Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7hke_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N ASN 1.A O no hydrogen 2.978 N/A GLY 6.A N LEU 2.A O no hydrogen 2.595 N/A LYS 7.A NZ GLU 161.A OE1 no hydrogen 2.763 N/A ARG 8.A NH1 CYS 163.A O no hydrogen 3.057 N/A ARG 8.A NH1 LEU 267.A O no hydrogen 2.905 N/A ARG 8.A NH2 ILE 4.A O no hydrogen 3.159 N/A ARG 8.A NH2 LEU 267.A O no hydrogen 2.839 N/A ILE 9.A N ILE 5.A O no hydrogen 3.107 N/A GLU 10.A N GLY 6.A O no hydrogen 2.432 N/A LYS 11.A N LYS 7.A O no hydrogen 2.880 N/A ILE 12.A N ARG 8.A O no hydrogen 3.304 N/A LYS 13.A N ILE 9.A O no hydrogen 3.010 N/A GLN 14.A N GLU 10.A O no hydrogen 3.362 N/A GLU 15.A N ILE 12.A O no hydrogen 3.181 N/A HIS 16.A N LYS 13.A O no hydrogen 3.073 N/A SER 19.A N HIS 16.A O no hydrogen 3.043 N/A HIS 21.A N SER 36.A O no hydrogen 3.474 N/A HIS 21.A ND1 SER 19.A O no hydrogen 2.809 N/A ASP 23.A N HIS 21.A O no hydrogen 2.960 N/A ASP 25.A N ASP 23.A OD1 no hydrogen 2.758 N/A HIS 26.A ND1 ASP 23.A O no hydrogen 3.210 N/A TYR 28.A OH ASP 284.A OD2 no hydrogen 2.618 N/A LYS 29.A N ASP 76.A OD1 no hydrogen 3.427 N/A LYS 29.A N ASP 76.A OD2 no hydrogen 3.380 N/A THR 30.A N ASP 76.A OD1 no hydrogen 2.930 N/A THR 30.A OG1 ASP 76.A OD1 no hydrogen 2.502 N/A THR 30.A OG1 THR 77.A O no hydrogen 3.383 N/A ALA 32.A N SER 287.A O no hydrogen 2.981 N/A TYR 33.A OH SER 36.A OG no hydrogen 2.273 N/A HIS 34.A NE2 SER 287.A OG no hydrogen 2.942 N/A SER 36.A N HIS 21.A O no hydrogen 3.256 N/A SER 36.A OG TYR 33.A OH no hydrogen 2.273 N/A SER 36.A OG ASP 284.A OD1 no hydrogen 2.895 N/A TYR 37.A N MET 283.A O no hydrogen 3.232 N/A THR 39.A N THR 281.A O no hydrogen 3.495 N/A MET 46.A N SER 434.A O.A no hydrogen 3.055 N/A MET 46.A N SER 434.A O.B no hydrogen 2.887 N/A ASN 48.A N ARG 432.A O no hydrogen 2.681 N/A ASN 48.A ND2 THR 444.A O no hydrogen 3.214 N/A VAL 51.A N ASN 48.A OD1 no hydrogen 3.159 N/A ARG 52.A N ASN 48.A O no hydrogen 3.009 N/A LEU 53.A N GLY 49.A O no hydrogen 2.962 N/A LEU 54.A N VAL 51.A O no hydrogen 3.085 N/A THR 55.A N ARG 52.A O no hydrogen 3.088 N/A THR 55.A OG1 VAL 51.A O no hydrogen 2.803 N/A THR 55.A OG1 ARG 52.A O no hydrogen 3.470 N/A TRP 58.A N THR 55.A O no hydrogen 3.097 N/A ASP 59.A N LYS 56.A O no hydrogen 2.888 N/A ILE 61.A N TRP 58.A O no hydrogen 3.198 N/A VAL 64.A N ILE 61.A O no hydrogen 2.911 N/A THR 65.A N ILE 61.A O no hydrogen 3.056 N/A THR 65.A OG1 ILE 61.A O no hydrogen 3.520 N/A GLN 66.A N PRO 62.A O no hydrogen 2.911 N/A MET 67.A N VAL 64.A O no hydrogen 3.240 N/A ALA 68.A N THR 65.A O no hydrogen 3.442 N/A MET 69.A N GLN 66.A O no hydrogen 3.150 N/A LYS 74.A N PHE 71.A O no hydrogen 3.179 N/A THR 77.A OG1 LYS 74.A O no hydrogen 2.654 N/A LYS 83.A N ASP 376.A OD2 no hydrogen 2.888 N/A GLY 85.A N GLN 326.A O no hydrogen 3.339 N/A THR 86.A OG1 ASP 376.A OD2 no hydrogen 2.615 N/A LYS 87.A N LYS 83.A O no hydrogen 2.987 N/A LYS 87.A NZ GLU 81.A OE1 no hydrogen 2.797 N/A LYS 87.A NZ GLU 84.A OE2 no hydrogen 3.155 N/A LYS 88.A N GLU 84.A O no hydrogen 2.997 N/A LEU 89.A N GLY 85.A O no hydrogen 2.996 N/A MET 90.A N THR 86.A O no hydrogen 2.912 N/A LYS 91.A N LYS 87.A O no hydrogen 3.074 N/A LYS 91.A NZ GLU 241.A OE2 no hydrogen 3.040 N/A LYS 91.A NZ ASN 245.A OD1 no hydrogen 3.050 N/A ILE 92.A N LYS 88.A O no hydrogen 3.042 N/A THR 93.A N LEU 89.A O no hydrogen 2.997 N/A THR 93.A OG1 LEU 89.A O no hydrogen 2.738 N/A ALA 94.A N MET 90.A O no hydrogen 2.758 N/A GLU 95.A N LYS 91.A O no hydrogen 3.011 N/A TRP 96.A N ILE 92.A O no hydrogen 3.101 N/A LEU 97.A N THR 93.A O no hydrogen 2.829 N/A TRP 98.A N ALA 94.A O no hydrogen 2.913 N/A TRP 