Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 9axf_Q.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N GLY 2.A O no hydrogen 3.010 N/A GLN 5.A NE2 GLU 331.A OE1 no hydrogen 3.307 N/A ALA 7.A N ILE 78.A O no hydrogen 2.953 N/A GLN 8.A N HIS 325.A O no hydrogen 3.104 N/A LYS 9.A N TYR 76.A O no hydrogen 2.924 N/A ASP 12.A N THR 73.A O no hydrogen 2.926 N/A ILE 13.A N THR 73.A O no hydrogen 3.174 N/A LEU 15.A N GLY 75.A O no hydrogen 3.318 N/A GLY 16.A N ALA 121.A O no hydrogen 2.729 N/A LEU 18.A N VAL 123.A O no hydrogen 2.968 N/A PHE 19.A N PHE 79.A O no hydrogen 3.289 N/A ILE 21.A N ASP 80.A OD1 no hydrogen 2.613 N/A HIS 22.A ND1 ASP 80.A OD2 no hydrogen 3.100 N/A HIS 22.A NE2 GLU 331.A OE2 no hydrogen 3.049 N/A PHE 23.A N ARG 43.A O no hydrogen 3.365 N/A GLN 30.A N ASP 29.A OD1 no hydrogen 2.768 N/A LYS 33.A N ASP 31.A OD1 no hydrogen 3.509 N/A LYS 33.A NZ ASP 31.A OD2 no hydrogen 3.020 N/A CYS 41.A SG ASP 80.A OD2 no hydrogen 3.777 N/A ILE 42.A N GLY 24.A O no hydrogen 2.864 N/A ARG 43.A NH1 GLU 258.A OE2 no hydrogen 3.311 N/A ASN 45.A N ILE 21.A O no hydrogen 2.907 N/A ASN 45.A ND2 PRO 20.A O no hydrogen 3.496 N/A ARG 47.A N ASN 45.A OD1 no hydrogen 3.175 N/A PHE 49.A N ASN 45.A O no hydrogen 3.409 N/A ARG 50.A N PHE 46.A O no hydrogen 2.943 N/A ARG 50.A NE PRO 357.A O no hydrogen 3.363 N/A ARG 50.A NE TYR 358.A O no hydrogen 3.116 N/A ARG 50.A NH2 PRO 357.A O no hydrogen 2.967 N/A TRP 51.A N ARG 47.A O no hydrogen 2.947 N/A LEU 52.A N GLY 48.A O no hydrogen 2.949 N/A GLN 53.A N PHE 49.A O no hydrogen 2.917 N/A ALA 54.A N ARG 50.A O no hydrogen 2.883 N/A MET 55.A N TRP 51.A O no hydrogen 3.011 N/A ILE 56.A N LEU 52.A O no hydrogen 3.005 N/A PHE 57.A N GLN 53.A O no hydrogen 2.828 N/A ALA 58.A N ALA 54.A O no hydrogen 2.931 N/A ILE 59.A N MET 55.A O no hydrogen 2.994 N/A GLU 60.A N ILE 56.A O no hydrogen 2.920 N/A GLU 61.A N PHE 57.A O no hydrogen 2.897 N/A ILE 62.A N ALA 58.A O no hydrogen 2.938 N/A ASN 63.A N ILE 59.A O no hydrogen 2.951 N/A ASN 63.A ND2 LEU 74.A O no hydrogen 3.054 N/A SER 64.A N GLU 60.A O no hydrogen 2.883 N/A SER 64.A OG GLU 60.A O no hydrogen 2.945 N/A SER 65.A N GLU 61.A O no hydrogen 3.133 N/A ALA 67.A N SER 65.A OG no hydrogen 3.411 N/A LEU 72.A N LEU 69.A O no hydrogen 3.419 N/A THR 73.A N ASP 12.A OD2 no hydrogen 3.348 N/A LEU 74.A N ASN 63.A OD1 no hydrogen 2.985 N/A GLY 75.A N ILE 13.A O no hydrogen 2.815 N/A TYR 76.A N LYS 9.A O no hydrogen 2.928 N/A ARG 77.A N LEU 15.A O no hydrogen 3.108 N/A ILE 78.A N ALA 7.A O no hydrogen 2.871 N/A PHE 79.A N GLY 17.A O no hydrogen 3.290 N/A THR 81.A N PHE 19.A O no hydrogen 3.139 N/A CYS 82.A N ASP 80.A OD1 no hydrogen 3.252 N/A CYS 82.A SG ASP 80.A OD2 no hydrogen 3.159 N/A ASN 83.A N THR 81.A OG1 no hydrogen 3.248 N/A ASN 83.A ND2 PHE 23.A O no hydrogen 3.082 N/A THR 84.A N THR 81.A O no hydrogen 3.043 N/A THR 84.A OG1 CYS 82.A O no hydrogen 2.748 N/A LEU 89.A N VAL 85.A O no hydrogen 2.885 N/A GLU 90.A N SER 86.A O no hydrogen 2.954 N/A ALA 91.A N LYS 87.A O no hydrogen 2.983 N/A THR 92.A N ALA 88.A O no hydrogen 2.853 N/A THR 92.A OG1 ALA 88.A O no hydrogen 2.556 N/A LEU 93.A N LEU 89.A O no hydrogen 2.894 N/A SER 94.A N GLU 90.A O no hydrogen 2.997 N/A PHE 95.A N ALA 91.A O no hydrogen 2.910 N/A VAL 96.A N THR 92.A O no hydrogen 2.914 N/A GLN 98.A NE2 ILE 116.A O no hydrogen 2.688 N/A LYS 100.A N VAL 96.A O no hydrogen 2.867 N/A LYS 100.A NZ LEU 93.A O no hydrogen 3.203 N/A ILE 101.A N ALA 97.A O no hydrogen 2.956 N/A ASP 102.A N GLN 98.A O no hydrogen 2.948 N/A SER 103.A N LYS 100.A O no hydrogen 2.969 N/A SER 103.A OG ASN 99.A O no hydrogen 3.304 N/A SER 103.A OG LYS 100.A O no hydrogen 3.020 N/A ILE 116.A N SER 113.A O no hydrogen 3.387 N/A ILE 120.A N ILE 14.A