Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8brc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N SER 34.A O no hydrogen 2.800 N/A ARG 5.A N ASP 56.A OD2 no hydrogen 2.702 N/A ARG 5.A NE ASP 56.A OD1 no hydrogen 3.444 N/A ARG 5.A NE ASP 56.A OD2 no hydrogen 3.052 N/A ARG 5.A NH1 ASN 53.A O no hydrogen 3.170 N/A ARG 5.A NH2 ASN 53.A OD1 no hydrogen 2.759 N/A ARG 5.A NH2 ASP 56.A OD1 no hydrogen 2.804 N/A TRP 6.A N ALA 36.A O no hydrogen 2.674 N/A CYS 7.A N ALA 57.A O no hydrogen 2.979 N/A CYS 7.A SG VAL 38.A O no hydrogen 3.951 N/A ALA 8.A N VAL 38.A O no hydrogen 2.734 N/A VAL 9.A N GLU 13.A OE1 no hydrogen 3.219 N/A GLU 13.A N SER 10.A OG no hydrogen 3.046 N/A ALA 14.A N SER 10.A O no hydrogen 3.075 N/A THR 15.A N GLU 11.A O no hydrogen 3.072 N/A THR 15.A OG1 GLU 11.A O no hydrogen 2.795 N/A LYS 16.A N HIS 12.A O no hydrogen 3.220 N/A LYS 16.A NZ LEU 282.A O no hydrogen 2.870 N/A LYS 16.A NZ SER 284.A O no hydrogen 3.550 N/A LYS 16.A NZ LEU 291.A O no hydrogen 2.880 N/A CYS 17.A N GLU 13.A O no hydrogen 2.929 N/A GLN 18.A N ALA 14.A O no hydrogen 2.795 N/A SER 19.A N THR 15.A O no hydrogen 3.178 N/A PHE 20.A N LYS 16.A O no hydrogen 2.786 N/A ARG 21.A N CYS 17.A O no hydrogen 2.759 N/A ASP 22.A N GLN 18.A O no hydrogen 2.919 N/A HIS 23.A N SER 19.A O no hydrogen 2.880 N/A HIS 23.A ND1 SER 19.A O no hydrogen 3.007 N/A MET 24.A N PHE 20.A O no hydrogen 3.087 N/A LYS 25.A N ASP 22.A O no hydrogen 2.991 N/A SER 26.A N HIS 23.A O no hydrogen 3.189 N/A VAL 27.A N MET 24.A O no hydrogen 3.347 N/A ILE 28.A N MET 24.A O no hydrogen 2.909 N/A SER 34.A N LYS 2.A O no hydrogen 2.974 N/A ALA 36.A N VAL 4.A O no hydrogen 2.962 N/A VAL 38.A N TRP 6.A O no hydrogen 2.777 N/A LYS 39.A NZ LYS 40.A O no hydrogen 3.013 N/A LYS 40.A N ALA 8.A O no hydrogen 2.770 N/A SER 42.A OG ASP 45.A OD2 no hydrogen 3.055 N/A ASP 45.A N SER 42.A OG no hydrogen 3.290 N/A CYS 46.A N SER 42.A O no hydrogen 2.986 N/A CYS 46.A SG ALA 8.A O no hydrogen 3.747 N/A CYS 46.A SG SER 42.A O no hydrogen 3.811 N/A ILE 47.A N TYR 43.A O no hydrogen 3.003 N/A ARG 48.A N LEU 44.A O no hydrogen 2.936 N/A ALA 49.A N ASP 45.A O no hydrogen 2.780 N/A ILE 50.A N CYS 46.A O no hydrogen 2.969 N/A ALA 51.A N ILE 47.A O no hydrogen 3.045 N/A ALA 52.A N ARG 48.A O no hydrogen 2.689 N/A ASN 53.A N ILE 50.A O no hydrogen 2.824 N/A GLU 54.A N ALA 49.A O no hydrogen 2.765 N/A ALA 55.A N ALA 49.A O no hydrogen 3.389 N/A ASP 56.A N ARG 5.A O no hydrogen 2.741 N/A ALA 57.A N ARG 5.A O no hydrogen 3.133 N/A THR 59.A OG1 LEU 292.A O no hydrogen 3.378 N/A LEU 60.A N THR 248.A O no hydrogen 2.604 N/A VAL 65.A N ASP 61.A O no hydrogen 2.905 N/A TYR 66.A N ALA 62.A O no hydrogen 3.091 N/A ASP 67.A N GLY 63.A O no hydrogen 3.225 N/A ALA 68.A N LEU 64.A O no hydrogen 2.968 N/A TYR 69.A N VAL 65.A O no hydrogen 3.064 N/A LEU 70.A N TYR 66.A O no hydrogen 3.327 N/A ASN 73.A N LEU 70.A O no hydrogen 2.903 N/A ASN 73.A ND2 ASP 67.A O no hydrogen 3.277 N/A ASN 73.A ND2 LEU 70.A O no hydrogen 3.325 N/A ASN 74.A N LEU 70.A O no hydrogen 3.076 N/A LEU 75.A N ALA 68.A O no hydrogen 2.881 N/A LYS 76.A N ALA 251.A O no hydrogen 2.760 N/A VAL 78.A N VAL 249.A O no hydrogen 2.998 N/A ALA 80.A N LEU 301.A O no hydrogen 2.804 N/A GLU 81.A N HIS 247.A O no