98.A NE1 ASN 245.A O no hydrogen 3.073 N/A LYS 99.A N GLU 95.A O no hydrogen 3.355 N/A LYS 99.A NZ GLU 95.A OE2 no hydrogen 3.045 N/A GLU 100.A N TRP 96.A O no hydrogen 3.033 N/A LEU 101.A N LEU 97.A O no hydrogen 2.904 N/A GLY 102.A N TRP 98.A O no hydrogen 2.809 N/A LYS 103.A N GLU 100.A O no hydrogen 3.408 N/A LYS 103.A NZ GLU 100.A OE1 no hydrogen 2.996 N/A LYS 103.A NZ GLU 100.A OE2 no hydrogen 3.013 N/A LYS 105.A N GLY 102.A O no hydrogen 3.295 N/A LYS 105.A NZ ASP 191.A O no hydrogen 2.785 N/A ARG 108.A NE ASP 191.A OD2 no hydrogen 2.785 N/A ARG 108.A NH1 MET 109.A O no hydrogen 3.224 N/A ARG 108.A NH1 GLU 114.A OE1 no hydrogen 2.906 N/A ARG 108.A NH1 GLU 114.A OE2 no hydrogen 3.446 N/A ARG 108.A NH2 GLU 114.A OE2 no hydrogen 3.119 N/A ARG 108.A NH2 ASP 191.A OD1 no hydrogen 3.034 N/A CYS 110.A N GLU 183.A O no hydrogen 3.038 N/A THR 111.A N GLU 114.A OE1 no hydrogen 3.033 N/A THR 111.A OG1 GLU 114.A OE1 no hydrogen 3.498 N/A ARG 112.A NH2 ASP 149.A OD1 no hydrogen 2.895 N/A GLU 114.A N THR 111.A OG1 no hydrogen 2.799 N/A PHE 115.A N THR 111.A O no hydrogen 2.786 N/A THR 116.A N ARG 112.A O no hydrogen 2.691 N/A THR 116.A OG1 ARG 112.A O no hydrogen 2.903 N/A ARG 117.A N GLU 113.A O no hydrogen 3.043 N/A LYS 118.A N GLU 114.A O no hydrogen 3.172 N/A LYS 118.A NZ GLU 190.A OE2 no hydrogen 2.865 N/A VAL 119.A N PHE 115.A O no hydrogen 3.063 N/A ARG 120.A N THR 116.A O no hydrogen 2.991 N/A SER 121.A OG ARG 117.A O no hydrogen 2.725 N/A SER 121.A OG LYS 118.A O no hydrogen 3.176 N/A LYS 133.A N GLU 137.A OE1 no hydrogen 3.246 N/A ALA 138.A N SER 134.A O no hydrogen 3.497 N/A VAL 139.A N ALA 135.A O no hydrogen 3.241 N/A GLU 140.A N GLU 137.A O no hydrogen 3.331 N/A ASP 141.A N GLU 137.A O no hydrogen 3.312 N/A GLY 143.A N ASP 141.A OD1 no hydrogen 2.505 N/A TRP 145.A NE1 VAL 139.A O no hydrogen 2.906 N/A GLU 146.A N GLY 143.A O no hydrogen 2.843 N/A LEU 147.A N GLY 143.A O no hydrogen 3.149 N/A VAL 148.A N PHE 144.A O no hydrogen 2.791 N/A ASP 149.A N TRP 145.A O no hydrogen 2.673 N/A LYS 150.A N GLU 146.A O no hydrogen 2.807 N/A GLU 151.A N LEU 147.A O no hydrogen 3.063 N/A ARG 152.A N VAL 148.A O no hydrogen 2.839 N/A ARG 152.A NH2 GLU 256.A OE1 no hydrogen 3.162 N/A ASN 153.A N ASP 149.A O no hydrogen 2.995 N/A ASN 153.A ND2 ASP 149.A O no hydrogen 2.924 N/A LEU 154.A N LYS 150.A O no hydrogen 2.967 N/A HIS 155.A N GLU 151.A O no hydrogen 2.773 N/A LEU 156.A N ARG 152.A O no hydrogen 3.060 N/A GLU 157.A N ASN 153.A O no hydrogen 3.116 N/A GLY 158.A N HIS 155.A O no hydrogen 2.675 N/A LYS 159.A N LEU 154.A O no hydrogen 2.919 N/A CYS 160.A SG GLU 151.A OE1 no hydrogen 3.720 N/A CYS 160.A SG HIS 155.A NE2 no hydrogen 3.798 N/A GLU 161.A N GLU 151.A OE2 no hydrogen 2.857 N/A CYS 163.A SG GLU 151.A OE1 no hydrogen 2.824 N/A CYS 163.A SG HIS 155.A NE2 no hydrogen 3.522 N/A TYR 165.A N VAL 273.A O no hydrogen 2.750 N/A ASN 166.A N TYR 172.A O no hydrogen 2.797 N/A MET 167.A N ARG 275.A O no hydrogen 3.032 N/A ILE 170.A N MET 168.A O no hydrogen 3.159 N/A TYR 172.A N ASN 166.A O no hydrogen 3.050 N/A MET 173.A N GLY 126.A O no hydrogen 3.197 N/A ARG 178.A N TRP 174.A O no hydrogen 3.236 N/A ARG 178.A NE GLY 126.A O no hydrogen 3.352 N/A PHE 179.A N LEU 175.A O no hydrogen 2.859 N/A LEU 180.A N GLY 176.A O no hydrogen 3.166 N/A GLU 181.A N ALA 177.A O no hydrogen 2.999 N/A PHE 182.A N ARG 178.A O no hydrogen 2.965 N/A GLU 183.A N PHE 179.A O no hydrogen 2.713 N/A ALA 184.A N LEU 180.A O no hydrogen 3.314 N/A ALA 184.A N GLU 181.A O no hydrogen 3.282 N/A LEU 185.A N GLU 181.A O no hydrogen 2.952 N/A GLY 186.A N PHE 182.A O no hydrogen 2.812 N/A LEU 188.A