O no hydrogen 2.928 N/A VAL 122.A N PRO 144.A O no hydrogen 3.063 N/A VAL 123.A N GLY 16.A O no hydrogen 3.014 N/A GLY 124.A N VAL 146.A O no hydrogen 3.050 N/A ALA 125.A N SER 131.A OG no hydrogen 3.313 N/A THR 126.A OG1 TYR 148.A OH no hydrogen 3.130 N/A SER 131.A N GLY 127.A O no hydrogen 3.052 N/A SER 131.A OG GLY 127.A O no hydrogen 2.950 N/A SER 131.A OG SER 150.A OG no hydrogen 2.569 N/A THR 132.A N SER 128.A O no hydrogen 2.865 N/A THR 132.A OG1 SER 128.A O no hydrogen 2.974 N/A ALA 133.A N GLY 129.A O no hydrogen 3.005 N/A VAL 134.A N VAL 130.A O no hydrogen 2.949 N/A ALA 135.A N SER 131.A O no hydrogen 2.799 N/A ASN 136.A N THR 132.A O no hydrogen 2.942 N/A LEU 137.A N ALA 133.A O no hydrogen 3.098 N/A LEU 138.A N VAL 134.A O no hydrogen 2.849 N/A GLY 139.A N ALA 135.A O no hydrogen 2.843 N/A LEU 140.A N ASN 136.A O no hydrogen 3.010 N/A PHE 141.A N LEU 138.A O no hydrogen 2.927 N/A ILE 143.A N LEU 138.A O no hydrogen 3.178 N/A GLN 145.A N SER 163.A O no hydrogen 3.065 N/A GLN 145.A NE2 GLY 124.A O no hydrogen 2.863 N/A VAL 146.A N VAL 122.A O no hydrogen 2.837 N/A SER 147.A N LEU 165.A O no hydrogen 2.867 N/A SER 147.A OG ALA 125.A O no hydrogen 2.825 N/A SER 147.A OG SER 150.A OG no hydrogen 3.151 N/A TYR 148.A OH LEU 18.A O no hydrogen 2.680 N/A TYR 148.A OH THR 126.A OG1 no hydrogen 3.130 N/A SER 150.A N SER 147.A OG no hydrogen 3.131 N/A SER 150.A OG ALA 125.A O no hydrogen 2.769 N/A SER 150.A OG THR 126.A O no hydrogen 2.962 N/A SER 150.A OG GLY 127.A O no hydrogen 3.117 N/A SER 150.A OG SER 131.A OG no hydrogen 2.569 N/A SER 150.A OG SER 147.A OG no hydrogen 3.151 N/A SER 151.A OG ASP 171.A OD1 no hydrogen 3.178 N/A SER 151.A OG ASP 171.A OD2 no hydrogen 2.863 N/A SER 152.A OG ASP 198.A O no hydrogen 2.776 N/A LEU 154.A N SER 152.A OG no hydrogen 3.372 N/A LEU 155.A N SER 152.A O no hydrogen 3.480 N/A SER 156.A N ARG 153.A O no hydrogen 2.914 N/A SER 156.A OG ARG 153.A O no hydrogen 3.424 N/A SER 156.A OG ASP 434.A OD1 no hydrogen 3.562 N/A SER 156.A OG ASP 434.A OD2 no hydrogen 3.132 N/A LYS 158.A NZ LEU 155.A O no hydrogen 3.425 N/A LYS 158.A NZ PHE 161.A O no hydrogen 3.193 N/A LYS 158.A NZ PHE 164.A O no hydrogen 3.056 N/A LYS 158.A NZ CYS 432.A O no hydrogen 3.348 N/A ASN 159.A N ASN 157.A OD1 no hydrogen 3.229 N/A ASN 159.A ND2 ASN 157.A OD1 no hydrogen 3.350 N/A PHE 161.A N ASN 157.A O no hydrogen 2.903 N/A LYS 162.A NZ TYR 142.A OH no hydrogen 3.094 N/A SER 163.A OG ILE 143.A O no hydrogen 2.744 N/A LEU 165.A N GLN 145.A O no hydrogen 2.900 N/A ARG 166.A N GLY 433.A O no hydrogen 3.126 N/A ARG 166.A NE SER 150.A O no hydrogen 2.933 N/A ARG 166.A NH1 SER 156.A OG no hydrogen 3.291 N/A ARG 166.A NH2 SER 152.A O no hydrogen 2.530 N/A THR 167.A N SER 147.A O no hydrogen 3.188 N/A THR 167.A OG1 SER 147.A O no hydrogen 3.257 N/A THR 167.A OG1 ASN 369.A O no hydrogen 3.268 N/A ASP 171.A N ASN 170.A OD1 no hydrogen 2.354 N/A ALA 175.A N ASP 171.A O no hydrogen 3.321 N/A THR 176.A N GLU 172.A O no hydrogen 2.999 N/A THR 176.A OG1 GLU 172.A O no hydrogen 2.957 N/A THR 176.A OG1 GLU 210.A OE2 no hydrogen 2.496 N/A ALA 177.A N HIS 173.A O no hydrogen 2.822 N/A MET 178.A N GLN 174.A O no hydrogen 2.922 N/A ALA 179.A N ALA 175.A O no hydrogen 3.000 N/A ASP 180.A N THR 176.A O no hydrogen 2.899 N/A ILE 181.A N ALA 177.A O no hydrogen 2.862 N/A ILE 182.A N MET 178.A O no hydrogen 2.948 N/A GLU 183.A N ALA 179.A O no hydrogen 2.931 N/A TYR 184.A N ASP 180.A O no hydrogen 2.880 N/A TYR 184.A OH GLU 475.A OE1 no hydrogen 2.730 N/A PHE 185.A N ILE 181.A O no hydrogen 3.364 N/A ARG 186.A N GLU 183.A O no hydrogen 3.146 N/A TRP 187.A N ILE 182.A O no hydrogen 3.300 N/A TRP 189.A N SER 490.A O no hydrogen 3.140 N/A VAL 190.A N CYS 217.A O no hydrogen 