Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8e79_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N VAL 3.A O no hydrogen 3.382 N/A ARG 9.A NE GLU 683.A OE2 no hydrogen 2.796 N/A ARG 9.A NH1 VAL 924.A O no hydrogen 3.132 N/A ARG 9.A NH2 PRO 595.A O no hydrogen 3.331 N/A ARG 9.A NH2 GLU 683.A OE1 no hydrogen 3.160 N/A ARG 9.A NH2 GLU 683.A OE2 no hydrogen 3.286 N/A PHE 12.A N SER 925.A O no hydrogen 3.079 N/A LYS 14.A N ASP 930.A OD2 no hydrogen 2.971 N/A LYS 14.A NZ PHE 12.A O no hydrogen 3.483 N/A LYS 14.A NZ GLY 931.A O no hydrogen 3.131 N/A LYS 14.A NZ GLU 936.A OE1 no hydrogen 3.109 N/A LYS 14.A NZ GLU 936.A OE2 no hydrogen 2.881 N/A LEU 15.A N ASP 930.A OD2 no hydrogen 3.142 N/A GLU 20.A N GLU 20.A OE2 no hydrogen 2.611 N/A LEU 24.A N ASP 608.A OD2 no hydrogen 2.839 N/A ASP 26.A N GLY 23.A O no hydrogen 2.985 N/A GLN 28.A NE2 VAL 146.A O no hydrogen 2.895 N/A THR 29.A N LEU 25.A O no hydrogen 3.498 N/A ASP 30.A N ASP 26.A O no hydrogen 2.889 N/A SER 31.A N VAL 27.A O no hydrogen 2.928 N/A SER 31.A N GLN 28.A O no hydrogen 3.044 N/A SER 31.A OG THR 351.A OG1 no hydrogen 2.334 N/A PHE 32.A N GLN 28.A O no hydrogen 2.956 N/A GLU 33.A N THR 29.A O no hydrogen 3.252 N/A LEU 35.A N PHE 32.A O no hydrogen 2.384 N/A ILE 36.A N PHE 32.A O no hydrogen 3.403 N/A GLY 37.A N GLU 33.A O no hydrogen 2.966 N/A SER 38.A N GLU 33.A O no hydrogen 3.262 N/A ARG 40.A NE GLU 33.A OE1 no hydrogen 2.754 N/A ARG 40.A NE GLU 33.A OE2 no hydrogen 3.412 N/A ARG 40.A NH2 GLU 33.A OE1 no hydrogen 2.457 N/A ARG 42.A N SER 38.A O no hydrogen 3.209 N/A GLU 43.A N PRO 39.A O no hydrogen 2.894 N/A SER 44.A N ARG 40.A O no hydrogen 2.942 N/A SER 44.A OG ARG 40.A O no hydrogen 3.213 N/A ALA 45.A N TRP 41.A O no hydrogen 2.872 N/A ALA 46.A N ARG 42.A O no hydrogen 2.925 N/A ALA 46.A N GLU 43.A O no hydrogen 3.108 N/A ASN 52.A N GLY 49.A O no hydrogen 3.432 N/A GLY 55.A N GLU 58.A OE1 no hydrogen 2.890 N/A LEU 57.A N LEU 35.A O no hydrogen 3.390 N/A GLU 59.A N GLY 55.A O no hydrogen 2.803 N/A VAL 60.A N GLY 56.A O no hydrogen 2.923 N/A LEU 61.A N LEU 57.A O no hydrogen 2.925 N/A TYR 62.A N GLU 58.A O no hydrogen 2.900 N/A GLU 63.A N GLU 59.A O no hydrogen 2.930 N/A LEU 64.A N VAL 60.A O no hydrogen 2.914 N/A SER 65.A N LEU 61.A O no hydrogen 2.879 N/A SER 65.A OG LEU 61.A O no hydrogen 3.102 N/A ILE 67.A N LEU 76.A O