hydrogen 3.086 N/A PHE 82.A N GLY 299.A O no hydrogen 2.854 N/A TYR 83.A OH GLU 81.A OE1 no hydrogen 2.622 N/A GLY 84.A N HIS 298.A ND1 no hydrogen 2.930 N/A ASP 88.A N SER 85.A OG no hydrogen 2.935 N/A GLN 90.A N TYR 83.A O no hydrogen 3.119 N/A GLN 90.A NE2 ASP 88.A O no hydrogen 3.574 N/A TYR 93.A N VAL 244.A O no hydrogen 2.874 N/A TYR 93.A OH SER 123.A OG no hydrogen 2.975 N/A TYR 94.A N HIS 205.A ND1 no hydrogen 3.147 N/A ALA 95.A N ALA 242.A O no hydrogen 3.041 N/A VAL 96.A N VAL 203.A O no hydrogen 2.752 N/A VAL 98.A N ALA 201.A O no hydrogen 3.044 N/A VAL 99.A N GLU 222.A O no hydrogen 2.914 N/A LYS 100.A NZ TYR 221.A OH no hydrogen 3.479 N/A LYS 101.A N GLN 220.A O no hydrogen 2.627 N/A LYS 101.A NZ ASP 219.A O no hydrogen 3.055 N/A SER 103.A N LYS 100.A O no hydrogen 3.065 N/A SER 103.A OG LYS 100.A O no hydrogen 2.657 N/A GLN 106.A N GLN 109.A OE1 no hydrogen 2.740 N/A GLN 109.A N GLN 106.A O no hydrogen 2.914 N/A GLY 112.A N PHE 151.A O no hydrogen 3.116 N/A LYS 113.A N LEU 110.A O no hydrogen 3.143 N/A LYS 113.A NZ GLN 109.A O no hydrogen 3.256 N/A LYS 114.A N ASP 199.A OD2 no hydrogen 2.574 N/A LYS 114.A NZ ALA 197.A O no hydrogen 3.156 N/A SER 115.A N GLY 154.A O no hydrogen 3.356 N/A SER 115.A OG HIS 117.A NE2 no hydrogen 3.019 N/A CYS 116.A N VAL 200.A O no hydrogen 2.741 N/A CYS 116.A SG VAL 200.A O no hydrogen 3.719 N/A HIS 117.A N CYS 156.A O no hydrogen 2.933 N/A HIS 117.A ND1 GLY 125.A O no hydrogen 2.945 N/A LEU 120.A N PRO 158.A O no hydrogen 2.749 N/A ARG 122.A N GLY 119.A O no hydrogen 3.357 N/A SER 123.A OG TYR 93.A OH no hydrogen 2.975 N/A TRP 126.A N SER 123.A O no hydrogen 3.144 N/A ASN 127.A N ARG 122.A O no hydrogen 2.869 N/A ASN 127.A ND2 GLY 121.A O no hydrogen 2.833 N/A ILE 128.A N SER 123.A O no hydrogen 2.863 N/A ILE 130.A N TRP 126.A O no hydrogen 2.766 N/A GLY 131.A N ASN 127.A O no hydrogen 2.780 N/A LEU 132.A N ILE 128.A O no hydrogen 2.863 N/A LEU 133.A N PRO 129.A O no hydrogen 2.858 N/A TYR 134.A N GLY 131.A O no hydrogen 3.373 N/A ASP 136.A N LEU 133.A O no hydrogen 2.926 N/A LEU 137.A N TYR 134.A O no hydrogen 3.232 N/A ARG 141.A NH1 TYR 134.A O no hydrogen 3.400 N/A ARG 141.A NH1 CYS 135.A O no hydrogen 2.863 N/A LYS 146.A N PRO 143.A O no hydrogen 3.073 N/A ALA 147.A N PRO 143.A O no hydrogen 3.274 N/A VAL 148.A N LEU 144.A O no hydrogen 3.066 N/A ALA 149.A N GLU 145.A O no hydrogen 3.124 N/A ASN 150.A N LYS 146.A O no hydrogen 3.035 N/A ASN 150.A ND2 LYS 146.A O no hydrogen 3.616 N/A PHE 151.A N VAL 148.A O no hydrogen 3.055 N/A PHE 152.A N VAL 148.A O no hydrogen 3.253 N/A SER 153.A N LYS 113.A O no hydrogen 3.186 N/A SER 153.A OG GLY 112.A O no hydrogen 3.040 N/A SER 153.A OG LYS 113.A O no hydrogen 3.159 N/A SER 155.A N GLN 167.A O no hydrogen 2.731 N/A SER 155.A OG GLN 167.A O no hydrogen 3.552 N/A CYS 156.A N SER 115.A O no hydrogen 3.115 N/A CYS 156.A SG TYR 183.A O no hydrogen 3.960 N/A ALA 157.A N LEU 168.A O no hydrogen 2.827 N/A CYS 159.A N CYS 175.A O no hydrogen 3.222 N/A ALA 160.A N ALA 157.A O no hydrogen 3.006 N/A ASP 161.A N GLU 145.A OE2 no hydrogen 2.788 N/A ASP 164.A N ASP 161.A OD1 no hydrogen 3.023 N/A PHE 165.A N ASP 161.A O no hydrogen 2.991 N/A GLN 167.A N GLN 167.A OE1 no hydrogen 2.709 N/A LEU 168.A N