3.154 N/A GLY 191.A N VAL 247.A O no hydrogen 3.030 N/A THR 192.A N PHE 220.A O no hydrogen 2.957 N/A THR 192.A OG1 PHE 220.A O no hydrogen 3.304 N/A ILE 193.A N VAL 249.A O no hydrogen 2.758 N/A ALA 194.A N GLU 222.A O no hydrogen 3.209 N/A ALA 195.A N PHE 251.A O no hydrogen 3.094 N/A ASP 196.A N ILE 224.A O no hydrogen 3.030 N/A TYR 199.A N ASP 197.A OD1 no hydrogen 2.852 N/A TYR 199.A OH SER 277.A OG no hydrogen 3.415 N/A GLY 200.A N ASP 197.A OD1 no hydrogen 2.721 N/A ARG 201.A N ASP 197.A O no hydrogen 3.426 N/A ARG 201.A NH1 ASP 196.A OD1 no hydrogen 2.680 N/A ILE 204.A N GLY 200.A O no hydrogen 2.912 N/A GLU 205.A N ARG 201.A O no hydrogen 2.936 N/A LYS 206.A N PRO 202.A O no hydrogen 2.944 N/A LYS 206.A NZ GLU 172.A O no hydrogen 3.380 N/A LYS 206.A NZ GLU 172.A OE1 no hydrogen 3.041 N/A LYS 206.A NZ GLU 210.A OE2 no hydrogen 3.426 N/A PHE 207.A N GLY 203.A O no hydrogen 2.924 N/A ARG 208.A N ILE 204.A O no hydrogen 2.884 N/A GLU 209.A N GLU 205.A O no hydrogen 2.959 N/A GLU 210.A N LYS 206.A O no hydrogen 2.997 N/A ALA 211.A N PHE 207.A O no hydrogen 2.854 N/A GLU 212.A N ARG 208.A O no hydrogen 2.910 N/A GLU 213.A N GLU 209.A O no hydrogen 2.989 N/A ARG 214.A N ALA 211.A O no hydrogen 3.106 N/A ARG 214.A NH1 GLU 210.A O no hydrogen 3.470 N/A ARG 214.A NH1 GLU 210.A OE1 no hydrogen 3.411 N/A ASP 215.A N GLU 212.A O no hydrogen 3.431 N/A ILE 216.A N ALA 211.A O no hydrogen 2.861 N/A CYS 217.A N ASN 188.A O no hydrogen 2.707 N/A ASP 219.A N VAL 190.A O no hydrogen 2.783 N/A GLU 222.A N THR 192.A O no hydrogen 3.146 N/A ILE 224.A N ALA 194.A O no hydrogen 2.909 N/A GLN 226.A N ASP 256.A OD1 no hydrogen 2.878 N/A TYR 227.A N SER 225.A OG no hydrogen 3.371 N/A SER 228.A OG SER 225.A O no hydrogen 3.148 N/A SER 228.A OG GLU 232.A OE1 no hydrogen 3.316 N/A GLU 231.A N ASP 229.A OD2 no hydrogen 2.999 N/A ILE 233.A N ASP 229.A O no hydrogen 3.023 N/A GLN 234.A N GLU 230.A O no hydrogen 2.900 N/A HIS 235.A N GLU 231.A O no hydrogen 2.893 N/A VAL 236.A N GLU 232.A O no hydrogen 2.935 N/A VAL 237.A N ILE 233.A O no hydrogen 2.930 N/A GLU 238.A N GLN 234.A O no hydrogen 2.914 N/A VAL 239.A N HIS 235.A O no hydrogen 2.947 N/A ILE 240.A N VAL 236.A O no hydrogen 2.895 N/A GLN 241.A N VAL 237.A O no hydrogen 2.959 N/A ASN 242.A N GLU 238.A O no hydrogen 2.902 N/A SER 243.A N VAL 239.A O no hydrogen 3.317 N/A SER 243.A OG ASP 219.A OD2 no hydrogen 2.869 N/A SER 243.A OG VAL 239.A O no hydrogen 3.319 N/A LYS 246.A N SER 490.A OG no hydrogen 3.381 N/A LYS 246.A NZ PHE 489.A O no hydrogen 2.387 N/A VAL 247.A N SER 490.A OG no hydrogen 3.384 N/A ILE 248.A N ILE 273.A O no hydrogen 2.749 N/A VAL 249.A N GLY 191.A O no hydrogen 2.858 N/A VAL 250.A N LEU 275.A O no hydrogen 3.185 N/A PHE 251.A N ILE 193.A O no hydrogen 3.141 N/A SER 252.A OG SER 253.A O no hydrogen 2.839 N/A LEU 257.A N SER 253.A O no hydrogen 2.846 N/A LEU 257.A N GLY 254.A O no hydrogen 3.232 N/A GLU 258.A N GLY 254.A O no hydrogen 2.933 N/A ILE 261.A N LEU 257.A O no hydrogen 3.171 N/A LYS 262.A N GLU 258.A O no hydrogen 2.907 N/A GLU 263.A N PRO 259.A O no hydrogen 2.938 N/A ILE 264.A N LEU 260.A O no hydrogen 2.935 N/A VAL 265.A N ILE 261.A O no hydrogen 2.903 N/A ARG 266.A N LYS 262.A O no hydrogen 2.890 N/A ARG 267.A N GLU 263.A O no hydrogen 2.954 N/A ASN 268.A N ILE 264.A O no hydrogen 2.658 N/A ILE 269.A N ILE 264.A O no hydrogen 3.315 N/A LYS 272.A NZ ALA 245.A O no hydrogen 3.451 N/A ILE 273.A N LYS 246.A O no hydrogen 2.608 N/A TRP 274.A NE1 VAL 294.A O no hydrogen 3.143 N/A LEU 275.A N ILE 248.A O no hydrogen 2.923 N/A ALA 276.A N ILE 299.A O no hydrogen 2.834 N/A SER 277.A OG TYR 199.A OH no hydrogen 3.415 N/A SER 277.A OG VAL 250.A O no hydrogen 3.358 N/A GLU 278.A N GLN 174.A OE1 no