no hydrogen 2.815 N/A SER 71.A OG ASP 69.A OD2 no hydrogen 2.325 N/A SER 71.A OG SER 73.A OG no hydrogen 3.073 N/A GLY 72.A N ASP 69.A O no hydrogen 3.071 N/A SER 73.A OG ASP 69.A OD2 no hydrogen 2.996 N/A SER 73.A OG SER 71.A OG no hydrogen 3.073 N/A MET 74.A N ASP 69.A OD1 no hydrogen 3.305 N/A SER 75.A N ILE 111.A O no hydrogen 2.876 N/A LEU 76.A N ILE 67.A O no hydrogen 2.965 N/A SER 77.A N GLU 109.A O no hydrogen 2.910 N/A SER 79.A OG ASP 80.A OD2 no hydrogen 2.688 N/A ARG 82.A N PHE 105.A O no hydrogen 3.142 N/A ARG 82.A NH1 ASP 80.A OD1 no hydrogen 3.485 N/A ASP 84.A N PRO 103.A O no hydrogen 3.469 N/A LYS 87.A NZ ASP 127.A OD2 no hydrogen 3.266 N/A CYS 93.A N PRO 89.A O no hydrogen 3.021 N/A CYS 93.A SG ALA 88.A O no hydrogen 3.888 N/A CYS 93.A SG THR 99.A O no hydrogen 3.778 N/A LYS 94.A N VAL 90.A O no hydrogen 2.919 N/A ASP 95.A N ASP 91.A O no hydrogen 2.906 N/A LYS 96.A N GLU 92.A O no hydrogen 2.896 N/A LYS 96.A NZ GLU 92.A OE1 no hydrogen 3.413 N/A MET 98.A N CYS 93.A O no hydrogen 2.993 N/A THR 99.A OG1 ILE 138.A O no hydrogen 3.389 N/A TYR 100.A N ILE 138.A O no hydrogen 3.234 N/A ALA 102.A N PHE 128.A O no hydrogen 2.907 N/A LEU 104.A N GLY 126.A O no hydrogen 3.159 N/A PHE 105.A N ARG 82.A O no hydrogen 3.154 N/A VAL 106.A N VAL 123.A O no hydrogen 2.955 N/A THR 107.A N SER 79.A O no hydrogen 3.309 N/A THR 107.A OG1 ASP 80.A OD1 no hydrogen 2.419 N/A THR 107.A OG1 ASP 80.A OD2 no hydrogen 3.045 N/A ALA 108.A N GLN 121.A O no hydrogen 2.881 N/A GLU 109.A N SER 77.A O no hydrogen 2.905 N/A PHE 110.A N LYS 119.A O no hydrogen 2.884 N/A ILE 111.A N SER 75.A O no hydrogen 2.924 N/A ASN 113.A N SER 73.A O no hydrogen 2.558 N/A ASN 113.A ND2 GLY 72.A O no hydrogen 3.086 N/A ASN 114.A N ASN 112.A OD1 no hydrogen 3.300 N/A GLY 116.A N ASN 112.A O no hydrogen 3.085 N/A GLU 117.A N THR 115.A OG1 no hydrogen 3.329 N/A LYS 119.A N PHE 110.A O no hydrogen 2.924 N/A LYS 119.A NZ ILE 383.A O no hydrogen 2.453 N/A GLN 121.A N ALA 108.A O no hydrogen 2.928 N/A GLN 121.A NE2 GLN 386.A OE1 no hydrogen 3.069 N/A VAL 123.A N VAL 106.A O no hydrogen 2.880 N/A MET 125.A N LEU 104.A O no hydrogen 2.757 N/A PHE 128.A N ALA 102.A O no hydrogen 2.890 N/A MET 130.A N TYR 100.A O no hydrogen 3.159 N/A THR 132.A N THR 136.A O no hydrogen 3.103 N/A THR 132.A OG1 THR 136.A O no hydrogen 2.477 N/A THR 132.A OG1 