PHE 165.A O no hydrogen 3.097 N/A CYS 169.A N PRO 166.A O no hydrogen 2.955 N/A LEU 171.A N SER 155.A O no hydrogen 3.202 N/A CYS 172.A N CYS 169.A O no hydrogen 3.076 N/A CYS 175.A N CYS 172.A O no hydrogen 2.984 N/A CYS 175.A SG ALA 157.A O no hydrogen 3.206 N/A CYS 175.A SG LEU 168.A O no hydrogen 3.603 N/A LEU 180.A N SER 178.A OG no hydrogen 3.203 N/A ASN 181.A N SER 178.A O no hydrogen 3.103 N/A ASN 181.A ND2 GLY 176.A O no hydrogen 3.078 N/A TYR 183.A N ASN 181.A OD1 no hydrogen 2.807 N/A GLY 185.A N THR 118.A O no hydrogen 3.040 N/A ALA 189.A N GLY 185.A O no hydrogen 3.138 N/A PHE 190.A N TYR 186.A O no hydrogen 3.238 N/A LYS 191.A N SER 187.A O no hydrogen 2.810 N/A LYS 191.A NZ GLN 182.A OE1 no hydrogen 3.505 N/A LYS 191.A NZ ASP 195.A OD2 no hydrogen 3.041 N/A CYS 192.A N GLY 188.A O no hydrogen 3.036 N/A LEU 193.A N ALA 189.A O no hydrogen 3.343 N/A LEU 193.A N PHE 190.A O no hydrogen 3.057 N/A LYS 194.A N PHE 190.A O no hydrogen 2.994 N/A LYS 194.A NZ ASP 195.A OD1 no hydrogen 3.321 N/A ASP 195.A N LYS 191.A O no hydrogen 2.717 N/A GLY 196.A N LEU 193.A O no hydrogen 2.890 N/A ALA 197.A N CYS 192.A O no hydrogen 2.928 N/A GLY 198.A N CYS 192.A O no hydrogen 3.107 N/A ASP 199.A N LYS 114.A O no hydrogen 2.647 N/A VAL 200.A N LYS 114.A O no hydrogen 3.183 N/A ALA 201.A N VAL 98.A O no hydrogen 2.975 N/A PHE 202.A N CYS 116.A O no hydrogen 2.946 N/A VAL 203.A N VAL 96.A O no hydrogen 2.974 N/A HIS 205.A N TYR 94.A O no hydrogen 2.817 N/A THR 207.A N LYS 204.A O no hydrogen 3.186 N/A PHE 209.A N SER 206.A O no hydrogen 2.994 N/A GLU 210.A N SER 206.A O no hydrogen 3.153 N/A GLU 210.A N THR 207.A O no hydrogen 3.159 N/A ASN 211.A ND2 THR 207.A O no hydrogen 2.727 N/A LYS 215.A NZ ASP 219.A OD1 no hydrogen 3.549 N/A ASP 217.A N ASN 214.A O no hydrogen 3.023 N/A ARG 218.A N LYS 215.A O no hydrogen 2.967 N/A ARG 218.A NE LEU 212.A O no hydrogen 3.349 N/A GLN 220.A N ASP 217.A O no hydrogen 3.314 N/A TYR 221.A N ARG 218.A O no hydrogen 3.302 N/A GLU 222.A N VAL 99.A O no hydrogen 2.872 N/A LEU 223.A N LYS 231.A O no hydrogen 2.806 N/A LEU 224.A N ALA 97.A O no hydrogen 2.963 N/A CYS 225.A N THR 229.A O no hydrogen 2.946 N/A CYS 225.A SG THR 229.A O no hydrogen 3.577 N/A CYS 225.A SG THR 229.A OG1 no hydrogen 3.685 N/A ASN 228.A N CYS 225.A O no hydrogen 3.120 N/A THR 229.A N ASP 227.A OD1 no hydrogen 3.202 N/A THR 229.A OG1 ASP 227.A OD1 no hydrogen 3.324 N/A THR 229.A OG1 ASP 227.A OD2 no hydrogen 3.543 N/A ARG 230.A NE PHE 105.A O no hydrogen 2.692 N/A ARG 230.A NH1 LYS 100.A O no hydrogen 2.843 N/A ARG 230.A NH1 SER 103.A OG no hydrogen 3.154 N/A ARG 230.A NH1 GLU 222.A OE1 no hydrogen 2.685 N/A ARG 230.A NH2 SER 103.A OG no hydrogen 2.654 N/A ARG 230.A NH2 PHE 105.A O no hydrogen 2.999 N/A LYS 231.A N LEU 223.A O no hydrogen 3.084 N/A GLU 235.A N PRO 232.A O no hydrogen 3.206 N/A ASP 238.A N GLU 235.A O no hydrogen 3.274 N/A CYS 239.A SG LEU 223.A O no hydrogen 3.403 N/A HIS 240.A ND1 TYR 236.A O no hydrogen 3.063 N/A LEU 241.A N ALA 95.A O no hydrogen 2.658 N/A ALA 242.A N ALA 95.A O no hydrogen 3.433 N/A GLN 243.A NE2 ARG 668.A O no hydrogen 3.048 N/A VAL 244.A N TYR 93.A O no hydrogen 2.729 N/A SER 246.A N THR 91.A O no hydrogen 3.102 N/A SER 246.A OG THR 91.A O no