N LEU 185.A O no hydrogen 3.189 N/A ASN 189.A N GLY 186.A O no hydrogen 3.010 N/A GLU 190.A N GLY 186.A O no hydrogen 2.765 N/A ASP 191.A N PHE 187.A O no hydrogen 2.920 N/A HIS 192.A N ASN 189.A O no hydrogen 3.087 N/A HIS 192.A ND1 GLU 204.A OE1 no hydrogen 2.999 N/A TRP 193.A N LEU 188.A O no hydrogen 2.970 N/A SER 195.A N HIS 192.A O no hydrogen 3.219 N/A SER 195.A OG HIS 192.A O no hydrogen 3.320 N/A ARG 196.A N GLU 206.A OE2 no hydrogen 3.161 N/A ARG 196.A NH1 SER 201.A O no hydrogen 3.057 N/A ARG 196.A NH1 GLY 202.A O no hydrogen 3.096 N/A ARG 196.A NH1 MET 351.A O no hydrogen 3.249 N/A ARG 196.A NH2 MET 351.A O no hydrogen 2.932 N/A ASN 198.A N SER 195.A OG no hydrogen 2.960 N/A ASN 198.A ND2 LEU 101.A O no hydrogen 3.004 N/A ASN 198.A ND2 TRP 193.A O no hydrogen 2.917 N/A SER 199.A N SER 195.A O no hydrogen 2.977 N/A SER 199.A OG SER 195.A O no hydrogen 2.685 N/A LEU 200.A N ARG 196.A O no hydrogen 2.888 N/A SER 201.A OG LEU 348.A O no hydrogen 2.606 N/A GLY 202.A N SER 199.A OG no hydrogen 2.951 N/A GLU 204.A N PHE 194.A O no hydrogen 3.118 N/A GLU 206.A N VAL 203.A O no hydrogen 2.979 N/A LYS 210.A N GLY 207.A O no hydrogen 2.865 N/A LEU 211.A N LEU 208.A O.B no hydrogen 3.310 N/A TYR 213.A OH VAL 416.A O no hydrogen 3.235 N/A ILE 214.A N LYS 210.A O no hydrogen 2.987 N/A LEU 215.A N LEU 211.A O no hydrogen 2.978 N/A ARG 216.A N GLY 212.A O no hydrogen 2.908 N/A ARG 216.A NH1 GLU 408.A OE1 no hydrogen 2.936 N/A ASP 217.A N TYR 213.A O no hydrogen 2.951 N/A VAL 218.A N ILE 214.A O no hydrogen 3.010 N/A SER 219.A N LEU 215.A O no hydrogen 2.973 N/A SER 219.A OG ARG 216.A O no hydrogen 2.647 N/A LYS 220.A N ASP 217.A O no hydrogen 3.161 N/A LYS 220.A NZ ASP 217.A OD1 no hydrogen 3.069 N/A LYS 221.A N VAL 218.A O no hydrogen 3.167 N/A LYS 221.A NZ GLU 346.A OE2 no hydrogen 3.273 N/A GLY 224.A N PRO 362.A O no hydrogen 3.137 N/A ALA 225.A N ASP 365.A OD1 no hydrogen 2.868 N/A MET 226.A N TRP 393.A O no hydrogen 2.869 N/A TYR 227.A N VAL 360.A O no hydrogen 2.858 N/A TYR 227.A OH ASP 365.A OD1 no hydrogen 2.523 N/A ALA 232.A N VAL 380.A O no hydrogen 3.023 N/A TRP 234.A NE1 ASN 303.A OD1 no hydrogen 2.908 N/A THR 236.A N GLY 233.A O no hydrogen 2.965 N/A THR 236.A OG1 GLY 233.A O no hydrogen 2.658 N/A ARG 237.A N TRP 234.A O no hydrogen 2.939 N/A ARG 237.A NE ALA 232.A O no hydrogen 3.079 N/A THR 239.A N ASP 242.A OD2 no hydrogen 2.945 N/A ASP 242.A N THR 239.A OG1 no hydrogen 3.048 N/A LEU 243.A N THR 239.A O no hydrogen 3.123 N/A LYS 244.A N LEU 240.A O no hydrogen 3.072 N/A ASN 245.A N GLU 241.A O no hydrogen 3.038 N/A GLU 246.A N ASP 242.A O no hydrogen 2.935 N/A GLU 247.A N.A LEU 243.A O no hydrogen 3.125 N/A GLU 247.A N.B LEU 243.A O no hydrogen 3.116 N/A MET 248.A N ASN 245.A O no hydrogen 3.331 N/A VAL 249.A N GLU 246.A O no hydrogen 3.192 N/A THR 250.A N GLU 247.A O.A no hydrogen 2.891 N/A THR 250.A N GLU 247.A O.B no hydrogen 2.928 N/A THR 250.A OG1 GLU 247.A O.A no hydrogen 2.730 N/A THR 250.A OG1 GLU 247.A O.B no hydrogen 2.735 N/A THR 250.A OG1 GLU 247.A OE2.B no hydrogen 2.874 N/A ASN 251.A N MET 248.A O no hydrogen 3.078 N/A HIS 252.A N VAL 249.A O no hydrogen 3.073 N/A MET 253.A N THR 250.A O no hydrogen 3.137 N/A HIS 257.A NE2 ALA 184.A O no hydrogen 2.788 N/A LYS 258.A N GLU 254.A O no hydrogen 3.329 N/A LYS 258.A NZ THR 250.A O no hydrogen 3.335 N/A LEU 260.A N GLU 256.A O no hydrogen 2.831 N/A ALA 261.A N HIS 257.A O no hydrogen 2.805 N/A GLU 262.A N LYS 258.A O no hydrogen 2.972 N/A ALA 263.A N LYS 259.A O no hydrogen 3.080 N/A ILE 264.A N LEU 260.A O no hydrogen 3.138 N/A PHE 265.A N ALA 261.A O no hydrogen 3.135 N/A LYS 