A LEU 213.A N HIS 500.A O no hydrogen 2.963 N/A LYS 215.A N GLY 212.A O no hydrogen 3.038 N/A LEU 216.A N LEU 213.A O no hydrogen 3.256 N/A ILE 219.A N LYS 215.A O no hydrogen 3.133 N/A LEU 220.A N LEU 216.A O no hydrogen 3.049 N/A ARG 221.A N GLY 217.A O no hydrogen 2.906 N/A ARG 221.A NH1 GLU 417.A OE1 no hydrogen 3.258 N/A ASP 222.A N TYR 218.A O no hydrogen 3.025 N/A ILE 223.A N ILE 219.A O no hydrogen 2.962 N/A SER 224.A N LEU 220.A O no hydrogen 2.915 N/A SER 224.A OG ARG 221.A O no hydrogen 2.669 N/A LYS 225.A N ASP 222.A O no hydrogen 3.342 N/A ILE 226.A N ILE 223.A O no hydrogen 2.958 N/A GLY 229.A N PRO 371.A O no hydrogen 2.888 N/A ALA 230.A N ASP 374.A OD1 no hydrogen 2.804 N/A MET 231.A N TRP 402.A O no hydrogen 2.916 N/A TYR 232.A N VAL 369.A O no hydrogen 2.816 N/A TYR 232.A OH ASP 374.A OD1 no hydrogen 2.647 N/A ALA 237.A N VAL 389.A O no hydrogen 3.123 N/A TRP 239.A NE1 ASN 311.A OD1 no hydrogen 2.782 N/A THR 241.A N GLY 238.A O no hydrogen 3.161 N/A THR 241.A OG1 GLY 238.A O no hydrogen 2.732 N/A ARG 242.A N TRP 239.A O no hydrogen 2.811 N/A ARG 242.A NE GLY 387.A O no hydrogen 2.794 N/A THR 244.A N ASP 247.A OD1 no hydrogen 2.936 N/A ASP 247.A N THR 244.A O no hydrogen 3.127 N/A ASP 247.A N THR 244.A OG1 no hydrogen 3.108 N/A LEU 248.A N THR 244.A O no hydrogen 3.203 N/A HIS 249.A N GLU 245.A O no hydrogen 3.025 N/A ASN 250.A N ASP 246.A O no hydrogen 3.103 N/A GLU 251.A N ASP 247.A O no hydrogen 2.835 N/A GLU 252.A N LEU 248.A O no hydrogen 3.076 N/A LYS 253.A N ASN 250.A O no hydrogen 3.431 N/A LYS 253.A NZ GLU 107.A OE2 no hydrogen 3.429 N/A ILE 255.A N GLU 252.A O no hydrogen 3.028 N/A GLN 256.A N LYS 253.A O no hydrogen 3.281 N/A GLN 257.A N ILE 254.A O no hydrogen 3.010 N/A MET 258.A N ILE 255.A O no hydrogen 3.122 N/A GLU 261.A N GLU 261.A OE1 no hydrogen 2.906 N/A HIS 262.A NE2 ALA 189.A O no hydrogen 2.749 N/A ARG 263.A N ASP 259.A O no hydrogen 2.734 N/A GLN 264.A N PRO 260.A O no hydrogen 3.094 N/A ALA 266.A N HIS 262.A O no hydrogen 2.915 N/A ASN 267.A N ARG 263.A O no hydrogen 2.814 N/A ALA 268.A N GLN 264.A O no hydrogen 3.244 N/A ILE 269.A N LEU 265.A O no hydrogen 3.206 N/A PHE 270.A N ALA 266.A O no hydrogen 3.049 N/A LYS 271.A N ASN 267.A O no hydrogen 2.865 N/A LYS 271.A NZ GLU 252.A OE1 no hydrogen 2.813 N/A LYS 271.A NZ ASN 267.A OD1 no hydrogen 2.817 N/A LEU 272.A