hydrogen 3.249 N/A HIS 247.A ND1 GLU 81.A OE2 no hydrogen 2.780 N/A THR 248.A N LEU 60.A O no hydrogen 2.885 N/A VAL 249.A N VAL 79.A O no hydrogen 2.888 N/A VAL 250.A N VAL 58.A O no hydrogen 2.854 N/A ALA 251.A N LYS 76.A O no hydrogen 2.873 N/A ARG 252.A NE ILE 50.A O no hydrogen 2.840 N/A ARG 252.A NH2 ALA 55.A O no hydrogen 2.759 N/A ARG 252.A NH2 ASP 56.A OD1 no hydrogen 2.619 N/A SER 253.A N ASN 74.A O no hydrogen 3.199 N/A SER 253.A OG ASN 74.A O no hydrogen 2.592 N/A LYS 257.A NZ ASP 56.A OD1 no hydrogen 3.500 N/A LYS 257.A NZ ASP 56.A OD2 no hydrogen 3.088 N/A LEU 260.A N ASP 259.A OD1 no hydrogen 2.838 N/A ILE 261.A N LYS 257.A O no hydrogen 2.583 N/A TRP 262.A N GLU 258.A O no hydrogen 2.768 N/A GLU 263.A N ASP 259.A O no hydrogen 2.927 N/A LEU 264.A N LEU 260.A O no hydrogen 2.926 N/A LEU 265.A N ILE 261.A O no hydrogen 2.985 N/A ASN 266.A N TRP 262.A O no hydrogen 2.763 N/A GLN 267.A N GLU 263.A O no hydrogen 3.088 N/A ALA 268.A N LEU 264.A O no hydrogen 2.760 N/A GLN 269.A N LEU 265.A O no hydrogen 2.946 N/A GLN 269.A NE2 ASN 266.A OD1 no hydrogen 3.100 N/A GLN 269.A NE2 PHE 300.A O no hydrogen 3.253 N/A GLU 270.A N ASN 266.A O no hydrogen 2.868 N/A HIS 271.A N GLN 267.A O no hydrogen 3.110 N/A PHE 272.A N ALA 268.A O no hydrogen 2.892 N/A GLY 273.A N GLN 269.A O no hydrogen 2.872 N/A LYS 276.A N GLY 273.A O no hydrogen 3.295 N/A LYS 278.A NZ HIS 271.A O no hydrogen 3.060 N/A GLN 281.A NE2 LYS 278.A O no hydrogen 3.395 N/A LEU 282.A N PHE 272.A O no hydrogen 2.990 N/A ASP 290.A N ASP 295.A OD2 no hydrogen 3.151 N/A LEU 292.A N GLU 13.A OE2 no hydrogen 2.992 N/A LYS 294.A N GLU 81.A OE1 no hydrogen 3.290 N/A LYS 294.A N GLU 81.A OE2 no hydrogen 3.237 N/A LYS 294.A NZ ASP 61.A OD1 no hydrogen 3.179 N/A ASP 295.A N ASP 290.A OD1 no hydrogen 2.777 N/A ALA 297.A N LYS 294.A O no hydrogen 3.098 N/A HIS 298.A N PHE 82.A O no hydrogen 2.824 N/A PHE 300.A N GLN 269.A OE1 no hydrogen 3.157 N/A LEU 301.A N ALA 80.A O no hydrogen 2.781 N/A VAL 303.A N VAL 78.A O no hydrogen 2.902 N/A ARG 306.A NH1 ARG 306.A O no hydrogen 2.836 N/A MET 307.A N PRO 304.A O no hydrogen 3.082 N/A LYS 310.A NZ GLU 379.A OE1 no hydrogen 2.946 N/A MET 311.A N ASP 308.A OD1 no hydrogen 2.898 N/A TYR 312.A N ASP 308.A O no hydrogen 3.207 N/A TYR 312.A N ALA 309.A O no hydrogen 3.097 N/A LEU 313.A N ALA 309.A O no hydrogen 3.075 N/A GLY 314.A N LYS 310.A O no hydrogen 3.080 N/A TYR 315.A OH ASP 583.A OD2 no hydrogen 3.398 N/A VAL 318.A N GLY 314.A O no hydrogen 3.173 N/A THR 319.A N TYR 315.A O no hydrogen 2.830 N/A THR 319.A OG1 TYR 315.A O no hydrogen 2.708 N/A ALA 320.A N GLU 316.A O no hydrogen 3.014 N/A ILE 321.A N TYR 317.A O no hydrogen 2.920 N/A ARG 322.A N VAL 318.A O no hydrogen 2.897 N/A ASN 323.A N THR 319.A O no hydrogen 3.026 N/A ASN 323.A ND2 GLY 131.A O no hydrogen 3.027 N/A LEU 324.A N ALA 320.A O no hydrogen 3.056 N/A ARG 325.A N ILE 321.A O no hydrogen 2.992 N/A ARG 325.A NH2 ASP 67.A OD1 no hydrogen 2.921 N/A GLU 326.A N ARG 322.A O no hydrogen 2.659 N/A GLU 332.A N GLU 332.A OE1 no hydrogen 2.662 N/A VAL 336.A N LYS 359.A O no hydrogen 3.330 N/A LYS 337.A N ASP 381.A OD2 no hydrogen 2.814 N/A LYS 337.A NZ ASP 381.A OD2 no hydrogen 3.244 N/A TRP 338.A N GLU 361.A O no hydrogen 2.818 N/A