266.A N GLU 262.A O no hydrogen 2.977 N/A LEU 267.A N ALA 263.A O no hydrogen 2.847 N/A THR 268.A N ILE 264.A O no hydrogen 3.034 N/A THR 268.A OG1 ILE 264.A O no hydrogen 2.462 N/A TYR 269.A N ILE 264.A O no hydrogen 3.217 N/A TYR 269.A OH GLU 181.A OE1 no hydrogen 2.347 N/A GLN 270.A N PHE 265.A O no hydrogen 2.783 N/A GLN 270.A NE2 LEU 243.A O no hydrogen 3.343 N/A GLN 270.A NE2 GLU 247.A OE1.A no hydrogen 2.948 N/A ASN 271.A ND2 LYS 266.A O no hydrogen 3.050 N/A LYS 272.A N ARG 288.A O no hydrogen 3.066 N/A LYS 272.A NZ TYR 269.A O no hydrogen 2.805 N/A LYS 272.A NZ ASP 290.A O no hydrogen 2.609 N/A LYS 272.A NZ GLN 291.A O no hydrogen 3.126 N/A VAL 274.A N ILE 286.A O no hydrogen 2.839 N/A ARG 275.A N TYR 165.A O no hydrogen 2.934 N/A VAL 276.A N ASP 284.A O no hydrogen 3.045 N/A ARG 278.A N VAL 282.A O no hydrogen 3.402 N/A ARG 278.A NE ASP 284.A OD2 no hydrogen 2.722 N/A ARG 278.A NH1 ASP 25.A O no hydrogen 3.255 N/A ARG 278.A NH2 ASP 284.A OD1 no hydrogen 3.114 N/A VAL 282.A N ARG 278.A O no hydrogen 3.110 N/A MET 283.A N TYR 37.A O no hydrogen 2.764 N/A ASP 284.A N VAL 276.A O no hydrogen 3.033 N/A ILE 285.A N GLY 35.A O no hydrogen 3.077 N/A ILE 286.A N VAL 274.A O no hydrogen 2.957 N/A SER 287.A N ALA 32.A O no hydrogen 2.834 N/A SER 287.A OG HIS 34.A NE2 no hydrogen 2.942 N/A ARG 288.A NE ASP 290.A OD1 no hydrogen 2.591 N/A ARG 288.A NH2 THR 77.A O no hydrogen 3.386 N/A ARG 288.A NH2 ASP 290.A OD1 no hydrogen 2.795 N/A ARG 289.A NE GLN 270.A O no hydrogen 2.891 N/A ARG 289.A NE ASN 271.A OD1 no hydrogen 3.310 N/A ARG 289.A NH2 GLN 270.A O no hydrogen 3.025 N/A GLN 291.A N ILE 238.A O no hydrogen 2.939 N/A GLN 291.A NE2 VAL 75.A O no hydrogen 3.091 N/A ARG 292.A N ASP 235.A O no hydrogen 2.905 N/A ARG 292.A NE ASN 303.A OD1 no hydrogen 2.994 N/A ARG 292.A NH1 GLU 246.A OE1 no hydrogen 2.748 N/A ARG 292.A NH2 GLU 246.A OE1 no hydrogen 3.523 N/A ARG 292.A NH2 GLU 246.A OE2 no hydrogen 2.862 N/A ARG 292.A NH2 ASN 303.A OD1 no hydrogen 3.002 N/A GLY 295.A N GLU 181.A OE1 no hydrogen 2.985 N/A GLY 295.A N GLU 181.A OE2 no hydrogen 3.174 N/A THR 299.A N GLY 295.A O no hydrogen 2.806 N/A THR 299.A OG1 GLY 295.A O no hydrogen 2.697 N/A TYR 300.A N GLN 296.A O no hydrogen 3.039 N/A TYR 300.A OH SER 354.A OG no hydrogen 2.930 N/A GLY 301.A N VAL 297.A O no hydrogen 3.324 N/A LEU 302.A N VAL 298.A O no hydrogen 2.978 N/A ASN 303.A N THR 299.A O no hydrogen 2.906 N/A ASN 303.A ND2 ASP 235.A OD1 no hydrogen 3.064 N/A THR 304.A N TYR 300.A O no hydrogen 2.949 N/A THR 304.A OG1 TYR 300.A O no hydrogen 2.873 N/A PHE 305.A N GLY 301.A O no hydrogen 2.971 N/A THR 306.A N LEU 302.A O no hydrogen 2.975 N/A THR 306.A OG1 GLU 246.A OE2 no hydrogen 2.446 N/A THR 306.A OG1 LEU 302.A O no hydrogen 3.339 N/A ASN 307.A N ASN 303.A O no hydrogen 2.869 N/A ASN 307.A ND2 GLY 355.A O no hydrogen 2.952 N/A MET 308.A N THR 304.A O no hydrogen 2.830 N/A GLU 309.A N PHE 305.A O no hydrogen 3.026 N/A ALA 310.A N THR 306.A O no hydrogen 2.915 N/A GLN 311.A N ASN 307.A O no hydrogen 2.951 N/A GLN 311.A NE2 ASN 307.A OD1 no hydrogen 3.026 N/A LEU 312.A N MET 308.A O no hydrogen 3.015 N/A ILE 313.A N GLU 309.A O no hydrogen 3.117 N/A ARG 314.A N ALA 310.A O no hydrogen 2.977 N/A ARG 314.A NE PHE 367.A O no hydrogen 3.233 N/A ARG 314.A NH1 ASP 229.A OD2 no hydrogen 2.838 N/A ARG 314.A NH2 PHE 367.A O no hydrogen 3.151 N/A ARG 314.A NH2 ALA 368.A O no hydrogen 3.345 N/A ARG 314.A NH2 SER 390.A OG no hydrogen 2.824 N/A GLN 315.A N GLN 311.A O no hydrogen 2.904 N/A GLN 315.A NE2 ARG 347.A O no hydrogen 3.192 N/A MET 316.A N LEU 312.A O no hydrogen 2.798 N/A GLU 317.A N ILE 313.A O no