N ALA 268.A O no hydrogen 3.033 N/A THR 273.A N ILE 269.A O no hydrogen 2.844 N/A THR 273.A OG1 ILE 269.A O no hydrogen 2.836 N/A TYR 274.A N PHE 270.A O no hydrogen 3.243 N/A TYR 274.A OH GLU 186.A OE1 no hydrogen 2.486 N/A GLN 275.A N PHE 270.A O no hydrogen 2.793 N/A ASN 276.A ND2 LYS 271.A O no hydrogen 2.735 N/A LYS 277.A NZ TYR 274.A O no hydrogen 2.728 N/A LYS 277.A NZ ASP 298.A O no hydrogen 3.058 N/A LYS 277.A NZ GLN 299.A O no hydrogen 2.943 N/A VAL 279.A N ILE 294.A O no hydrogen 2.720 N/A LYS 280.A N TYR 169.A O no hydrogen 3.039 N/A LYS 280.A NZ TYR 37.A OH no hydrogen 3.121 N/A VAL 281.A N ASP 292.A O no hydrogen 3.104 N/A GLN 282.A NE2 THR 42.A OG1 no hydrogen 3.145 N/A ARG 283.A N VAL 290.A O no hydrogen 2.813 N/A ARG 283.A NE ASP 292.A OD1 no hydrogen 3.110 N/A ARG 283.A NE ASP 292.A OD2 no hydrogen 2.920 N/A ARG 283.A NH1 SER 36.A OG no hydrogen 3.374 N/A ARG 283.A NH1 ASP 292.A OD1 no hydrogen 3.036 N/A THR 285.A N GLY 288.A O no hydrogen 2.802 N/A THR 285.A OG1 GLY 288.A O no hydrogen 3.140 N/A GLY 288.A N THR 285.A O no hydrogen 3.310 N/A VAL 290.A N ARG 283.A O no hydrogen 2.947 N/A MET 291.A N TYR 37.A O no hydrogen 2.884 N/A ASP 292.A N VAL 281.A O no hydrogen 2.766 N/A ILE 293.A N GLY 35.A O no hydrogen 2.812 N/A ILE 294.A N VAL 279.A O no hydrogen 3.014 N/A SER 295.A N ALA 32.A O no hydrogen 2.792 N/A SER 295.A OG HIS 34.A NE2 no hydrogen 3.165 N/A ARG 296.A NE ASP 298.A OD1 no hydrogen 3.004 N/A ARG 296.A NH1 THR 30.A OG1 no hydrogen 3.131 N/A ARG 296.A NH1 THR 89.A O no hydrogen 3.527 N/A ARG 296.A NH2 THR 89.A O no hydrogen 3.017 N/A ARG 296.A NH2 ASP 298.A OD1 no hydrogen 3.187 N/A LYS 297.A NZ GLU 245.A OE2 no hydrogen 3.247 N/A GLN 299.A N ILE 243.A O no hydrogen 2.923 N/A GLN 299.A NE2 VAL 87.A O no hydrogen 3.141 N/A GLN 299.A NE2 THR 89.A O no hydrogen 3.512 N/A ARG 300.A N ASP 240.A O no hydrogen 2.838 N/A ARG 300.A NE ASN 311.A OD1 no hydrogen 2.760 N/A ARG 300.A NH1 GLU 251.A OE1 no hydrogen 2.792 N/A ARG 300.A NH1 GLU 251.A OE2 no hydrogen 3.570 N/A ARG 300.A NH2 GLU 251.A OE1 no hydrogen 3.473 N/A ARG 300.A NH2 GLU 251.A OE2 no hydrogen 2.715 N/A ARG 300.A NH2 ASN 311.A OD1 no hydrogen 2.846 N/A SER 302.A OG ASP 240.A OD2 no hydrogen 2.683 N/A GLY 303.A N TYR 169.A OH no hydrogen 2.829 N/A GLN 304.A NE2 THR 273.A O no hydrogen 3.337 N/A VAL 305.A N GLU 186.A OE2 