CYS 339.A N ALA 382.A O no hydrogen 3.061 N/A CYS 339.A SG VAL 363.A O no hydrogen 3.900 N/A ALA 340.A N VAL 363.A O no hydrogen 2.941 N/A LEU 341.A N GLU 345.A OE1 no hydrogen 2.996 N/A GLU 345.A N SER 342.A OG no hydrogen 2.837 N/A ARG 346.A N SER 342.A O no hydrogen 2.931 N/A ARG 346.A NE ASP 350.A OD2 no hydrogen 3.295 N/A ARG 346.A NH1 ASP 350.A OD1 no hydrogen 3.290 N/A ARG 346.A NH2 SER 364.A OG no hydrogen 3.275 N/A LEU 347.A N HIS 343.A O no hydrogen 3.083 N/A LYS 348.A N HIS 344.A O no hydrogen 3.243 N/A LYS 348.A NZ LEU 612.A O no hydrogen 2.984 N/A LYS 348.A NZ ARG 614.A O no hydrogen 3.067 N/A LYS 348.A NZ LEU 620.A O no hydrogen 2.576 N/A CYS 349.A N GLU 345.A O no hydrogen 2.966 N/A CYS 349.A N ARG 346.A O no hydrogen 3.157 N/A ASP 350.A N ARG 346.A O no hydrogen 2.973 N/A ASP 350.A N LEU 347.A O no hydrogen 3.257 N/A GLU 351.A N LEU 347.A O no hydrogen 3.392 N/A TRP 352.A N LYS 348.A O no hydrogen 3.313 N/A TRP 352.A NE1 GLN 595.A OE1 no hydrogen 3.111 N/A SER 353.A N CYS 349.A O no hydrogen 2.888 N/A SER 353.A OG ILE 360.A O no hydrogen 2.716 N/A VAL 354.A N ASP 350.A O no hydrogen 3.382 N/A ASN 355.A N GLU 351.A O no hydrogen 3.281 N/A SER 356.A N TRP 352.A O no hydrogen 3.429 N/A SER 356.A OG TRP 352.A O no hydrogen 2.967 N/A SER 356.A OG SER 353.A O no hydrogen 2.775 N/A GLU 361.A N VAL 336.A O no hydrogen 2.970 N/A CYS 362.A SG CYS 349.A O no hydrogen 2.892 N/A VAL 363.A N TRP 338.A O no hydrogen 2.988 N/A ALA 365.A N ALA 340.A O no hydrogen 3.005 N/A THR 367.A N ASP 370.A OD2 no hydrogen 3.309 N/A ASP 370.A N THR 367.A OG1 no hydrogen 3.321 N/A CYS 371.A SG ALA 340.A O no hydrogen 4.045 N/A ILE 372.A N THR 368.A O no hydrogen 2.889 N/A ALA 373.A N GLU 369.A O no hydrogen 2.997 N/A LYS 374.A N ASP 370.A O no hydrogen 3.278 N/A ILE 375.A N CYS 371.A O no hydrogen 2.957 N/A MET 376.A N ILE 372.A O no hydrogen 2.828 N/A ASN 377.A N ALA 373.A O no hydrogen 3.153 N/A GLY 378.A N ILE 375.A O no hydrogen 3.128 N/A GLU 379.A N LYS 374.A O no hydrogen 2.763 N/A GLU 379.A N ASN 377.A OD1 no hydrogen 3.337 N/A ALA 380.A N LYS 374.A O no hydrogen 2.953 N/A ASP 381.A N LYS 337.A O no hydrogen 2.623 N/A ALA 382.A N LYS 337.A O no hydrogen 3.185 N/A MET 383.A N VAL 579.A O no hydrogen 3.473 N/A SER 384.A OG ALA 577.A O no hydrogen 3.327 N/A LEU 385.A N ALA 577.A O no hydrogen 2.773 N/A GLY 388.A N ASP 386.A OD2 no hydrogen 3.351 N/A PHE 389.A N ASP 386.A O no hydrogen 3.133 N/A VAL 390.A N ASP 386.A O no hydrogen 2.893 N/A TYR 391.A N GLY 387.A O no hydrogen 3.063 N/A ILE 392.A N GLY 388.A O no hydrogen 3.483 N/A ALA 393.A N PHE 389.A O no hydrogen 2.609 N/A GLY 394.A N VAL 390.A O no hydrogen 2.814 N/A LYS 395.A N TYR 391.A O no hydrogen 2.939 N/A CYS 396.A SG ILE 392.A O no hydrogen 3.302 N/A CYS 396.A SG LEU 661.A O no hydrogen 4.029 N/A GLY 397.A N GLY 394.A O no hydrogen 2.538 N/A LEU 398.A N ALA 393.A O no hydrogen 2.763 N/A VAL 399.A N THR 580.A O no hydrogen 2.658 N/A VAL 401.A N VAL 578.A O no hydrogen 2.797 N/A ALA 403.A N ALA 630.A O no hydrogen 3.240 N/A GLU 404.A N HIS 576.A O no hydrogen 2.730 N/A ASN 405.A N CYS 628.A O no hydrogen 2.799 N/A THR 412.A OG1 CYS 409.A O no hydrogen 2.747 N/A THR 412.A OG1 ASP 411.A O no hydrogen 2.588 N/A GLY 416.A N GLU 414.A