THR 136.A OG1 no hydrogen 2.829 N/A GLY 135.A N THR 132.A O no hydrogen 3.141 N/A THR 136.A N THR 132.A OG1 no hydrogen 3.350 N/A THR 136.A OG1 THR 132.A OG1 no hydrogen 2.829 N/A THR 136.A OG1 GLU 143.A OE2 no hydrogen 2.291 N/A PHE 137.A N ARG 144.A O no hydrogen 2.942 N/A ILE 139.A N THR 142.A O no hydrogen 2.908 N/A THR 142.A N ILE 139.A O no hydrogen 2.908 N/A THR 142.A OG1 ILE 139.A O no hydrogen 3.030 N/A ARG 144.A N PHE 137.A O no hydrogen 2.877 N/A VAL 145.A N GLN 409.A O no hydrogen 2.927 N/A VAL 147.A N LEU 407.A O no hydrogen 3.095 N/A GLN 149.A N ARG 350.A O no hydrogen 2.942 N/A GLN 149.A NE2 PRO 431.A O no hydrogen 3.656 N/A LEU 150.A N SER 427.A O no hydrogen 3.286 N/A VAL 151.A N ARG 348.A O no hydrogen 2.952 N/A SER 153.A N ASN 346.A O no hydrogen 2.814 N/A SER 153.A OG PRO 154.A O no hydrogen 3.454 N/A GLY 155.A N ILE 176.A O no hydrogen 2.907 N/A TYR 157.A N LYS 174.A O no hydrogen 2.911 N/A TYR 157.A OH SER 153.A O no hydrogen 2.322 N/A ASP 159.A N SER 172.A O no hydrogen 2.928 N/A THR 161.A N LEU 170.A O no hydrogen 2.905 N/A THR 161.A OG1 ILE 162.A O no hydrogen 3.431 N/A ASP 163.A N LYS 168.A O no hydrogen 3.058 N/A SER 165.A N ASP 163.A OD1 no hydrogen 3.198 N/A SER 165.A OG ASP 163.A OD1 no hydrogen 3.193 N/A SER 165.A OG ASP 163.A OD2 no hydrogen 3.258 N/A THR 166.A OG1 ASP 163.A OD2 no hydrogen 2.539 N/A ASP 167.A N ASP 163.A O no hydrogen 2.768 N/A LEU 170.A N THR 161.A O no hydrogen 2.877 N/A SER 172.A N ASP 159.A O no hydrogen 2.891 N/A VAL 173.A N PHE 185.A O no hydrogen 3.085 N/A LYS 174.A N TYR 157.A O no hydrogen 2.914 N/A ILE 176.A N GLY 155.A O no hydrogen 2.880 N/A SER 178.A N ASP 278.A O no hydrogen 3.224 N/A VAL 187.A N HIS 171.A O no hydrogen 3.047 N/A THR 192.A OG1 ASP 188.A OD1 no hydrogen 2.751 N/A THR 192.A OG1 ARG 190.A O no hydrogen 2.838 N/A GLY 194.A N ASP 186.A O no hydrogen 3.326 N/A VAL 195.A N GLN 203.A O no hydrogen 2.680 N/A ASP 198.A N TRP 182.A O no hydrogen 2.935 N/A LYS 200.A N ILE 197.A O no hydrogen 3.376 N/A ARG 202.A NE ASP 186.A OD2 no hydrogen 3.263 N/A VAL 205.A N VAL 193.A O no hydrogen 3.117 N/A VAL 207.A N PRO 204.A O no hydrogen 3.104 N/A LEU 209.A N VAL 205.A O no hydrogen 2.870 N/A LYS 210.A N THR 206.A O no hydrogen 2.891 N/A LYS 210.A NZ THR 238.A O no hydrogen 3.305 N/A ALA 211.A N VAL 207.A O no hydrogen 2.895 N/A LEU 