hydrogen 2.615 N/A TRP 280.A N SER 277.A O no hydrogen 3.384 N/A ALA 281.A N SER 277.A O no hydrogen 3.056 N/A SER 283.A N TRP 280.A O no hydrogen 3.488 N/A LEU 285.A N SER 283.A OG no hydrogen 3.302 N/A ALA 287.A N SER 283.A O no hydrogen 3.100 N/A TYR 291.A N MET 288.A O no hydrogen 2.997 N/A PHE 292.A N PRO 289.A O no hydrogen 2.924 N/A VAL 294.A N TYR 291.A O no hydrogen 2.895 N/A VAL 295.A N TYR 291.A O no hydrogen 3.132 N/A GLY 297.A N TRP 444.A O no hydrogen 3.031 N/A THR 298.A OG1 VAL 295.A O no hydrogen 2.513 N/A ILE 299.A N TRP 274.A O no hydrogen 3.197 N/A GLY 300.A N ILE 442.A O no hydrogen 2.931 N/A ALA 302.A N SER 440.A O no hydrogen 2.881 N/A LYS 304.A NZ ALA 305.A O no hydrogen 3.243 N/A GLY 306.A N LEU 364.A O no hydrogen 2.942 N/A PHE 311.A N ILE 308.A O no hydrogen 3.272 N/A ARG 312.A NH1 ILE 359.A O no hydrogen 3.188 N/A ARG 312.A NH2 ILE 359.A O no hydrogen 3.447 N/A GLU 313.A N GLU 313.A OE1 no hydrogen 2.695 N/A PHE 314.A N GLY 310.A O no hydrogen 3.231 N/A LEU 315.A N PHE 311.A O no hydrogen 2.897 N/A LYS 316.A N ARG 312.A O no hydrogen 2.936 N/A LYS 317.A N PHE 314.A O no hydrogen 3.238 N/A VAL 318.A N LEU 315.A O no hydrogen 3.403 N/A SER 323.A N HIS 319.A O no hydrogen 3.131 N/A SER 323.A OG HIS 319.A O no hydrogen 3.298 N/A HIS 325.A ND1 GLN 8.A O no hydrogen 3.232 N/A PHE 328.A N ASN 326.A OD1 no hydrogen 3.343 N/A LYS 330.A NZ SER 323.A O no hydrogen 3.308 N/A LYS 330.A NZ ASN 326.A O no hydrogen 3.345 N/A PHE 332.A N PHE 328.A O no hydrogen 3.364 N/A TRP 333.A N ALA 329.A O no hydrogen 2.909 N/A TRP 333.A NE1 GLU 349.A OE1 no hydrogen 2.773 N/A GLU 334.A N LYS 330.A O no hydrogen 2.926 N/A GLU 335.A N GLU 331.A O no hydrogen 2.917 N/A THR 336.A N PHE 332.A O no hydrogen 2.883 N/A THR 336.A OG1 PHE 332.A O no hydrogen 3.018 N/A PHE 337.A N TRP 333.A O no hydrogen 2.958 N/A CYS 339.A N GLU 334.A O no hydrogen 3.207 N/A HIS 340.A N PRO 343.A O no hydrogen 2.819 N/A LEU 341.A N GLU 334.A OE2 no hydrogen 3.224 N/A ARG 342.A NE ASN 338.A OD1 no hydrogen 3.404 N/A ARG 342.A NH2 ASN 338.A OD1 no hydrogen 3.181 N/A CYS 345.A N HIS 340.A O no hydrogen 2.676 N/A THR 346.A OG1 GLU 349.A OE2 no hydrogen 3.130 N/A GLY 347.A N GLU 349.A OE2 no hydrogen 3.352 N/A ASP 348.A N THR 346.A OG1 no hydrogen 3.238 N/A GLU 349.A N GLU 349.A OE1 no hydrogen 2.758 N/A SER 353.A N ASN 350.A O no hydrogen 3.307 N/A SER 353.A OG ASN 350.A O no hydrogen 2.536 N/A VAL 354.A N ILE 351.A O no hydrogen 3.245 N/A TYR 358.A OH LEU 315.A O no hydrogen 2.773 N/A ASP 360.A N THR 356.A O no hydrogen 3.254 N/A ARG 365.A NH1 LEU 303.A O no hydrogen 2.406 N/A TYR 368.A OH ASN 422.A OD1 no hydrogen 2.638 N/A ASN 369.A N ARG 365.A O no hydrogen 3.302 N/A ASN 369.A ND2 TYR 148.A O no hydrogen 3.018 N/A VAL 370.A N ILE 366.A O no hydrogen 2.955 N/A TYR 371.A N SER 367.A O no hydrogen 2.943 N/A TYR 371.A OH GLU 61.A OE1 no hydrogen 3.319 N/A TYR 371.A OH TYR 375.A OH no hydrogen 3.056 N/A LEU 372.A N TYR 368.A O no hydrogen 2.855 N/A ALA 373.A N ASN 369.A O no hydrogen 2.914 N/A VAL 374.A N VAL 370.A O no hydrogen 2.978 N/A TYR 375.A N TYR 371.A O no hydrogen 3.004 N/A TYR 375.A OH TYR 371.A OH no hydrogen 3.056 N/A SER 376.A N LEU 372.A O no hydrogen 2.821 N/A SER 376.A OG LEU 372.A O no hydrogen 3.146 N/A SER 376.A OG ALA 373.A O no hydrogen 2.456 N/A ILE 377.A N ALA 373.A O no hydrogen 3.038 N/A ALA 378.A N VAL 374.A O no hydrogen 2.938 N/A HIS 379.A N TYR 375.A O no hydrogen 2.828 N/A ALA 380.A N SER 376.A O no hydrogen 2.961 N/A LEU 381.A N ILE 377.A O no hydrogen 2.990 N/A GLN 382.A N ALA 378.A O no hydrogen 2.830 N/A ASP 383.A N HIS 379.A O no hydrogen 2.873 N/A ILE 384.A N ALA 380.A O no hydrogen 2.985 N/A TYR 385.A N LEU 381.A O no hydrogen 2.912 N/A THR 386.A N