OE2 no hydrogen 2.983 N/A PHE 418.A N HIS 526.A ND1 no hydrogen 3.175 N/A ALA 419.A N ALA 571.A O no hydrogen 3.006 N/A ILE 420.A N VAL 524.A O no hydrogen 2.774 N/A VAL 422.A N ALA 522.A O no hydrogen 2.782 N/A VAL 423.A N GLU 551.A O no hydrogen 2.785 N/A LYS 425.A N ASP 549.A O no hydrogen 2.702 N/A SER 428.A OG LYS 425.A O no hydrogen 3.528 N/A SER 428.A OG SER 426.A O no hydrogen 3.552 N/A ASP 429.A N ASP 429.A OD1 no hydrogen 2.520 N/A GLY 437.A N PHE 470.A O no hydrogen 2.783 N/A LYS 439.A N ASP 520.A OD2 no hydrogen 3.211 N/A LYS 439.A NZ GLU 473.A OE2 no hydrogen 2.836 N/A SER 440.A N GLU 473.A O no hydrogen 3.319 N/A SER 440.A OG HIS 442.A NE2 no hydrogen 2.945 N/A CYS 441.A N VAL 521.A O no hydrogen 2.729 N/A HIS 442.A N CYS 475.A O no hydrogen 2.871 N/A HIS 442.A ND1 GLY 450.A O no hydrogen 2.964 N/A HIS 442.A NE2 SER 440.A OG no hydrogen 2.945 N/A ALA 444.A N THR 443.A OG1 no hydrogen 2.809 N/A VAL 445.A N PRO 477.A O no hydrogen 3.089 N/A ARG 447.A NH1 TYR 506.A OH no hydrogen 3.077 N/A ARG 447.A NH2 TYR 506.A OH no hydrogen 3.348 N/A THR 448.A N ASP 386.A OD2 no hydrogen 2.776 N/A THR 448.A OG1 ASP 386.A OD1 no hydrogen 2.889 N/A THR 448.A OG1 ASP 386.A OD2 no hydrogen 3.462 N/A THR 448.A OG1 TYR 646.A OH no hydrogen 2.897 N/A TRP 451.A N ARG 447.A O no hydrogen 2.911 N/A ASN 452.A N ARG 447.A O no hydrogen 2.668 N/A ASN 452.A ND2 GLY 446.A O no hydrogen 3.128 N/A ASN 452.A ND2 TYR 646.A OH no hydrogen 2.930 N/A ILE 453.A N THR 448.A O no hydrogen 2.927 N/A MET 455.A N TRP 451.A O no hydrogen 2.908 N/A GLY 456.A N ASN 452.A O no hydrogen 2.971 N/A LEU 457.A N ILE 453.A O no hydrogen 3.027 N/A LEU 458.A N PRO 454.A O no hydrogen 3.030 N/A TYR 459.A N MET 455.A O no hydrogen 2.935 N/A ASN 460.A N LEU 457.A O no hydrogen 3.108 N/A LYS 461.A N LEU 458.A O no hydrogen 3.147 N/A ILE 462.A N TYR 459.A O no hydrogen 3.320 N/A ASN 463.A N TYR 459.A O no hydrogen 2.779 N/A CYS 465.A SG ASN 652.A O no hydrogen 3.781 N/A ARG 466.A N HIS 464.A ND1 no hydrogen 3.223 N/A ARG 466.A NE GLU 469.A OE1 no hydrogen 3.517 N/A ARG 466.A NH1 GLU 469.A OE1 no hydrogen 3.421 N/A PHE 470.A N PHE 467.A O no hydrogen 3.086 N/A PHE 471.A N PHE 467.A O no hydrogen 3.116 N/A SER 472.A N LYS 438.A O no hydrogen 3.193 N/A SER 472.A OG GLY 437.A O no hydrogen 3.373 N/A GLU 473.A N SER 472.A OG no hydrogen 2.691 N/A GLY 474.A N SER 484.A O no hydrogen 3.116 N/A CYS 475.A N SER 440.A O no hydrogen 2.950 N/A ALA 476.A N LEU 485.A O no hydrogen 2.926 N/A GLY 478.A N CYS 497.A O no hydrogen 2.748 N/A SER 479.A N ALA 476.A O no hydrogen 3.211 N/A SER 479.A OG ALA 476.A O no hydrogen 2.953 N/A LYS 481.A NZ GLU 498.A OE1 no hydrogen 2.678 N/A SER 483.A N LYS 480.A O no hydrogen 2.582 N/A SER 484.A OG ASP 468.A O no hydrogen 2.874 N/A LEU 485.A N SER 483.A OG no hydrogen 3.141 N/A CYS 486.A N SER 483.A O no hydrogen 3.255 N/A CYS 486.A SG LYS 480.A O no hydrogen 3.585 N/A LEU 488.A N GLY 474.A O no hydrogen 2.938 N/A CYS 489.A N CYS 486.A O no hydrogen 3.335 N/A MET 490.A N GLU 503.A OE2 no hydrogen 2.907 N/A GLY 491.A N GLU 503.A OE1 no hydrogen 3.080 N/A ASN 495.A N SER 492.A O no hydrogen 3.361 N/A ASN 495.A ND2 SER 492.A O no hydrogen 3.223 N/A CYS 497.A N GLU 503.A OE1 no hydrogen 2.693 N/A CYS 497.A