212.A N LEU 208.A O no hydrogen 2.885 N/A GLY 213.A N LYS 210.A O no hydrogen 2.842 N/A TRP 214.A N LEU 209.A O no hydrogen 3.200 N/A THR 215.A N GLN 218.A OE1 no hydrogen 3.138 N/A THR 215.A OG1 GLU 217.A OE1 no hydrogen 3.543 N/A GLN 218.A N THR 215.A OG1 no hydrogen 3.260 N/A ILE 219.A N THR 215.A O no hydrogen 3.380 N/A GLU 221.A N GLU 217.A O no hydrogen 2.886 N/A ARG 222.A N GLN 218.A O no hydrogen 2.929 N/A PHE 223.A N ILE 219.A O no hydrogen 2.421 N/A ARG 230.A N SER 226.A O no hydrogen 3.500 N/A ARG 230.A NH1 GLY 224.A O no hydrogen 3.279 N/A SER 231.A N GLU 227.A O no hydrogen 2.904 N/A THR 232.A N ILE 228.A O no hydrogen 2.911 N/A THR 232.A OG1 ILE 228.A O no hydrogen 2.995 N/A LEU 233.A N MET 229.A O no hydrogen 2.880 N/A GLU 234.A N ARG 230.A O no hydrogen 2.917 N/A LYS 235.A N SER 231.A O no hydrogen 3.078 N/A LYS 235.A NZ ASN 237.A OD1 no hydrogen 2.945 N/A THR 238.A OG1 ASP 236.A O no hydrogen 3.434 N/A THR 238.A OG1 ASP 236.A OD1 no hydrogen 3.134 N/A THR 241.A OG1 ASP 242.A OD1 no hydrogen 2.906 N/A LEU 245.A N THR 241.A O no hydrogen 3.243 N/A LEU 246.A N ASP 242.A O no hydrogen 2.921 N/A ASP 247.A N GLU 243.A O no hydrogen 2.893 N/A ILE 248.A N ALA 244.A O no hydrogen 2.913 N/A TYR 249.A N LEU 245.A O no hydrogen 2.889 N/A ARG 250.A N LEU 246.A O no hydrogen 2.922 N/A LYS 251.A N ILE 248.A O no hydrogen 3.227 N/A LEU 252.A N ILE 248.A O no hydrogen 2.904 N/A ARG 253.A N TYR 249.A O no hydrogen 3.170 N/A LYS 260.A NZ ASP 242.A OD2 no hydrogen 3.047 N/A ALA 263.A N THR 259.A O no hydrogen 2.997 N/A GLN 264.A N LYS 260.A O no hydrogen 2.900 N/A THR 265.A N GLU 261.A O no hydrogen 2.929 N/A THR 265.A OG1 GLU 261.A O no hydrogen 3.239 N/A THR 265.A OG1 SER 262.A O no hydrogen 2.547 N/A LEU 266.A N SER 262.A O no hydrogen 2.888 N/A LEU 267.A N ALA 263.A O no hydrogen 2.913 N/A GLU 268.A N GLN 264.A O no hydrogen 2.925 N/A ASN 269.A N THR 265.A O no hydrogen 2.887 N/A LEU 270.A N LEU 266.A O no hydrogen 2.913 N/A PHE 272.A N GLU 268.A O no hydrogen 2.742 N/A LEU 279.A N SER 302.A O no hydrogen 2.815 N/A TYR 285.A N ARG 281.A O no hydrogen 3.298 N/A LYS 286.A N VAL 282.A O no hydrogen 2.929 N/A LYS 286.A NZ GLY 345.A O no hydrogen 3.295 N/A VAL 287.A N GLY 283.A O no hydrogen 2.912 N/A ASN 288.A N ARG 284.A O no hydrogen 2.910 N/A LYS 289.A N TYR 285.A O no hydrogen 2.912 N/A LYS 290.A