no hydrogen 3.193 N/A GLY 306.A N GLU 186.A OE1 no hydrogen 2.931 N/A THR 307.A OG1 GLY 301.A O no hydrogen 2.711 N/A THR 307.A OG1 GLN 304.A O no hydrogen 3.184 N/A TYR 308.A OH SER 363.A OG no hydrogen 2.644 N/A LEU 310.A N GLY 306.A O no hydrogen 2.873 N/A ASN 311.A N THR 307.A O no hydrogen 3.008 N/A ASN 311.A ND2 ASP 240.A OD1 no hydrogen 2.943 N/A THR 312.A N TYR 308.A O no hydrogen 2.857 N/A THR 312.A OG1 TYR 308.A O no hydrogen 2.716 N/A PHE 313.A N GLY 309.A O no hydrogen 2.802 N/A THR 314.A N LEU 310.A O no hydrogen 3.035 N/A THR 314.A OG1 GLU 251.A OE2 no hydrogen 2.667 N/A THR 314.A OG1 LEU 310.A O no hydrogen 3.181 N/A ASN 315.A N ASN 311.A O no hydrogen 2.966 N/A ASN 315.A ND2 GLY 364.A O no hydrogen 2.781 N/A MET 316.A N THR 312.A O no hydrogen 3.040 N/A GLU 317.A N PHE 313.A O no hydrogen 3.069 N/A ALA 318.A N THR 314.A O no hydrogen 2.774 N/A GLN 319.A N ASN 315.A O no hydrogen 2.809 N/A GLN 319.A NE2 ASN 315.A OD1 no hydrogen 2.921 N/A LEU 320.A N MET 316.A O no hydrogen 2.972 N/A VAL 321.A N GLU 317.A O no hydrogen 3.049 N/A ARG 322.A N ALA 318.A O no hydrogen 2.967 N/A ARG 322.A NE PHE 376.A O no hydrogen 3.260 N/A ARG 322.A NE ALA 379.A O no hydrogen 3.032 N/A ARG 322.A NH1 ASP 234.A OD2 no hydrogen 2.765 N/A ARG 322.A NH2 PHE 376.A O no hydrogen 2.806 N/A ARG 322.A NH2 SER 399.A OG no hydrogen 2.789 N/A GLN 323.A N GLN 319.A O no hydrogen 2.978 N/A MET 324.A N LEU 320.A O no hydrogen 3.076 N/A GLU 325.A N VAL 321.A O no hydrogen 3.091 N/A GLY 326.A N ARG 322.A O no hydrogen 2.907 N/A GLU 327.A N GLN 323.A O no hydrogen 2.910 N/A GLY 328.A N GLU 325.A O no hydrogen 3.064 N/A VAL 329.A N MET 324.A O no hydrogen 2.810 N/A LEU 330.A N MET 324.A O no hydrogen 3.274 N/A THR 331.A N ASP 334.A OD1 no hydrogen 3.037 N/A ASP 334.A N THR 331.A OG1 no hydrogen 3.236 N/A LEU 335.A N THR 331.A O no hydrogen 3.304 N/A GLU 336.A N LYS 332.A O no hydrogen 3.345 N/A ASN 337.A N ASP 334.A O no hydrogen 3.199 N/A LEU 340.A N ASN 337.A O no hydrogen 3.405 N/A LYS 344.A NZ VAL 329.A O no hydrogen 2.810 N/A LYS 344.A NZ ASP 334.A OD1 no hydrogen 2.677 N/A ILE 345.A N GLU 342.A O no hydrogen 3.208 N/A THR 346.A N GLU 342.A O no hydrogen 3.017 N/A THR 346.A OG1 GLU 342.A O no hydrogen 3.174 N/A GLN 347.A N LYS 343.A O no hydrogen 2.800 N/A TRP 348.A N LYS 344.A O no hydrogen 3.075 N/A TRP 348.A NE1 GLU 