GLN 382.A O no hydrogen 2.678 N/A THR 386.A OG1 GLN 382.A O no hydrogen 3.197 N/A THR 386.A OG1 THR 386.A O no hydrogen 2.503 N/A CYS 387.A SG LEU 388.A O no hydrogen 3.377 N/A GLY 392.A N GLY 397.A O no hydrogen 2.920 N/A GLY 397.A N PHE 394.A O no hydrogen 2.971 N/A SER 398.A N THR 395.A O no hydrogen 2.940 N/A SER 398.A OG THR 395.A O no hydrogen 2.601 N/A CYS 399.A SG ILE 384.A O no hydrogen 4.010 N/A CYS 399.A SG ALA 400.A O no hydrogen 3.635 N/A LYS 403.A N ASP 401.A OD1 no hydrogen 3.176 N/A LYS 404.A N ASP 401.A OD2 no hydrogen 3.183 N/A VAL 410.A N GLU 406.A O no hydrogen 3.443 N/A LEU 411.A N ALA 407.A O no hydrogen 2.895 N/A LYS 412.A N TRP 408.A O no hydrogen 2.912 N/A HIS 413.A N GLN 409.A O no hydrogen 2.953 N/A LEU 414.A N VAL 410.A O no hydrogen 2.844 N/A ARG 415.A N LEU 411.A O no hydrogen 2.940 N/A ARG 415.A NH2 LYS 162.A O no hydrogen 3.162 N/A PHE 419.A N VAL 427.A O no hydrogen 3.421 N/A ASN 421.A N GLU 425.A O no hydrogen 2.924 N/A ASN 421.A ND2 TYR 368.A OH no hydrogen 3.027 N/A ASN 422.A ND2 GLN 307.A O no hydrogen 2.846 N/A GLY 424.A N ASN 421.A O no hydrogen 3.452 N/A GLN 426.A NE2 ASN 418.A OD1 no hydrogen 3.294 N/A VAL 427.A N PHE 419.A O no hydrogen 2.947 N/A THR 428.A OG1 LEU 417.A O no hydrogen 3.244 N/A ASP 430.A N ASP 434.A O no hydrogen 3.315 N/A CYS 432.A SG SER 156.A O no hydrogen 3.943 N/A GLY 433.A N ASP 430.A O no hydrogen 3.027 N/A ASP 434.A N ASP 430.A OD1 no hydrogen 2.581 N/A TYR 439.A N TYR 461.A O no hydrogen 2.966 N/A TYR 439.A OH ASN 170.A O no hydrogen 3.376 N/A SER 440.A N ALA 302.A O no hydrogen 2.914 N/A SER 440.A OG ALA 302.A O no hydrogen 3.216 N/A ILE 441.A N GLY 459.A O no hydrogen 2.888 N/A ILE 442.A N GLY 300.A O no hydrogen 2.898 N/A ASN 443.A N LYS 456.A O no hydrogen 2.817 N/A ASN 443.A ND2 HIS 445.A NE2 no hydrogen 3.079 N/A ASN 443.A ND2 LEU 479.A O no hydrogen 3.621 N/A TRP 444.A N THR 298.A O no hydrogen 3.021 N/A TRP 444.A NE1 ALA 281.A O no hydrogen 2.969 N/A HIS 445.A N VAL 454.A O no hydrogen 2.997 N/A SER 447.A N SER 452.A O no hydrogen 2.737 N/A GLY 451.A N SER 447.A O no hydrogen 2.826 N/A VAL 454.A N HIS 445.A O no hydrogen 3.111 N/A LYS 456.A N ASN 443.A O no hydrogen 3.005 N/A VAL 458.A N ILE 441.A O no hydrogen 2.785 N/A TYR 460.A N PHE 472.A O no hydrogen 2.915 N/A TYR 461.A N TYR 439.A O no hydrogen 2.888 N/A ASN 462.A N ARG 470.A O no hydrogen 2.764 N/A VAL 463.A N ASN 438.A OD1 no hydrogen 3.410 N/A TYR 464.A N ASN 462.A OD1 no hydrogen 2.934 N/A GLU 469.A N LYS 466.A O no hydrogen 3.081 N/A ARG 470.A NE ALA 465.A O no hydrogen 3.317 N/A ARG 470.A NH2 ALA 465.A O no hydrogen 3.565 N/A PHE 472.A N TYR 460.A O no hydrogen 2.950 N/A ASN 474.A N VAL 458.A O no hydrogen 2.940 N/A GLU 475.A N GLU 475.A OE2 no hydrogen 2.738 N/A LYS 477.A N ASN 474.A O no hydrogen 3.457 N/A LYS 477.A NZ GLU 457.A O no hydrogen 3.475 N/A ILE 478.A N GLU 475.A O no hydrogen 3.479 N/A TRP 480.A N SER 484.A O no hydrogen 3.153 N/A GLY 482.A N LEU 479.A O no hydrogen 3.036 N/A PHE 483.A N TRP 480.A O no hydrogen 3.124 N/A SER 484.A N TRP 480.A O no hydrogen 2.715 N/A SER 490.A OG TRP 189.A O no hydrogen 2.838 N/A CYS 492.A N ASN 188.A OD1 no hydrogen 3.401 N/A SER 493.A OG PHE 513.A O no hydrogen 3.414 N/A CYS 496.A SG THR 500.A OG1 no hydrogen 3.171 N/A GLY 499.A N SER 524.A O no hydrogen 2.750 N/A THR 500.A OG1 LEU 497.A O no hydrogen 2.949 N/A ARG 501.A N VAL 516.A O no hydrogen 2.901 N/A ARG 501.A NH1 LYS 502.A O no hydrogen 2.578 N/A LYS 502.A N ALA 529.A O no hydrogen 2.842 N/A GLY 503.A N GLU 514.A O no hydrogen 2.842 N/A CYS 511.A SG ASN 188.A O no hydrogen 3.843 N/A CYS 512.A N PRO 509.A O no hydrogen 3.132 N/A PHE 513.A N SER 493.A OG no hydrogen 3.119 N/A GLU 514.A N GLY 503.A O no hydrogen 