hydrogen 2.835 N/A GLY 318.A N ARG 314.A O no hydrogen 3.056 N/A GLU 319.A N GLN 315.A O no hydrogen 3.063 N/A GLY 320.A N GLU 317.A O no hydrogen 3.120 N/A VAL 321.A N MET 316.A O no hydrogen 3.056 N/A LYS 323.A N GLU 332.A OE1 no hydrogen 3.036 N/A GLN 326.A N SER 324.A OG no hydrogen 3.088 N/A THR 329.A N GLU 332.A OE2 no hydrogen 3.184 N/A THR 329.A OG1 GLU 332.A OE2 no hydrogen 3.429 N/A GLU 332.A N THR 329.A O no hydrogen 3.205 N/A GLU 332.A N THR 329.A OG1 no hydrogen 3.142 N/A GLU 333.A N THR 329.A O no hydrogen 3.233 N/A ALA 335.A N THR 331.A O no hydrogen 3.170 N/A VAL 336.A N GLU 332.A O no hydrogen 2.792 N/A LYS 337.A N GLU 333.A O no hydrogen 2.991 N/A ASN 338.A N ILE 334.A O no hydrogen 2.879 N/A TRP 339.A N ALA 335.A O no hydrogen 2.741 N/A TRP 339.A NE1 GLU 319.A OE1 no hydrogen 3.057 N/A LEU 340.A N VAL 336.A O no hydrogen 3.053 N/A VAL 341.A N LYS 337.A O no hydrogen 3.030 N/A ARG 342.A N ASN 338.A O no hydrogen 2.846 N/A VAL 343.A N TRP 339.A O no hydrogen 2.547 N/A GLY 344.A N LEU 340.A O no hydrogen 2.770 N/A ARG 345.A NH1 GLU 100.A OE1 no hydrogen 2.788 N/A ARG 347.A N VAL 343.A O no hydrogen 2.922 N/A ARG 347.A NE GLU 319.A OE2 no hydrogen 2.848 N/A ARG 347.A NH1 GLU 346.A OE1 no hydrogen 2.835 N/A ARG 347.A NH2 GLU 319.A OE1 no hydrogen 2.859 N/A LEU 348.A N GLY 344.A O no hydrogen 2.903 N/A SER 349.A N ARG 345.A O no hydrogen 3.183 N/A SER 349.A OG GLU 346.A O no hydrogen 2.583 N/A ARG 350.A N ARG 347.A O no hydrogen 3.288 N/A ARG 350.A NE GLU 346.A OE1 no hydrogen 2.856 N/A ARG 350.A NE GLU 346.A OE2 no hydrogen 3.246 N/A ARG 350.A NH1 GLU 222.A O no hydrogen 3.104 N/A ARG 350.A NH1 LYS 361.A O no hydrogen 2.803 N/A ARG 350.A NH2 GLU 222.A O no hydrogen 3.045 N/A ARG 350.A NH2 GLU 346.A OE2 no hydrogen 3.169 N/A MET 351.A N LEU 348.A O no hydrogen 3.061 N/A ALA 352.A N VAL 359.A O no hydrogen 2.884 N/A ILE 353.A N SER 201.A O no hydrogen 2.880 N/A SER 354.A N ASP 357.A O no hydrogen 2.874 N/A SER 354.A OG TYR 300.A OH no hydrogen 2.930 N/A GLY 355.A N THR 304.A OG1 no hydrogen 2.892 N/A ASP 357.A N SER 354.A O no hydrogen 2.885 N/A CYS 358.A SG ASP 229.A O no hydrogen 3.878 N/A VAL 359.A N ALA 352.A O no hydrogen 2.879 N/A VAL 360.A N TYR 227.A O no hydrogen 2.841 N/A LYS 361.A N ARG 350.A O no hydrogen 2.826 N/A LYS 361.A NZ SER 219.A O no hydrogen 3.028 N/A LYS 361.A NZ LYS 221.A O no hydrogen 3.031 N/A ARG 366.A N ASP 364.A OD1 no hydrogen 3.177 N/A ARG 366.A NE ASP 364.A OD1 no hydrogen 2.878 N/A ARG 366.A NH2 ASP 364.A OD2 no hydrogen 2.832 N/A ALA 368.A N ASP 365.A O no hydrogen 3.035 N/A SER 369.A N ARG 366.A O no hydrogen 3.265 N/A SER 369.A OG ARG 366.A O no hydrogen 3.480 N/A ALA 370.A N PHE 367.A O no hydrogen 3.058 N/A THR 372.A N GLU 317.A OE1 no hydrogen 3.129 N/A THR 372.A OG1 GLU 317.A OE1 no hydrogen 2.500 N/A ALA 373.A N GLU 317.A OE2 no hydrogen 2.921 N/A ASN 375.A N LEU 371.A O no hydrogen 2.988 N/A ASN 375.A ND2 GLN 386.A O no hydrogen 3.121 N/A ASP 376.A N THR 372.A O no hydrogen 2.872 N/A MET 377.A N ALA 373.A O no hydrogen 2.729 N/A GLY 378.A N ASN 375.A O no hydrogen 3.026 N/A LYS 379.A N LEU 374.A O no hydrogen 3.077 N/A LYS 379.A NZ ARG 237.A O no hydrogen 2.784 N/A LYS 379.A NZ ASP 242.A OD2 no hydrogen 2.695 N/A LYS 379.A NZ MET 377.A O no hydrogen 3.126 N/A ARG 381.A NH1 GLU 388.A O.A no hydrogen 2.912 N/A ARG 381.A NH1 GLU 388.A O.B no hydrogen 2.880 N/A ARG 381.A NH1 SER 390.A OG no hydrogen 2.969 N/A ARG 381.A NH2 GLN 386.A O no hydrogen 2.871 N/A ARG 381.A NH2 GLU 388.A O.A no hydrogen 2.864 N/A ARG 381.A NH2 GLU 388.A O.B no hydrogen 2.876 N/A LYS 382.A N ASP 230.A O no hydrogen 2.926 N/A LYS 