327.A OE1 no hydrogen 2.970 N/A LEU 349.A N ILE 345.A O no hydrogen 2.823 N/A GLU 350.A N THR 346.A O no hydrogen 2.890 N/A THR 351.A N GLN 347.A O no hydrogen 3.041 N/A THR 351.A OG1 GLN 347.A O no hydrogen 2.704 N/A LYS 352.A N TRP 348.A O no hydrogen 2.788 N/A GLY 353.A N LEU 349.A O no hydrogen 3.060 N/A ARG 356.A N LYS 352.A O no hydrogen 2.850 N/A ARG 356.A NE GLU 327.A OE1 no hydrogen 3.398 N/A ARG 356.A NE GLU 327.A OE2 no hydrogen 2.750 N/A ARG 356.A NH1 GLU 355.A OE2 no hydrogen 2.716 N/A ARG 356.A NH2 GLU 327.A OE1 no hydrogen 2.767 N/A LEU 357.A N GLY 353.A O no hydrogen 2.833 N/A LYS 358.A N VAL 354.A O no hydrogen 2.890 N/A LYS 358.A N GLU 355.A O no hydrogen 3.238 N/A ARG 359.A N ARG 356.A O no hydrogen 3.444 N/A ARG 359.A NE GLU 355.A OE1 no hydrogen 3.272 N/A ARG 359.A NE GLU 355.A OE2 no hydrogen 3.051 N/A ARG 359.A NH1 PRO 227.A O no hydrogen 2.752 N/A ARG 359.A NH1 LYS 370.A O no hydrogen 2.955 N/A ARG 359.A NH2 PRO 227.A O no hydrogen 2.902 N/A ARG 359.A NH2 GLU 355.A OE1 no hydrogen 3.112 N/A MET 360.A N LEU 357.A O no hydrogen 3.389 N/A ALA 361.A N VAL 368.A O no hydrogen 2.972 N/A ILE 362.A N SER 206.A O no hydrogen 2.875 N/A SER 363.A N ASP 366.A O no hydrogen 2.757 N/A SER 363.A OG TYR 308.A OH no hydrogen 2.644 N/A GLY 364.A N THR 312.A OG1 no hydrogen 2.998 N/A ASP 366.A N SER 363.A O no hydrogen 2.952 N/A CYS 367.A SG ASP 234.A O no hydrogen 3.915 N/A VAL 368.A N ALA 361.A O no hydrogen 2.853 N/A VAL 369.A N TYR 232.A O no hydrogen 2.732 N/A LYS 370.A N ARG 359.A O no hydrogen 2.785 N/A LYS 370.A NZ ILE 226.A O no hydrogen 2.772 N/A LYS 370.A NZ GLY 229.A O no hydrogen 3.146 N/A ARG 375.A N ASP 373.A OD1 no hydrogen 2.994 N/A ARG 375.A NE ASP 373.A OD1 no hydrogen 3.065 N/A ARG 375.A NE ASP 373.A OD2 no hydrogen 3.395 N/A ARG 375.A NH2 ASP 373.A OD2 no hydrogen 3.098 N/A ALA 377.A N ASP 374.A O no hydrogen 3.096 N/A ASN 378.A N ARG 375.A O no hydrogen 3.052 N/A ALA 379.A N PHE 376.A O no hydrogen 3.121 N/A LEU 381.A N GLU 325.A OE1 no hydrogen 3.079 N/A ALA 382.A N GLU 325.A OE2 no hydrogen 2.892 N/A ASN 384.A N LEU 380.A O no hydrogen 3.191 N/A ASP 385.A N LEU 381.A O no hydrogen 3.038 N/A MET 386.A N ALA 382.A O no hydrogen 2.790 N/A GLY 387.A N ASN 384.A O no hydrogen 3.232 N/A LYS 388.A N LEU 383.A O no hydrogen 3.009 N/A LYS 388.A NZ ARG 242.A O no hydrogen 2.801 N/A LYS 