SG LEU 485.A O no hydrogen 3.997 N/A GLU 498.A N ASN 495.A O no hydrogen 3.088 N/A ASN 500.A N GLU 498.A O no hydrogen 2.806 N/A LYS 502.A N ASN 500.A OD1 no hydrogen 2.887 N/A GLU 503.A N ASN 500.A O no hydrogen 3.095 N/A TYR 505.A N GLU 503.A OE2 no hydrogen 3.263 N/A TYR 505.A OH GLU 517.A OE1 no hydrogen 2.435 N/A TYR 506.A N GLU 503.A O no hydrogen 3.072 N/A GLY 507.A N THR 443.A O no hydrogen 2.682 N/A TYR 508.A OH HIS 576.A NE2 no hydrogen 2.832 N/A ALA 511.A N GLY 507.A O no hydrogen 3.144 N/A PHE 512.A N TYR 508.A O no hydrogen 3.423 N/A ARG 513.A N THR 509.A O no hydrogen 2.866 N/A ARG 513.A NE GLU 517.A OE1 no hydrogen 3.189 N/A ARG 513.A NE GLU 517.A OE2 no hydrogen 2.931 N/A ARG 513.A NH2 GLU 517.A OE2 no hydrogen 2.984 N/A CYS 514.A N GLY 510.A O no hydrogen 2.850 N/A LEU 515.A N ALA 511.A O no hydrogen 2.924 N/A VAL 516.A N PHE 512.A O no hydrogen 2.842 N/A GLU 517.A N ARG 513.A O no hydrogen 2.864 N/A LYS 518.A N CYS 514.A O no hydrogen 2.633 N/A LYS 518.A NZ LEU 488.A O no hydrogen 3.107 N/A GLY 519.A N CYS 514.A O no hydrogen 2.893 N/A ASP 520.A N LYS 439.A O no hydrogen 3.107 N/A VAL 521.A N LYS 439.A O no hydrogen 3.242 N/A ALA 522.A N VAL 422.A O no hydrogen 2.941 N/A PHE 523.A N CYS 441.A O no hydrogen 2.984 N/A VAL 524.A N ILE 420.A O no hydrogen 3.025 N/A LYS 525.A NZ ASP 625.A OD1 no hydrogen 3.372 N/A THR 528.A N LYS 525.A O no hydrogen 3.364 N/A THR 528.A OG1 LYS 525.A O no hydrogen 3.158 N/A GLN 531.A N GLN 527.A O no hydrogen 3.308 N/A GLN 531.A NE2 GLN 527.A O no hydrogen 2.634 N/A ASN 532.A N THR 528.A O no hydrogen 3.242 N/A ASN 532.A N VAL 529.A O no hydrogen 2.981 N/A ASN 532.A ND2 THR 528.A O no hydrogen 2.911 N/A THR 533.A OG1 VAL 529.A O no hydrogen 2.919 N/A THR 533.A OG1 PRO 530.A O no hydrogen 3.445 N/A GLY 534.A N LEU 545.A O no hydrogen 3.089 N/A LYS 536.A N THR 533.A O no hydrogen 3.229 N/A ASN 537.A ND2 ASN 532.A OD1 no hydrogen 2.769 N/A ASP 539.A N ASN 537.A OD1 no hydrogen 3.264 N/A ALA 542.A N ASP 539.A O no hydrogen 2.889 N/A LYS 543.A N ASP 539.A O no hydrogen 2.845 N/A LEU 545.A N ALA 542.A O no hydrogen 3.417 N/A ASP 549.A N ASN 546.A O no hydrogen 2.964 N/A TYR 550.A N GLU 547.A O no hydrogen 2.968 N/A GLU 551.A N VAL 423.A O no hydrogen 3.090 N/A LEU 552.A N LYS 560.A O no hydrogen 2.983 N/A LEU 553.A N ALA 421.A O no hydrogen 2.867 N/A CYS 554.A N THR 558.A O no hydrogen 3.350 N/A GLY 557.A N CYS 554.A O no hydrogen 3.213 N/A THR 558.A OG1 ASP 556.A OD1 no hydrogen 3.249 N/A THR 558.A OG1 ASP 556.A OD2 no hydrogen 3.148 N/A ARG 559.A NE GLU 551.A OE1 no hydrogen 3.079 N/A ARG 559.A NH1 ALA 427.A O no hydrogen 2.795 N/A ARG 559.A NH1 LEU 430.A O no hydrogen 2.901 N/A ARG 559.A NH2 LYS 424.A O no hydrogen 3.538 N/A ARG 559.A NH2 ALA 427.A O no hydrogen 3.329 N/A ARG 559.A NH2 GLU 551.A OE1 no hydrogen 2.617 N/A GLU 564.A N PRO 561.A O no hydrogen 3.040 N/A ASN 567.A N GLU 564.A O no hydrogen 3.395 N/A CYS 568.A N GLU 564.A O no hydrogen 2.806 N/A LEU 570.A N ALA 419.A O no hydrogen 2.675 N/A ARG 572.A NE GLY 416.A O no hydrogen 2.938 N/A ALA 573.A N TYR 417.A O no hydrogen 2.591 N/A ASN 575.A ND2 ASN 405.A OD1 no hydrogen 3.479 N/A HIS 576.A NE2 TYR 508.A OH no hydrogen 2.832 N/A ALA 577.A N LEU 385.A O no hydrogen 3.121 N/A VAL 