382.A NZ ASP 230.A OD2 no hydrogen 3.014 N/A GLU 388.A N.A GLN 385.A O no hydrogen 3.006 N/A GLU 388.A N.B GLN 385.A O no hydrogen 2.983 N/A SER 390.A N ALA 368.A O no hydrogen 2.931 N/A SER 390.A OG ASP 229.A OD2 no hydrogen 2.448 N/A TRP 393.A N MET 226.A O no hydrogen 2.693 N/A THR 397.A N ASP 395.A OD1 no hydrogen 3.084 N/A THR 397.A OG1 ASP 395.A OD1 no hydrogen 2.688 N/A THR 397.A OG1 ASP 395.A OD2 no hydrogen 2.954 N/A GLN 398.A N.A ASP 395.A O no hydrogen 2.919 N/A GLN 398.A N.B ASP 395.A O no hydrogen 2.919 N/A GLN 398.A NE2.A ASP 395.A OD2 no hydrogen 3.482 N/A GLN 398.A NE2.A THR 397.A OG1 no hydrogen 3.055 N/A VAL 399.A N TRP 396.A O no hydrogen 3.341 N/A PHE 401.A N HIS 404.A O no hydrogen 2.927 N/A CYS 402.A N ASP 357.A OD2 no hydrogen 2.756 N/A HIS 404.A N PHE 401.A O no hydrogen 2.977 N/A HIS 404.A ND1 CYS 402.A O no hydrogen 2.770 N/A HIS 404.A NE2 TYR 459.A OH no hydrogen 2.613 N/A HIS 405.A N CYS 421.A O no hydrogen 2.925 N/A HIS 407.A N VAL 419.A O no hydrogen 2.978 N/A LEU 409.A N LEU 417.A O no hydrogen 2.725 N/A MET 411.A N ARG 415.A O no hydrogen 2.836 N/A LYS 412.A NZ.A GLU 523.A O no hydrogen 2.829 N/A GLY 414.A N MET 411.A O no hydrogen 2.714 N/A ARG 415.A N ASP 413.A OD1 no hydrogen 2.950 N/A ARG 415.A NE ASP 413.A OD1 no hydrogen 3.293 N/A ARG 415.A NE ASP 413.A OD2 no hydrogen 3.245 N/A ARG 415.A NH1 ASP 515.A O no hydrogen 3.045 N/A ARG 415.A NH1 THR 517.A O no hydrogen 2.792 N/A ARG 415.A NH2 ASP 413.A OD2 no hydrogen 2.981 N/A ARG 415.A NH2 THR 517.A O no hydrogen 3.151 N/A LEU 417.A N LEU 409.A O no hydrogen 2.830 N/A VAL 418.A N TYR 213.A OH no hydrogen 3.275 N/A VAL 419.A N HIS 407.A O no hydrogen 2.924 N/A CYS 421.A N HIS 405.A O no hydrogen 2.861 N/A CYS 421.A SG HIS 405.A NE2 no hydrogen 3.467 N/A CYS 421.A SG HIS 407.A NE2 no hydrogen 3.531 N/A CYS 421.A SG ARG 422.A O no hydrogen 3.858 N/A ARG 422.A NE GLU 426.A OE2 no hydrogen 2.740 N/A ARG 422.A NH2 GLU 426.A OE2 no hydrogen 3.061 N/A GLN 424.A N CYS 536.A O no hydrogen 2.979 N/A GLN 424.A NE2 ASP 464.A OD2 no hydrogen 2.884 N/A ASP 425.A N ASN 423.A OD1 no hydrogen 2.975 N/A GLU 426.A N ASN 423.A O no hydrogen 3.048 N/A ILE 428.A N GLN 424.A O no hydrogen 2.984 N/A GLY 429.A N ASP 425.A O no hydrogen 2.950 N/A ARG 430.A N GLU 426.A O no hydrogen 3.068 N/A ALA 431.A N LEU 427.A O no hydrogen 3.132 N/A ARG 432.A N ILE 428.A O no hydrogen 3.224 N/A ARG 432.A NH1 THR 55.A OG1 no hydrogen 2.900 N/A ARG 432.A NH1 ASP 59.A OD1 no hydrogen 3.078 N/A ARG 432.A NH2 ASP 59.A OD1 no hydrogen 2.870 N/A ILE 433.A N ARG 430.A O no hydrogen 3.118 N/A SER 434.A N.A MET 46.A O no hydrogen 2.769 N/A SER 434.A N.B MET 46.A O no hydrogen 2.795 N/A SER 434.A OG.A GLN 435.A O no hydrogen 3.465 N/A TRP 439.A NE1 GLN 435.A O no hydrogen 2.837 N/A GLU 443.A N SER 440.A OG no hydrogen 2.978 N/A THR 444.A N SER 440.A O no hydrogen 3.053 N/A THR 444.A OG1 SER 440.A O no hydrogen 2.788 N/A ALA 445.A N LEU 441.A O no hydrogen 2.863 N/A CYS 446.A N ARG 442.A O no hydrogen 3.010 N/A CYS 446.A SG ARG 442.A O no hydrogen 3.345 N/A CYS 446.A SG VAL 481.A O no hydrogen 3.293 N/A LEU 447.A N GLU 443.A O no hydrogen 3.000 N/A GLY 448.A N THR 444.A O no hydrogen 2.972 N/A LYS 449.A N ALA 445.A O no hydrogen 2.945 N/A LYS 449.A NZ PRO 477.A O no hydrogen 3.562 N/A LYS 449.A NZ SER 478.A O.A no hydrogen 2.914 N/A LYS 449.A NZ SER 478.A O.B no hydrogen 2.905 N/A LYS 449.A NZ TRP 480.A O no hydrogen 2.654 N/A SER 450.A N CYS 446.A O no hydrogen 3.089 N/A SER 450.A OG CYS 446.A O no hydrogen 3.344 N/A SER 450.A OG THR 483.A O no hydrogen 2.707 N/A TYR 451.A N LEU 447.A O no hydrogen 3.223 N/A ALA 452.A