388.A NZ ASP 247.A OD1 no hydrogen 2.801 N/A LYS 388.A NZ MET 386.A O no hydrogen 2.881 N/A ARG 390.A NH1 GLN 397.A O no hydrogen 2.795 N/A ARG 390.A NH1 SER 399.A OG no hydrogen 3.036 N/A ARG 390.A NH2 GLN 395.A O no hydrogen 2.859 N/A ARG 390.A NH2 GLN 397.A O no hydrogen 2.785 N/A LYS 391.A N ASP 235.A O no hydrogen 2.846 N/A LYS 391.A NZ ASP 235.A OD2 no hydrogen 3.097 N/A GLN 397.A N PRO 394.A O no hydrogen 2.975 N/A SER 399.A N ALA 377.A O no hydrogen 2.971 N/A SER 399.A OG ASP 234.A OD2 no hydrogen 2.630 N/A LYS 400.A NZ GLY 401.A O no hydrogen 3.397 N/A TRP 402.A N MET 231.A O no hydrogen 2.914 N/A GLN 406.A N ASP 404.A OD1.A no hydrogen 3.182 N/A GLN 407.A N ASP 404.A O no hydrogen 3.060 N/A PHE 410.A N HIS 413.A O no hydrogen 2.856 N/A CYS 411.A N ASP 366.A OD2 no hydrogen 3.393 N/A CYS 411.A SG HIS 500.A NE2 no hydrogen 3.137 N/A HIS 413.A N PHE 410.A O no hydrogen 3.051 N/A HIS 413.A ND1 CYS 411.A O no hydrogen 2.734 N/A HIS 413.A NE2 TYR 468.A OH no hydrogen 2.849 N/A HIS 414.A N CYS 430.A O no hydrogen 2.800 N/A HIS 416.A N VAL 428.A O no hydrogen 2.963 N/A LEU 418.A N LEU 426.A O no hydrogen 2.738 N/A MET 420.A N ARG 424.A O no hydrogen 2.763 N/A LYS 421.A NZ GLU 536.A O no hydrogen 2.791 N/A GLY 423.A N MET 420.A O no hydrogen 2.796 N/A ARG 424.A N ASP 422.A OD1 no hydrogen 3.000 N/A ARG 424.A NE ASP 422.A OD1 no hydrogen 3.222 N/A ARG 424.A NE ASP 422.A OD2 no hydrogen 3.143 N/A ARG 424.A NH1 ASP 528.A O no hydrogen 2.715 N/A ARG 424.A NH1 THR 530.A O no hydrogen 2.848 N/A ARG 424.A NH2 ASP 422.A OD2 no hydrogen 3.020 N/A ARG 424.A NH2 THR 530.A O no hydrogen 2.792 N/A LYS 425.A NZ GLU 417.A OE2 no hydrogen 3.387 N/A LEU 426.A N LEU 418.A O no hydrogen 2.757 N/A VAL 427.A N TYR 218.A OH no hydrogen 3.251 N/A VAL 428.A N HIS 416.A O no hydrogen 2.869 N/A CYS 430.A N HIS 414.A O no hydrogen 2.698 N/A CYS 430.A SG ARG 431.A O no hydrogen 3.770 N/A ARG 431.A NE GLU 435.A OE1 no hydrogen 3.284 N/A ARG 431.A NH2 GLU 435.A OE1 no hydrogen 3.217 N/A GLN 433.A N CYS 549.A O no hydrogen 2.998 N/A GLN 433.A NE2 ASP 473.A OD2 no hydrogen 2.847 N/A GLU 435.A N PRO 432.A O no hydrogen 3.171 N/A ILE 437.A N GLN 433.A O no hydrogen 2.944 N/A GLY 438.A N ASP 434.A O no hydrogen 2.890 N/A ARG 439.A N GLU 435.A O no hydrogen 3.118 N/A ALA 440.A N LEU 436.A O no hydrogen 3.011 N/A ARG 441.A N ILE 437.A O