N LYS 286.A O no hydrogen 2.897 N/A LYS 290.A NZ ASP 339.A OD1 no hydrogen 2.958 N/A LYS 290.A NZ ASP 339.A OD2 no hydrogen 2.510 N/A LEU 291.A N VAL 287.A O no hydrogen 2.945 N/A GLU 297.A N GLU 297.A OE1 no hydrogen 2.666 N/A SER 302.A OG ALA 280.A O no hydrogen 3.052 N/A VAL 309.A N THR 305.A O no hydrogen 3.239 N/A VAL 310.A N GLU 306.A O no hydrogen 2.954 N/A ALA 311.A N GLU 307.A O no hydrogen 2.884 N/A THR 312.A N ASP 308.A O no hydrogen 2.921 N/A ILE 313.A N VAL 309.A O no hydrogen 2.993 N/A GLU 314.A N VAL 310.A O no hydrogen 2.944 N/A TYR 315.A N ALA 311.A O no hydrogen 2.856 N/A TYR 315.A OH PRO 335.A O no hydrogen 3.101 N/A LEU 316.A N THR 312.A O no hydrogen 2.899 N/A VAL 317.A N ILE 313.A O no hydrogen 2.976 N/A ARG 318.A N GLU 314.A O no hydrogen 2.914 N/A ARG 318.A NE GLU 314.A OE2 no hydrogen 3.146 N/A ARG 318.A NH2 GLU 314.A OE2 no hydrogen 3.392 N/A LEU 319.A N TYR 315.A O no hydrogen 2.887 N/A HIS 320.A N LEU 316.A O no hydrogen 2.963 N/A GLU 321.A N VAL 317.A O no hydrogen 2.903 N/A GLY 322.A N LEU 319.A O no hydrogen 3.147 N/A GLN 323.A N ARG 318.A O no hydrogen 3.181 N/A THR 325.A OG1 GLU 333.A OE2 no hydrogen 3.017 N/A THR 325.A OG1 VAL 334.A O no hydrogen 3.034 N/A MET 326.A N VAL 334.A O no hydrogen 3.351 N/A GLY 331.A N VAL 328.A O no hydrogen 2.998 N/A VAL 334.A N MET 326.A O no hydrogen 3.354 N/A VAL 336.A N THR 324.A O no hydrogen 3.323 N/A GLU 337.A N TYR 315.A OH no hydrogen 3.176 N/A ASP 339.A N PHE 158.A O no hydrogen 3.067 N/A ASP 342.A N ASP 340.A OD1 no hydrogen 2.696 N/A GLY 345.A N HIS 343.A ND1 no hydrogen 3.377 N/A ASN 346.A N HIS 343.A O no hydrogen 2.695 N/A ASN 346.A ND2 ASP 340.A O no hydrogen 2.613 N/A ARG 348.A N VAL 151.A O no hydrogen 2.894 N/A ARG 348.A NH2 PHE 480.A O no hydrogen 2.898 N/A LEU 349.A N GLY 481.A O no hydrogen 2.993 N/A ARG 350.A N GLN 149.A O no hydrogen 2.871 N/A THR 351.A OG1 SER 31.A OG no hydrogen 2.334 N/A ILE 356.A N VAL 352.A O no hydrogen 3.432 N/A GLN 357.A N GLY 353.A O no hydrogen 2.942 N/A GLN 357.A NE2 GLY 56.A O no hydrogen 3.421 N/A GLN 357.A NE2 GLU 59.A OE1 no hydrogen 3.135 N/A ASN 358.A N GLU 354.A O no hydrogen 2.915 N/A GLN 359.A N LEU 355.A O no hydrogen 2.980 N/A GLN 359.A NE2 ALA 397.A O no hydrogen 3.623 N/A ILE 360.A N ILE 356.A O no hydrogen 2.927 N/A ARG 361.A N GLN 357.A O no hydrogen 2.867 N/A VAL 