2.932 N/A VAL 516.A N ARG 501.A O no hydrogen 2.918 N/A CYS 518.A N GLY 499.A O no hydrogen 3.144 N/A CYS 518.A SG GLY 499.A O no hydrogen 3.256 N/A GLU 522.A N PRO 519.A O no hydrogen 3.000 N/A TYR 523.A N ASN 533.A O no hydrogen 3.158 N/A SER 524.A N HIS 545.A O no hydrogen 3.049 N/A SER 524.A OG GLU 526.A O no hydrogen 3.187 N/A ASN 533.A N TYR 523.A O no hydrogen 2.875 N/A TRP 540.A N ILE 549.A O no hydrogen 2.893 N/A SER 541.A OG ASN 542.A O no hydrogen 2.885 N/A ASN 542.A N SER 547.A O no hydrogen 3.320 N/A ASN 542.A ND2 ASN 544.A OD1 no hydrogen 3.576 N/A GLU 543.A N GLU 543.A OE1 no hydrogen 2.781 N/A HIS 545.A N ASN 542.A O no hydrogen 3.343 N/A HIS 545.A ND1 GLU 517.A OE1 no hydrogen 2.731 N/A HIS 545.A NE2 ASP 520.A OD1 no hydrogen 2.708 N/A THR 546.A N ASN 544.A OD1 no hydrogen 2.932 N/A THR 546.A OG1 ASN 544.A O no hydrogen 3.552 N/A THR 546.A OG1 ASN 544.A OD1 no hydrogen 2.854 N/A ILE 549.A N TRP 540.A O no hydrogen 2.888 N/A LYS 551.A N ASP 538.A O no hydrogen 3.185 N/A LYS 551.A NZ ASP 686.A O no hydrogen 2.883 N/A GLU 554.A N ILE 689.A O no hydrogen 2.907 N/A GLU 560.A N SER 557.A O no hydrogen 3.335 N/A ILE 564.A N GLU 560.A O no hydrogen 2.779 N/A ALA 565.A N PRO 561.A O no hydrogen 2.926 N/A LEU 566.A N PHE 562.A O no hydrogen 2.955 N/A THR 567.A N GLY 563.A O no hydrogen 2.906 N/A THR 567.A OG1 GLY 563.A O no hydrogen 2.653 N/A LEU 568.A N ILE 564.A O no hydrogen 2.883 N/A PHE 569.A N ALA 565.A O no hydrogen 2.986 N/A ALA 570.A N LEU 566.A O no hydrogen 2.947 N/A VAL 571.A N THR 567.A O no hydrogen 2.941 N/A LEU 572.A N LEU 568.A O no hydrogen 2.906 N/A GLY 573.A N PHE 569.A O no hydrogen 2.937 N/A ILE 574.A N ALA 570.A O no hydrogen 2.974 N/A PHE 575.A N VAL 571.A O no hydrogen 2.912 N/A LEU 576.A N LEU 572.A O no hydrogen 2.926 N/A THR 577.A N GLY 573.A O no hydrogen 2.942 N/A THR 577.A OG1 GLY 573.A O no hydrogen 2.868 N/A ALA 578.A N ILE 574.A O no hydrogen 2.961 N/A PHE 579.A N PHE 575.A O no hydrogen 2.894 N/A VAL 580.A N LEU 576.A O no hydrogen 2.939 N/A LEU 581.A N THR 577.A O no hydrogen 2.957 N/A GLY 582.A N ALA 578.A O no hydrogen 2.899 N/A VAL 583.A N PHE 579.A O no hydrogen 2.923 N/A PHE 584.A N VAL 580.A O no hydrogen 2.967 N/A ILE 585.A N LEU 581.A O no hydrogen 2.924 N/A LYS 586.A N GLY 582.A O no hydrogen 2.912 N/A PHE 587.A N VAL 583.A O no hydrogen 3.092 N/A ARG 588.A N ILE 585.A O no hydrogen 3.272 N/A THR 590.A N PHE 587.A O no hydrogen 3.208 N/A THR 590.A OG1 PHE 587.A O no hydrogen 2.582 N/A VAL 593.A N THR 590.A O no hydrogen 3.150 N/A LYS 594.A N THR 590.A O no hydrogen 3.373 N/A ALA 595.A N PRO 591.A O no hydrogen 2.930 N/A THR 596.A N VAL 593.A O no hydrogen 2.951 N/A THR 596.A OG1 VAL 593.A O no hydrogen 2.805 N/A ARG 598.A NH2 GLU 599.A OE2 no hydrogen 3.423 N/A SER 601.A N ASN 597.A O no hydrogen 3.156 N/A SER 601.A OG THR 596.A O no hydrogen 3.235 N/A TYR 602.A N ARG 598.A O no hydrogen 2.919 N/A LEU 603.A N GLU 599.A O no hydrogen 2.935 N/A LEU 604.A N LEU 600.A O no hydrogen 2.878 N/A LEU 605.A N SER 601.A O no hydrogen 2.922 N/A PHE 606.A N TYR 602.A O no hydrogen 2.940 N/A SER 607.A N LEU 603.A O no hydrogen 2.928 N/A SER 607.A OG LEU 603.A O no hydrogen 2.879 N/A LEU 608.A N LEU 604.A O no hydrogen 2.886 N/A LEU 609.A N LEU 605.A O no hydrogen 2.935 N/A CYS 610.A N PHE 606.A O no hydrogen 2.981 N/A CYS 610.A SG PHE 606.A O no hydrogen 3.254 N/A CYS 611.A N SER 607.A O no hydrogen 2.866 N/A CYS 611.A SG SER 607.A O no hydrogen 3.322 N/A CYS 611.A SG SER 637.A OG no hydrogen 3.124 N/A PHE 612.A N LEU 608.A O no hydrogen 2.922 N/A SER 613.A N LEU 609.A O no hydrogen 2.933 N/A SER 613.A OG LEU 609.A O no hydrogen 2.745 N/A SER 614.A N CYS 610.A O no hydrogen 2.906 N/A SER 614.A N CYS 611.A O no hydrogen 