no hydrogen 2.965 N/A ARG 441.A NH1 THR 57.A OG1 no hydrogen 3.159 N/A ARG 441.A NH1 ASP 61.A OD1 no hydrogen 3.056 N/A ARG 441.A NH2 ASP 61.A OD1 no hydrogen 2.737 N/A ILE 442.A N ARG 439.A O no hydrogen 3.092 N/A SER 443.A N MET 48.A O no hydrogen 2.842 N/A SER 449.A N GLU 452.A OE1 no hydrogen 2.790 N/A SER 449.A OG GLU 452.A OE1 no hydrogen 3.175 N/A GLU 452.A N SER 449.A OG no hydrogen 3.276 N/A THR 453.A N SER 449.A O no hydrogen 3.101 N/A THR 453.A OG1 SER 449.A O no hydrogen 2.991 N/A ALA 454.A N LEU 450.A O no hydrogen 2.788 N/A CYS 455.A N ARG 451.A O no hydrogen 3.094 N/A CYS 455.A SG ARG 451.A O no hydrogen 3.266 N/A CYS 455.A SG VAL 490.A O no hydrogen 3.399 N/A LEU 456.A N GLU 452.A O no hydrogen 3.032 N/A GLY 457.A N THR 453.A O no hydrogen 2.964 N/A LYS 458.A N ALA 454.A O no hydrogen 2.813 N/A LYS 458.A NZ PRO 486.A O no hydrogen 3.382 N/A LYS 458.A NZ VAL 487.A O no hydrogen 2.986 N/A LYS 458.A NZ TRP 489.A O no hydrogen 2.956 N/A ALA 459.A N CYS 455.A O no hydrogen 2.904 N/A TYR 460.A N LEU 456.A O no hydrogen 3.045 N/A ALA 461.A N GLY 457.A O no hydrogen 2.925 N/A GLN 462.A N LYS 458.A O no hydrogen 2.843 N/A MET 463.A N ALA 459.A O no hydrogen 2.884 N/A TRP 464.A N TYR 460.A O no hydrogen 3.095 N/A SER 465.A N ALA 461.A O no hydrogen 3.118 N/A SER 465.A OG ALA 461.A O no hydrogen 2.968 N/A SER 465.A OG SER 478.A OG no hydrogen 2.724 N/A LEU 466.A N GLN 462.A O no hydrogen 3.073 N/A LEU 466.A N MET 463.A O no hydrogen 3.247 N/A MET 467.A N MET 463.A O no hydrogen 2.799 N/A TYR 468.A N TRP 464.A O no hydrogen 2.778 N/A TYR 468.A OH HIS 413.A NE2 no hydrogen 2.849 N/A ARG 471.A N TYR 468.A O no hydrogen 2.943 N/A ARG 471.A NE ASP 546.A OD1 no hydrogen 2.771 N/A ARG 471.A NH1 ASP 546.A O no hydrogen 2.784 N/A ARG 471.A NH1 ASP 546.A OD1 no hydrogen 3.074 N/A ARG 471.A NH1 CYS 549.A O no hydrogen 2.958 N/A ARG 471.A NH2 CYS 549.A O no hydrogen 3.212 N/A ARG 472.A N ASP 546.A OD2 no hydrogen 3.171 N/A ARG 472.A NH1 LEU 541.A O no hydrogen 2.770 N/A ARG 472.A NH1 ASP 546.A OD2 no hydrogen 2.762 N/A ARG 472.A NH2 LEU 541.A O no hydrogen 3.119 N/A LEU 474.A N ARG 471.A O no hydrogen 2.997 N/A ARG 475.A N ARG 471.A O no hydrogen 2.884 N/A ARG 475.A NE PHE 469.A O no hydrogen 2.845 N/A ARG 475.A NH1 VAL 538.A O no hydrogen 3.082 N/A ARG 475.A NH2 PHE 469.A O no hydrogen 2.864 N/A ARG 475.A