N GLY 448.A O no hydrogen 2.922 N/A GLN 453.A N LYS 449.A O no hydrogen 2.928 N/A GLN 453.A NE2 TRP 492.A O no hydrogen 2.837 N/A GLN 453.A NE2 THR 494.A O no hydrogen 2.941 N/A MET 454.A N SER 450.A O no hydrogen 3.028 N/A TRP 455.A N TYR 451.A O no hydrogen 2.912 N/A SER 456.A N.A ALA 452.A O no hydrogen 2.992 N/A SER 456.A N.B ALA 452.A O no hydrogen 3.011 N/A SER 456.A OG.A ALA 452.A O no hydrogen 2.995 N/A SER 456.A OG.B GLN 453.A O no hydrogen 2.874 N/A LEU 457.A N GLN 453.A O no hydrogen 2.997 N/A LEU 457.A N MET 454.A O no hydrogen 3.195 N/A MET 458.A N MET 454.A O no hydrogen 2.863 N/A TYR 459.A N TRP 455.A O no hydrogen 2.804 N/A TYR 459.A OH HIS 404.A NE2 no hydrogen 2.613 N/A ARG 462.A N TYR 459.A O no hydrogen 2.993 N/A ARG 462.A NE ASP 533.A OD1 no hydrogen 2.787 N/A ARG 462.A NH1 ASP 533.A OD1 no hydrogen 3.121 N/A ARG 462.A NH1 CYS 536.A O no hydrogen 2.905 N/A ARG 462.A NH2 ARG 422.A O no hydrogen 3.253 N/A ARG 462.A NH2 CYS 536.A O no hydrogen 3.327 N/A ARG 463.A N ASP 533.A OD2 no hydrogen 3.004 N/A ARG 463.A NH1 LEU 528.A O no hydrogen 2.741 N/A ARG 463.A NH1 ASP 533.A OD2 no hydrogen 2.902 N/A ARG 463.A NH2 LEU 528.A O no hydrogen 2.983 N/A LEU 465.A N ARG 462.A O no hydrogen 3.072 N/A ARG 466.A N ARG 462.A O no hydrogen 2.967 N/A ARG 466.A NE PHE 460.A O no hydrogen 2.838 N/A ARG 466.A NH1 TRP 522.A O no hydrogen 3.103 N/A ARG 466.A NH1 ILE 525.A O no hydrogen 3.296 N/A ARG 466.A NH2 PHE 460.A O no hydrogen 3.043 N/A ARG 466.A NH2 ILE 525.A O no hydrogen 2.889 N/A LEU 467.A N ARG 463.A O no hydrogen 3.235 N/A ALA 468.A N ASP 464.A O no hydrogen 2.927 N/A ALA 469.A N LEU 465.A O no hydrogen 2.901 N/A ASN 470.A N ARG 466.A O no hydrogen 3.036 N/A ALA 471.A N LEU 467.A O no hydrogen 2.891 N/A ILE 472.A N ALA 468.A O no hydrogen 2.839 N/A CYS 473.A N ALA 469.A O no hydrogen 2.915 N/A CYS 473.A SG ALA 469.A O no hydrogen 3.476 N/A SER 474.A N ASN 470.A O no hydrogen 2.959 N/A SER 474.A N ALA 471.A O no hydrogen 3.121 N/A SER 474.A OG ASN 470.A O no hydrogen 2.852 N/A ALA 475.A N ALA 471.A O no hydrogen 2.995 N/A ALA 475.A N ILE 472.A O no hydrogen 2.965 N/A VAL 476.A N ILE 472.A O no hydrogen 3.010 N/A SER 478.A N.A GLU 567.A O no hydrogen 3.070 N/A SER 478.A N.B GLU 567.A O no hydrogen 3.055 N/A SER 478.A OG.B GLU 567.A O no hydrogen 3.450 N/A SER 478.A OG.B THR 569.A OG1 no hydrogen 2.594 N/A TRP 480.A N PRO 477.A O no hydrogen 3.028 N/A THR 483.A N CYS 446.A O no hydrogen 3.370 N/A SER 484.A OG THR 486.A O no hydrogen 3.348 N/A ARG 485.A NE GLU 443.A OE2 no hydrogen 3.218 N/A ARG 485.A NH1 ALA 437.A O no hydrogen 2.941 N/A ARG 485.A NH2 ALA 437.A O no hydrogen 3.188 N/A ARG 485.A NH2 GLU 443.A OE1 no hydrogen 2.946 N/A THR 487.A OG1 ASN 122.A O no hydrogen 3.361 N/A THR 489.A OG1 GLU 491.A OE1 no hydrogen 2.967 N/A THR 489.A OG1 GLU 491.A OE2 no hydrogen 2.815 N/A GLU 491.A N GLU 491.A OE2 no hydrogen 2.714 N/A MET 493.A N HIS 490.A O.A no hydrogen 3.128 N/A MET 493.A N HIS 490.A O.B no hydrogen 3.118 N/A GLU 496.A N THR 494.A OG1 no hydrogen 2.990 N/A LEU 499.A N ASP 497.A OD1 no hydrogen 2.928 N/A THR 500.A N ASP 497.A OD1 no hydrogen 3.375 N/A VAL 501.A N ASP 497.A O no hydrogen 3.190 N/A TRP 502.A N MET 498.A O no hydrogen 2.822 N/A ASN 503.A N LEU 499.A O no hydrogen 3.007 N/A ASN 503.A ND2 LEU 499.A O no hydrogen 3.283 N/A ASN 503.A ND2 VAL 519.A O no hydrogen 2.876 N/A ARG 504.A N THR 500.A O no hydrogen 3.075 N/A ARG 504.A NH1 GLU 496.A OE2 no hydrogen 2.983 N/A ARG 504.A NH2 GLU 496.A OE1 no hydrogen 2.935 N/A ARG 504.A NH2 GLU 496.A OE2 no hydrogen 3.104 N/A VAL 505.A N VAL 501.A O no hydrogen 2.962 N/A TRP 506.A N TRP 502.A