3.189 N/A SER 615.A N PHE 612.A O no hydrogen 3.416 N/A SER 615.A OG PHE 612.A O no hydrogen 2.948 N/A LEU 616.A N SER 613.A O no hydrogen 3.143 N/A PHE 617.A N SER 614.A O no hydrogen 3.226 N/A PHE 618.A N SER 615.A O no hydrogen 3.494 N/A GLY 620.A N LEU 556.A O no hydrogen 3.037 N/A GLN 623.A NE2 GLU 621.A O no hydrogen 3.634 N/A CYS 627.A N GLN 623.A O no hydrogen 2.756 N/A CYS 627.A SG GLN 623.A O no hydrogen 3.130 N/A ARG 628.A N ASP 624.A O no hydrogen 2.925 N/A LEU 629.A N TRP 625.A O no hydrogen 2.886 N/A ARG 630.A N THR 626.A O no hydrogen 2.936 N/A ARG 630.A NH2 PHE 617.A O no hydrogen 3.074 N/A GLN 631.A NE2 GLU 765.A OE1 no hydrogen 3.090 N/A ALA 633.A N LEU 629.A O no hydrogen 3.221 N/A GLY 635.A N GLN 631.A O no hydrogen 2.981 N/A ILE 636.A N PRO 632.A O no hydrogen 2.883 N/A SER 637.A N ALA 633.A O no hydrogen 2.968 N/A SER 637.A OG ALA 633.A O no hydrogen 2.926 N/A SER 637.A OG PHE 634.A O no hydrogen 3.023 N/A PHE 638.A N PHE 634.A O no hydrogen 2.881 N/A VAL 639.A N GLY 635.A O no hydrogen 2.963 N/A LEU 640.A N ILE 636.A O no hydrogen 2.935 N/A CYS 641.A N SER 637.A O no hydrogen 2.955 N/A CYS 641.A SG SER 637.A O no hydrogen 3.311 N/A ILE 642.A N PHE 638.A O no hydrogen 2.897 N/A SER 643.A N VAL 639.A O no hydrogen 2.895 N/A CYS 644.A N LEU 640.A O no hydrogen 2.940 N/A CYS 644.A SG LEU 640.A O no hydrogen 3.269 N/A ILE 645.A N CYS 641.A O no hydrogen 2.955 N/A LEU 646.A N ILE 642.A O no hydrogen 2.871 N/A VAL 647.A N SER 643.A O no hydrogen 2.924 N/A LYS 648.A N CYS 644.A O no hydrogen 2.887 N/A LYS 648.A NZ SER 601.A OG no hydrogen 3.293 N/A THR 649.A N ILE 645.A O no hydrogen 3.146 N/A THR 649.A OG1 ILE 645.A O no hydrogen 3.063 N/A GLN 652.A N GLN 652.A OE1 no hydrogen 2.643 N/A LEU 655.A N LEU 651.A O no hydrogen 3.145 N/A VAL 656.A N GLN 652.A O no hydrogen 3.009 N/A PHE 657.A N PHE 653.A O no hydrogen 2.861 N/A LEU 658.A N LEU 654.A O no hydrogen 2.933 N/A CYS 659.A N LEU 655.A O no hydrogen 2.970 N/A CYS 659.A SG LEU 655.A O no hydrogen 3.342 N/A THR 660.A N VAL 656.A O no hydrogen 2.944 N/A THR 660.A OG1 VAL 656.A O no hydrogen 2.839 N/A PHE 661.A N PHE 657.A O no hydrogen 2.883 N/A ILE 664.A N THR 660.A O no hydrogen 2.996 N/A VAL 665.A N PHE 661.A O no hydrogen 2.897 N/A ILE 666.A N MET 662.A O no hydrogen 2.917 N/A CYS 667.A N GLN 663.A O no hydrogen 2.901 N/A CYS 667.A SG GLN 663.A O no hydrogen 3.341 N/A CYS 667.A SG GLN 663.A OE1 no hydrogen 3.754 N/A VAL 668.A N ILE 664.A O no hydrogen 2.918 N/A ILE 669.A N VAL 665.A O no hydrogen 2.942 N/A TRP 670.A N ILE 666.A O no hydrogen 2.915 N/A LEU 671.A N CYS 667.A O no hydrogen 2.891 N/A TYR 672.A N VAL 668.A O no hydrogen 2.981 N/A THR 673.A N TRP 670.A O no hydrogen 3.390 N/A THR 673.A OG1 ILE 669.A O no hydrogen 2.210 N/A ALA 674.A N TRP 670.A O no hydrogen 3.101 N/A SER 677.A N HIS 694.A O no hydrogen 2.934 N/A SER 678.A N ASP 624.A OD1 no hydrogen 2.856 N/A SER 678.A OG ASP 624.A OD1 no hydrogen 2.990 N/A TYR 679.A N THR 692.A O no hydrogen 2.891 N/A ASN 681.A N PHE 690.A O no hydrogen 2.851 N/A GLN 682.A N GLU 683.A OE2 no hydrogen 2.882 N/A GLU 683.A N ASN 681.A OD1 no hydrogen 3.001 N/A ILE 688.A N GLU 685.A O no hydrogen 3.399 N/A ILE 689.A N GLU 552.A O no hydrogen 2.912 N/A PHE 690.A N ASN 681.A O no hydrogen 2.933 N/A THR 692.A N TYR 679.A O no hydrogen 2.937 N/A HIS 694.A N SER 677.A O no hydrogen 2.871 N/A GLU 695.A N GLU 695.A OE1 no hydrogen 2.722 N/A GLY 702.A N LEU 698.A O no hydrogen 2.930 N/A PHE 703.A N MET 699.A O no hydrogen 2.899 N/A LEU 704.A N ALA 700.A O no hydrogen 2.937 N/A ILE 705.A N LEU 701.A O no hydrogen 2.991 N/A GLY 706.A N GLY 702.A O no hydrogen 2.859 N/A TYR 707.A N PHE 703.A O no hydrogen 2.907 N/A TYR 707.A OH CYS 659.A O no hydrogen 