NH2 VAL 538.A O no hydrogen 2.962 N/A LEU 476.A N ARG 472.A O no hydrogen 3.230 N/A ALA 477.A N ASP 473.A O no hydrogen 3.045 N/A SER 478.A N LEU 474.A O no hydrogen 2.867 N/A SER 478.A OG ALA 461.A O no hydrogen 2.799 N/A SER 478.A OG SER 465.A OG no hydrogen 2.724 N/A ASN 479.A N ARG 475.A O no hydrogen 2.864 N/A ALA 480.A N LEU 476.A O no hydrogen 2.868 N/A ILE 481.A N ALA 477.A O no hydrogen 2.912 N/A CYS 482.A N SER 478.A O no hydrogen 2.987 N/A CYS 482.A SG SER 478.A O no hydrogen 3.384 N/A SER 483.A N ASN 479.A O no hydrogen 2.966 N/A SER 483.A N ALA 480.A O no hydrogen 3.317 N/A SER 483.A OG ASN 479.A O no hydrogen 2.797 N/A ALA 484.A N ALA 480.A O no hydrogen 3.189 N/A ALA 484.A N ILE 481.A O no hydrogen 3.168 N/A VAL 485.A N ILE 481.A O no hydrogen 3.005 N/A VAL 487.A N GLU 580.A O no hydrogen 3.207 N/A TRP 489.A N PRO 486.A O no hydrogen 3.111 N/A SER 498.A N THR 496.A OG1 no hydrogen 3.076 N/A HIS 500.A N SER 498.A OG no hydrogen 3.021 N/A ALA 501.A N SER 498.A O no hydrogen 3.091 N/A MET 506.A N HIS 503.A O no hydrogen 3.138 N/A GLU 509.A N THR 507.A OG1 no hydrogen 3.264 N/A THR 513.A N ASP 510.A O no hydrogen 3.120 N/A THR 513.A OG1 ASP 510.A OD1 no hydrogen 2.822 N/A VAL 514.A N ASP 510.A O no hydrogen 3.220 N/A TRP 515.A N MET 511.A O no hydrogen 2.782 N/A ASN 516.A N LEU 512.A O no hydrogen 3.132 N/A ASN 516.A ND2 LEU 512.A O no hydrogen 2.774 N/A ASN 516.A ND2 VAL 532.A O no hydrogen 2.835 N/A ARG 517.A N THR 513.A O no hydrogen 3.032 N/A ARG 517.A NH1 GLU 509.A OE1 no hydrogen 2.964 N/A ARG 517.A NH2 GLU 509.A OE1 no hydrogen 3.267 N/A ARG 517.A NH2 GLU 509.A OE2 no hydrogen 2.783 N/A VAL 518.A N VAL 514.A O no hydrogen 3.047 N/A TRP 519.A N TRP 515.A O no hydrogen 2.825 N/A TRP 519.A NE1 LEU 466.A O no hydrogen 2.718 N/A ILE 520.A N ASN 516.A O no hydrogen 3.034 N/A GLU 521.A N ASN 516.A O no hydrogen 2.805 N/A GLU 522.A N ARG 517.A O no hydrogen 2.741 N/A ASN 523.A ND2 TYR 218.A OH no hydrogen 3.008 N/A ASN 523.A ND2 TRP 519.A O no hydrogen 2.799 N/A TRP 525.A N ASN 523.A OD1 no hydrogen 2.853 N/A TRP 525.A NE1 ASP 222.A OD2 no hydrogen 2.942 N/A MET 526.A N ASN 523.A O no hydrogen 2.976 N/A LYS 529.A NZ ILE 520.A O no hydrogen 2.812 N/A LYS 529.A NZ GLU 521.A O no hydrogen 2.954 N/A LYS 529.A NZ MET 526.A O no hydrogen 2.759 N/A THR 530.A N ASP 528.A OD2 no hydrogen 2.981 N/A THR 