362.A N ASN 358.A O no hydrogen 2.983 N/A GLY 363.A N GLN 359.A O no hydrogen 2.978 N/A MET 364.A N ILE 360.A O no hydrogen 2.872 N/A SER 365.A N ARG 361.A O no hydrogen 2.901 N/A SER 365.A OG VAL 362.A O no hydrogen 2.592 N/A ARG 366.A N VAL 362.A O no hydrogen 3.012 N/A MET 367.A N GLY 363.A O no hydrogen 2.967 N/A GLU 368.A N MET 364.A O no hydrogen 2.806 N/A ARG 369.A N SER 365.A O no hydrogen 2.960 N/A VAL 370.A N ARG 366.A O no hydrogen 3.012 N/A VAL 371.A N MET 367.A O no hydrogen 2.891 N/A ARG 372.A N GLU 368.A O no hydrogen 2.886 N/A GLU 373.A N ARG 369.A O no hydrogen 2.972 N/A ARG 374.A N VAL 370.A O no hydrogen 2.919 N/A ARG 374.A NH1 THR 387.A O no hydrogen 3.122 N/A MET 375.A N VAL 371.A O no hydrogen 2.878 N/A MET 375.A N ARG 372.A O no hydrogen 3.212 N/A THR 376.A N GLU 373.A O no hydrogen 3.354 N/A THR 377.A N ARG 374.A O no hydrogen 3.391 N/A THR 377.A OG1 THR 377.A O no hydrogen 2.430 N/A THR 384.A N THR 387.A OG1 no hydrogen 3.082 N/A THR 384.A OG1 GLN 121.A OE1 no hydrogen 2.287 N/A THR 387.A N THR 384.A O no hydrogen 2.825 N/A THR 387.A OG1 THR 384.A O no hydrogen 2.614 N/A LEU 388.A N PRO 385.A O no hydrogen 3.177 N/A VAL 394.A N ILE 391.A O no hydrogen 3.129 N/A ALA 396.A N ARG 392.A O no hydrogen 2.929 N/A ALA 397.A N PRO 393.A O no hydrogen 2.894 N/A ILE 398.A N VAL 394.A O no hydrogen 2.986 N/A LYS 399.A N VAL 395.A O no hydrogen 2.925 N/A GLU 400.A N ALA 396.A O no hydrogen 2.880 N/A PHE 401.A N ALA 397.A O no hydrogen 2.968 N/A PHE 402.A N ILE 398.A O no hydrogen 2.971 N/A THR 404.A N GLU 400.A O no hydrogen 2.905 N/A SER 405.A OG PHE 401.A O no hydrogen 3.271 N/A SER 405.A OG THR 404.A O no hydrogen 2.279 N/A SER 408.A OG PHE 402.A O no hydrogen 3.154 N/A GLN 409.A N VAL 145.A O no hydrogen 2.914 N/A GLN 409.A NE2 GLN 406.A O no hydrogen 3.393 N/A MET 411.A N GLU 143.A O no hydrogen 3.355 N/A ASN 414.A ND2 ARG 584.A O no hydrogen 3.342 N/A ASN 415.A ND2 GLN 583.A O no hydrogen 3.435 N/A SER 418.A N ASN 415.A O no hydrogen 2.981 N/A SER 418.A N ASN 415.A OD1 no hydrogen 3.119 N/A SER 418.A OG ASP 412.A O no hydrogen 3.104 N/A LEU 420.A N PRO 416.A O no hydrogen 2.949 N/A THR 421.A N LEU 417.A O no hydrogen 2.909 N/A THR 421.A OG1 LEU 417.A O no hydrogen 3.266 N/A HIS 422.A N SER 418.A O no hydrogen 2.884 N/A HIS 422.A NE2 GLN 409.A OE1 no hydrogen 2.610 N/A LYS 423.A N