3.125 N/A THR 708.A N LEU 704.A O no hydrogen 2.986 N/A THR 708.A OG1 LEU 704.A O no hydrogen 3.083 N/A CYS 709.A N ILE 705.A O no hydrogen 2.933 N/A CYS 709.A SG ILE 705.A O no hydrogen 3.203 N/A LEU 710.A N GLY 706.A O no hydrogen 2.859 N/A LEU 711.A N TYR 707.A O no hydrogen 2.987 N/A ALA 712.A N THR 708.A O no hydrogen 2.949 N/A ALA 713.A N CYS 709.A O no hydrogen 2.870 N/A ILE 714.A N LEU 710.A O no hydrogen 2.956 N/A CYS 715.A N LEU 711.A O no hydrogen 2.955 N/A PHE 716.A N ALA 712.A O no hydrogen 2.884 N/A PHE 717.A N ALA 713.A O no hydrogen 2.904 N/A PHE 718.A N ILE 714.A O no hydrogen 3.010 N/A ALA 719.A N CYS 715.A O no hydrogen 2.905 N/A PHE 720.A N PHE 716.A O no hydrogen 2.872 N/A LYS 721.A N PHE 717.A O no hydrogen 2.982 N/A ARG 723.A NH1 PHE 720.A O no hydrogen 3.205 N/A LEU 725.A N SER 722.A O no hydrogen 3.259 N/A ASN 730.A N PRO 726.A O no hydrogen 3.247 N/A GLU 731.A N GLU 727.A O no hydrogen 2.980 N/A ILE 735.A N GLU 731.A O no hydrogen 3.011 N/A THR 736.A N ALA 732.A O no hydrogen 2.888 N/A THR 736.A OG1 ALA 732.A O no hydrogen 2.980 N/A PHE 737.A N LYS 733.A O no hydrogen 2.969 N/A SER 738.A N PHE 734.A O no hydrogen 2.926 N/A SER 738.A OG ILE 735.A O no hydrogen 2.903 N/A MET 739.A N ILE 735.A O no hydrogen 2.984 N/A LEU 740.A N THR 736.A O no hydrogen 2.963 N/A ILE 741.A N PHE 737.A O no hydrogen 2.917 N/A PHE 742.A N SER 738.A O no hydrogen 2.969 N/A PHE 743.A N MET 739.A O no hydrogen 3.010 N/A ILE 744.A N LEU 740.A O no hydrogen 2.938 N/A VAL 745.A N ILE 741.A O no hydrogen 2.888 N/A TRP 746.A N PHE 742.A O no hydrogen 3.081 N/A ILE 747.A N PHE 743.A O no hydrogen 2.944 N/A SER 748.A N ILE 744.A O no hydrogen 2.948 N/A SER 748.A OG ILE 744.A O no hydrogen 2.815 N/A PHE 749.A N VAL 745.A O no hydrogen 2.868 N/A ILE 750.A N TRP 746.A O no hydrogen 3.079 N/A ALA 752.A N SER 748.A O no hydrogen 3.411 N/A TYR 753.A N PHE 749.A O no hydrogen 2.822 N/A ALA 754.A N ILE 750.A O no hydrogen 2.983 N/A SER 755.A N PRO 751.A O no hydrogen 2.916 N/A SER 755.A N ALA 752.A O no hydrogen 3.358 N/A SER 755.A OG PRO 751.A O no hydrogen 2.917 N/A THR 756.A N ALA 752.A O no hydrogen 3.146 N/A THR 756.A OG1 ALA 752.A O no hydrogen 2.519 N/A TYR 757.A OH GLU 685.A OE2 no hydrogen 2.793 N/A LYS 759.A NZ GLU 554.A OE2 no hydrogen 3.096 N/A LYS 759.A NZ GLU 560.A OE1 no hydrogen 3.474 N/A LYS 759.A NZ GLU 560.A OE2 no hydrogen 3.011 N/A SER 762.A OG PHE 618.A O no hydrogen 3.415 N/A VAL 766.A N SER 762.A O no hydrogen 3.154 N/A ILE 767.A N ALA 763.A O no hydrogen 2.910 N/A ALA 768.A N VAL 764.A O no hydrogen 2.816 N/A ILE 769.A N GLU 765.A O no hydrogen 2.671 N/A LEU 770.A N VAL 766.A O no hydrogen 2.651 N/A ALA 771.A N ILE 767.A O no hydrogen 2.660 N/A ALA 772.A N ALA 768.A O no hydrogen 3.096 N/A SER 773.A OG ILE 769.A O no hydrogen 2.321 N/A PHE 774.A N LEU 770.A O no hydrogen 2.823 N/A GLY 775.A N ALA 771.A O no hydrogen 2.869 N/A LEU 776.A N ALA 772.A O no hydrogen 3.095 N/A LEU 777.A N SER 773.A O no hydrogen 3.197 N/A ALA 778.A N PHE 774.A O no hydrogen 2.766 N/A CYS 779.A N GLY 775.A O no hydrogen 2.798 N/A CYS 779.A N LEU 776.A O no hydrogen 2.986 N/A CYS 779.A SG GLY 775.A O no hydrogen 3.224 N/A ILE 780.A N LEU 776.A O no hydrogen 2.897 N/A ILE 780.A N LEU 777.A O no hydrogen 3.024 N/A PHE 781.A N LEU 777.A O no hydrogen 3.074 N/A LYS 784.A N ASN 783.A OD1 no hydrogen 2.329 N/A LYS 784.A NZ ASN 728.A OD1 no hydrogen 2.713 N/A ILE 785.A N PHE 781.A O no hydrogen 2.718 N/A TYR 786.A N PHE 782.A O no hydrogen 2.790 N/A ILE 787.A N ASN 783.A O no hydrogen 2.817 N/A ILE 788.A N LYS 784.A O no hydrogen 2.746 N/A LEU 789.A N ILE 785.A O no hydrogen 2.791 N/A LEU 789.A N TYR 786.A O no hydrogen 2.972 N/A PHE 790.A N TYR 786.A O no hydrogen 2.807 N/A