530.A OG1 ASP 528.A OD1 no hydrogen 3.532 N/A THR 530.A OG1 ASP 528.A OD2 no hydrogen 2.658 N/A VAL 532.A N ASN 516.A OD1 no hydrogen 2.759 N/A ASN 537.A N THR 534.A O no hydrogen 2.911 N/A VAL 538.A N TRP 535.A O no hydrogen 3.081 N/A LEU 541.A N HIS 470.A O no hydrogen 3.013 N/A ASP 546.A N GLY 542.A O no hydrogen 2.906 N/A GLN 547.A N LYS 543.A O no hydrogen 2.951 N/A GLN 547.A NE2 ILE 553.A O no hydrogen 2.851 N/A TRP 548.A N ARG 544.A O no hydrogen 2.837 N/A CYS 549.A N GLU 545.A O no hydrogen 3.027 N/A CYS 549.A SG HIS 414.A NE2 no hydrogen 3.340 N/A CYS 549.A SG HIS 416.A NE2 no hydrogen 4.013 N/A CYS 549.A SG GLU 545.A O no hydrogen 3.299 N/A GLY 550.A N GLN 547.A O no hydrogen 3.182 N/A SER 551.A N ASP 546.A O no hydrogen 2.971 N/A SER 551.A OG ASP 473.A OD1 no hydrogen 3.456 N/A SER 551.A OG ASP 473.A OD2 no hydrogen 3.272 N/A LEU 552.A N ASP 473.A OD2 no hydrogen 2.825 N/A ILE 553.A N SER 551.A OG no hydrogen 3.122 N/A LEU 555.A N LEU 552.A O no hydrogen 3.133 N/A ARG 558.A NE ASP 473.A OD1 no hydrogen 2.809 N/A ARG 558.A NH2 ASP 473.A OD1 no hydrogen 3.173 N/A ALA 559.A N LEU 555.A O no hydrogen 3.176 N/A THR 560.A N THR 556.A O no hydrogen 2.781 N/A THR 560.A OG1 THR 556.A O no hydrogen 2.991 N/A TRP 561.A N SER 557.A O no hydrogen 2.931 N/A TRP 561.A NE1 LEU 56.A O no hydrogen 2.777 N/A ALA 562.A N ARG 558.A O no hydrogen 2.839 N/A GLN 563.A N ALA 559.A O no hydrogen 2.939 N/A ASN 564.A N THR 560.A O no hydrogen 2.920 N/A ILE 569.A N ILE 565.A O no hydrogen 3.049 N/A GLN 570.A N PRO 566.A O no hydrogen 2.929 N/A GLN 571.A N THR 567.A O no hydrogen 2.987 N/A VAL 572.A N ALA 568.A O no hydrogen 3.035 N/A ARG 573.A N ILE 569.A O no hydrogen 2.894 N/A ARG 573.A NE SER 483.A O no hydrogen 2.790 N/A ARG 573.A NH2 SER 483.A O no hydrogen 2.886 N/A ARG 573.A NH2 LEU 582.A O no hydrogen 3.322 N/A SER 574.A N GLN 570.A O no hydrogen 2.830 N/A SER 574.A OG GLN 570.A O no hydrogen 3.332 N/A SER 574.A OG GLN 571.A O no hydrogen 2.807 N/A LEU 575.A N GLN 571.A O no hydrogen 3.171 N/A ILE 576.A N VAL 572.A O no hydrogen 2.936 N/A GLY 577.A N ARG 573.A O no hydrogen 2.956 N/A TYR 584.A N SER 483.A OG no hydrogen 2.935 N/A SER 587.A N TYR 584.A O no hydrogen 3.243 N/A SER 587.A OG TYR 584.A O no hydrogen 2.752 N/A MET 588.A N MET 585.A O no hydrogen 2.902 N/A LYS 589.A NZ GLU 536.A OE2 no hydrogen 3.533 N/A