GLY 419.A O no hydrogen 2.975 N/A LYS 423.A NZ LYS 134.A O no hydrogen 2.845 N/A ARG 424.A NH1 LEU 24.A O no hydrogen 2.415 N/A ARG 424.A NH2 LEU 471.A O no hydrogen 3.420 N/A LEU 426.A N GLY 469.A O no hydrogen 2.917 N/A SER 427.A N SER 148.A O no hydrogen 3.273 N/A SER 427.A OG SER 148.A O no hydrogen 3.384 N/A ALA 428.A N LEU 467.A O no hydrogen 2.865 N/A GLY 433.A N GLY 430.A O no hydrogen 3.220 N/A SER 435.A OG GLU 437.A OE1 no hydrogen 2.542 N/A ARG 436.A NE ASN 464.A OD1 no hydrogen 3.249 N/A GLU 437.A N GLU 437.A OE1 no hydrogen 2.392 N/A ARG 438.A N SER 435.A O no hydrogen 3.067 N/A ARG 444.A NH1 PRO 463.A O no hydrogen 2.876 N/A ARG 444.A NH1 ILE 465.A O no hydrogen 3.145 N/A HIS 450.A N HIS 447.A O no hydrogen 3.018 N/A TYR 451.A OH ASP 551.A OD2 no hydrogen 2.337 N/A ARG 453.A N HIS 450.A O no hydrogen 2.868 N/A ARG 453.A NE ILE 483.A O no hydrogen 3.426 N/A ARG 453.A NH1 SER 449.A O no hydrogen 3.461 N/A ARG 453.A NH1 GLU 507.A OE1 no hydrogen 3.544 N/A ARG 453.A NH1 GLU 507.A OE2 no hydrogen 3.123 N/A ARG 453.A NH2 GLU 507.A OE2 no hydrogen 3.559 N/A MET 454.A N HIS 450.A O no hydrogen 3.173 N/A CYS 455.A N SER 470.A O no hydrogen 3.097 N/A CYS 455.A SG SER 559.A OG no hydrogen 3.430 N/A THR 459.A OG1 GLU 458.A O no hydrogen 2.326 N/A LEU 467.A N ASN 464.A O no hydrogen 2.857 N/A GLY 469.A N LEU 426.A O no hydrogen 2.908 N/A SER 470.A OG LEU 471.A O no hydrogen 3.390 N/A LEU 471.A N ARG 424.A O no hydrogen 3.170 N/A SER 472.A OG GLY 452.A O no hydrogen 2.830 N/A ARG 476.A N GLU 484.A O no hydrogen 3.063 N/A ASN 478.A N PHE 482.A O no hydrogen 3.049 N/A GLY 481.A N ASN 478.A O no hydrogen 2.871 N/A GLY 481.A N ASN 478.A OD1 no hydrogen 3.098 N/A GLU 484.A N ARG 476.A O no hydrogen 2.793 N/A THR 485.A N LEU 502.A O no hydrogen 2.939 N/A THR 485.A OG1 PRO 486.A O no hydrogen 3.440 N/A TYR 487.A N VAL 500.A O no hydrogen 2.891 N/A TYR 487.A OH GLU 507.A OE2 no hydrogen 2.110 N/A ARG 488.A N MET 550.A O no hydrogen 2.919 N/A LYS 489.A N GLU 498.A O no hydrogen 3.335 N/A VAL 490.A N ASP 548.A O no hydrogen 3.290 N/A VAL 491.A N VAL 494.A O no hydrogen 2.999 N/A VAL 494.A N VAL 491.A O no hydrogen 2.898 N/A VAL 495.A N GLY 523.A O no hydrogen 2.851 N/A SER 496.A N LYS 489.A O no hydrogen 3.393 N/A GLU 498.A N SER 496.A OG no hydrogen 3.344 N/A VAL 500.A N TYR 487.A O no hydrogen 2.939 N/A