578.A N LEU 402.A O no hydrogen 2.695 N/A VAL 579.A N MET 383.A O no hydrogen 3.038 N/A THR 580.A N VAL 399.A O no hydrogen 2.894 N/A THR 580.A OG1 ASP 381.A O no hydrogen 2.338 N/A ARG 581.A NH1 ILE 375.A O no hydrogen 2.792 N/A ARG 581.A NH1 ALA 380.A O no hydrogen 2.771 N/A ARG 581.A NH2 ASP 381.A OD1 no hydrogen 2.681 N/A LYS 584.A N ARG 581.A O no hydrogen 2.813 N/A VAL 588.A N LYS 584.A O no hydrogen 2.739 N/A HIS 589.A N GLU 585.A O no hydrogen 3.099 N/A HIS 589.A ND1 HIS 589.A O no hydrogen 3.075 N/A LYS 590.A N ALA 586.A O no hydrogen 3.121 N/A LYS 590.A N CYS 587.A O no hydrogen 3.326 N/A ILE 591.A N CYS 587.A O no hydrogen 3.045 N/A LEU 592.A N VAL 588.A O no hydrogen 3.020 N/A GLN 594.A N LYS 590.A O no hydrogen 3.277 N/A GLN 595.A N ILE 591.A O no hydrogen 3.126 N/A GLN 595.A N LEU 592.A O no hydrogen 2.897 N/A GLN 596.A NE2 LEU 629.A O no hydrogen 3.527 N/A SER 601.A OG VAL 627.A O no hydrogen 2.735 N/A THR 604.A OG1 ASP 605.A OD1 no hydrogen 3.394 N/A CYS 611.A SG VAL 603.A O no hydrogen 3.561 N/A LEU 612.A N PHE 599.A O no hydrogen 2.805 N/A SER 615.A OG ASP 624.A OD1 no hydrogen 2.574 N/A SER 615.A OG ASP 624.A OD2 no hydrogen 3.325 N/A LEU 620.A N SER 615.A OG no hydrogen 2.880 N/A LEU 621.A N GLU 345.A OE2 no hydrogen 2.970 N/A PHE 622.A N LEU 620.A O no hydrogen 2.506 N/A ARG 623.A N GLU 404.A OE1 no hydrogen 3.212 N/A ASP 624.A N ASP 619.A OD1 no hydrogen 2.737 N/A THR 626.A OG1 GLU 404.A OE1 no hydrogen 3.326 N/A THR 626.A OG1 ARG 623.A O no hydrogen 3.079 N/A VAL 627.A N ASN 405.A O no hydrogen 2.642 N/A ALA 630.A N ALA 403.A O no hydrogen 2.681 N/A LYS 631.A N GLU 410.A O no hydrogen 3.239 N/A HIS 633.A NE2 ASP 411.A OD2 no hydrogen 3.047 N/A ARG 635.A N LEU 632.A O no hydrogen 2.967 N/A ASN 636.A N ASP 634.A O no hydrogen 2.888 N/A LYS 640.A NZ ASP 634.A O no hydrogen 2.826 N/A LYS 640.A NZ ASP 634.A OD1 no hydrogen 3.424 N/A TYR 641.A N THR 637.A O no hydrogen 2.754 N/A TYR 641.A OH ASN 575.A O no hydrogen 2.803 N/A LEU 642.A N TYR 638.A O no hydrogen 3.327 N/A GLY 643.A N GLU 639.A O no hydrogen 2.928 N/A GLU 644.A N GLU 644.A OE1 no hydrogen 3.023 N/A TYR 646.A OH THR 448.A OG1 no hydrogen 2.897 N/A VAL 647.A N GLY 643.A O no hydrogen 3.284 N/A LYS 648.A N GLU 644.A O no hydrogen 3.012 N/A ALA 649.A N GLU 645.A O no hydrogen 3.403 N/A VAL 650.A N TYR 646.A O no hydrogen 3.025 N/A GLY 651.A N VAL 647.A O no hydrogen 2.758 N/A ASN 652.A N LYS 648.A O no hydrogen 3.311 N/A LEU 653.A N ALA 649.A O no hydrogen 2.966 N/A ARG 654.A N VAL 650.A O no hydrogen 2.924 N/A LYS 655.A N ASN 652.A O no hydrogen 3.431 N/A CYS 656.A N LEU 653.A O no hydrogen 3.165 N/A SER 657.A N ARG 654.A O no hydrogen 3.236 N/A SER 659.A OG GLU 369.A OE1 no hydrogen 3.539 N/A SER 659.A OG GLU 369.A OE2 no hydrogen 2.689 N/A GLU 663.A N SER 659.A O no hydrogen 3.117 N/A ALA 664.A N SER 660.A O no hydrogen 3.066 N/A CYS 665.A N LEU 661.A O no hydrogen 2.984 N/A CYS 665.A SG LEU 661.A O no hydrogen 3.175 N/A THR 666.A N LEU 662.A O no hydrogen 2.905 N/A THR 666.A OG1 LEU 662.A O no hydrogen 2.891 N/A THR 666.A OG1 GLU 663.A O no hydrogen 3.507 N/A PHE 667.A N ALA 664.A O no hydrogen 3.013 N/A ARG 669.A N CYS 665.A O no hydrogen 3.104 N/A ARG 669.A NH2 ASP 238.A OD2 no hydrogen 2.696 N/A