O no hydrogen 2.853 N/A TRP 506.A NE1 LEU 457.A O no hydrogen 2.861 N/A ILE 507.A N ASN 503.A O no hydrogen 3.054 N/A GLN 508.A N ASN 503.A O no hydrogen 2.975 N/A GLU 509.A N ARG 504.A O no hydrogen 2.837 N/A ASN 510.A N ILE 507.A O no hydrogen 3.392 N/A ASN 510.A ND2 TYR 213.A OH no hydrogen 3.165 N/A ASN 510.A ND2 TRP 506.A O no hydrogen 2.874 N/A TRP 512.A N ASN 510.A OD1 no hydrogen 3.058 N/A TRP 512.A NE1 ASP 217.A OD2 no hydrogen 2.980 N/A MET 513.A N ASN 510.A O no hydrogen 3.057 N/A LYS 516.A NZ ILE 507.A O no hydrogen 2.937 N/A LYS 516.A NZ GLN 508.A O no hydrogen 3.245 N/A LYS 516.A NZ MET 513.A O no hydrogen 2.732 N/A THR 517.A N ASP 515.A OD1 no hydrogen 2.890 N/A THR 517.A OG1 ASP 515.A OD1 no hydrogen 2.505 N/A VAL 519.A N ASN 503.A OD1 no hydrogen 2.794 N/A GLU 520.A N GLU 524.A OE2 no hydrogen 2.726 N/A GLU 523.A N SER 521.A OG no hydrogen 3.285 N/A GLU 524.A N SER 521.A O no hydrogen 3.223 N/A ILE 525.A N TRP 522.A O no hydrogen 2.908 N/A LEU 528.A N HIS 461.A O no hydrogen 3.043 N/A GLY 529.A N GLU 532.A OE1 no hydrogen 2.928 N/A ASP 533.A N GLY 529.A O no hydrogen 2.927 N/A GLN 534.A N LYS 530.A O no hydrogen 3.165 N/A GLN 534.A NE2 ILE 540.A O no hydrogen 3.345 N/A TRP 535.A N ARG 531.A O no hydrogen 2.904 N/A CYS 536.A N GLU 532.A O no hydrogen 3.039 N/A CYS 536.A SG HIS 405.A NE2 no hydrogen 3.527 N/A CYS 536.A SG HIS 407.A NE2 no hydrogen 3.688 N/A CYS 536.A SG GLU 532.A O no hydrogen 3.722 N/A GLY 537.A N GLN 534.A O no hydrogen 2.904 N/A SER 538.A N ASP 533.A O no hydrogen 2.953 N/A SER 538.A OG ASP 464.A OD2 no hydrogen 3.334 N/A LEU 539.A N ASP 464.A OD2 no hydrogen 2.823 N/A ILE 540.A N SER 538.A OG no hydrogen 3.097 N/A LEU 542.A N LEU 539.A O no hydrogen 3.034 N/A ARG 545.A NE ASP 464.A OD1 no hydrogen 2.772 N/A ARG 545.A NH2 ASP 464.A OD1 no hydrogen 2.924 N/A ALA 546.A N LEU 542.A O no hydrogen 3.018 N/A THR 547.A N THR 543.A O no hydrogen 3.105 N/A THR 547.A OG1 THR 543.A O no hydrogen 3.073 N/A TRP 548.A N SER 544.A O no hydrogen 3.100 N/A TRP 548.A NE1 LEU 54.A O no hydrogen 3.039 N/A ALA 549.A N ARG 545.A O no hydrogen 2.934 N/A LYS 550.A N ALA 546.A O no hydrogen 3.016 N/A ASN 551.A N THR 547.A O no hydrogen 3.032 N/A ILE 552.A N ALA 549.A O no hydrogen 3.336 N/A GLN 553.A NE2.A ASP 570.A OD1 no hydrogen 3.103 N/A GLN 553.A NE2.B ASN 557.A OD1 no hydrogen 2.886 N/A THR 554.A N ASN 551.A O no hydrogen 3.035 N/A ILE 556.A N ILE 552.A O no hydrogen 2.884 N/A ASN 557.A N GLN 553.A O.A no hydrogen 2.889 N/A ASN 557.A N GLN 553.A O.B no hydrogen 2.911 N/A GLN 558.A N THR 554.A O no hydrogen 3.038 N/A VAL 559.A N ALA 555.A O no hydrogen 3.227 N/A ARG 560.A N ILE 556.A O no hydrogen 2.917 N/A ARG 560.A NE SER 474.A O no hydrogen 2.998 N/A ARG 560.A NH1 ASN 557.A OD1 no hydrogen 3.568 N/A ARG 560.A NH2 SER 474.A O no hydrogen 2.917 N/A ARG 560.A NH2 THR 569.A O no hydrogen 3.473 N/A SER 561.A N ASN 557.A O no hydrogen 2.939 N/A SER 561.A OG ASN 557.A O no hydrogen 2.927 N/A LEU 562.A N GLN 558.A O no hydrogen 3.205 N/A ILE 563.A N VAL 559.A O no hydrogen 2.960 N/A GLY 564.A N ARG 560.A O no hydrogen 2.809 N/A TYR 568.A OH GLY 564.A O no hydrogen 2.716 N/A THR 569.A OG1 SER 478.A OG.B no hydrogen 2.594 N/A TYR 571.A N SER 474.A OG no hydrogen 2.852 N/A MET 572.A N ASP 570.A OD1 no hydrogen 3.087 N/A SER 574.A N TYR 571.A O no hydrogen 3.318 N/A SER 574.A OG TYR 571.A O no hydrogen 2.759 N/A MET 575.A N MET 572.A O no hydrogen 3.000 N/A PHE 578.A N MET 575.A O no hydrogen 3.134 N/A ARG 579.A N LYS 576.A O no hydrogen 3.100 N/A ARG 579.A NE GLU 523.A OE2 no hydrogen 2.581 N/A ARG 579.A NH2 GLU 523.A OE1 no hydrogen 2.854 N/A