LEU 502.A N THR 485.A O no hydrogen 2.893 N/A ALA 504.A N THR 503.A OG1 no hydrogen 2.461 N/A GLU 507.A N THR 503.A O no hydrogen 3.170 N/A ASP 508.A N ALA 504.A O no hydrogen 2.922 N/A ARG 509.A N ASP 505.A O no hydrogen 2.940 N/A HIS 510.A N GLU 506.A O no hydrogen 3.217 N/A ALA 513.A N TYR 549.A O no hydrogen 2.761 N/A SER 517.A OG GLN 514.A O no hydrogen 3.130 N/A ILE 519.A N SER 517.A O no hydrogen 2.769 N/A ASP 520.A N ARG 524.A O no hydrogen 2.994 N/A VAL 526.A N PRO 518.A O no hydrogen 3.026 N/A VAL 532.A N GLU 540.A O no hydrogen 2.961 N/A ARG 533.A N VAL 512.A O no hydrogen 2.992 N/A ARG 533.A NH2 TYR 487.A OH no hydrogen 3.144 N/A ARG 533.A NH2 GLU 507.A OE2 no hydrogen 3.524 N/A ARG 534.A N GLU 538.A O no hydrogen 2.912 N/A GLU 540.A N VAL 532.A O no hydrogen 3.345 N/A SER 545.A N PRO 543.A O no hydrogen 2.702 N/A GLU 546.A N PRO 543.A O no hydrogen 3.400 N/A ASP 548.A N VAL 511.A O no hydrogen 3.228 N/A TYR 549.A N VAL 511.A O no hydrogen 3.211 N/A MET 550.A N ARG 488.A O no hydrogen 2.893 N/A SER 553.A OG TYR 474.A OH no hydrogen 3.304 N/A SER 553.A OG PRO 554.A O no hydrogen 3.090 N/A GLN 556.A NE2 PRO 486.A O no hydrogen 3.111 N/A VAL 558.A N ARG 555.A O no hydrogen 3.085 N/A SER 559.A OG GLU 458.A OE1 no hydrogen 2.470 N/A ALA 563.A N SER 559.A O no hydrogen 3.069 N/A ALA 563.A N VAL 560.A O no hydrogen 3.306 N/A MET 564.A N ALA 561.A O no hydrogen 3.391 N/A GLU 569.A N GLU 569.A OE1 no hydrogen 2.419 N/A HIS 570.A N PHE 567.A O no hydrogen 3.489 N/A HIS 570.A NE2 GLU 934.A OE2 no hydrogen 3.033 N/A ASP 571.A N LEU 568.A O no hydrogen 3.232 N/A ASP 572.A N MET 878.A O no hydrogen 3.127 N/A ASN 574.A N ASP 572.A OD1 no hydrogen 3.254 N/A ARG 575.A N ASP 572.A O no hydrogen 3.255 N/A ARG 575.A NH2 GLY 842.A O no hydrogen 2.501 N/A ALA 576.A N ASP 572.A O no hydrogen 2.969 N/A LEU 577.A N ALA 573.A O no hydrogen 2.943 N/A GLY 579.A N ARG 575.A O no hydrogen 2.908 N/A ALA 580.A N ALA 576.A O no hydrogen 2.896 N/A ALA 580.A N LEU 577.A O no hydrogen 3.022 N/A ASN 581.A N LEU 577.A O no hydrogen 2.944 N/A ASN 581.A ND2 THR 459.A O no hydrogen 2.466 N/A VAL 590.A N THR 719.A O no hydrogen 3.117 N/A ARG 591.A NH2 GLU 593.A OE1 no hydrogen 3.376 N/A SER 592.A OG PRO 677.A O no hydrogen 3.543 N/A ALA 594.A N ASP 680.A OD2 no hydrogen 2.711 N/A LEU 596.A N ASN 689.A OD1 no hydrogen 3.154 N/A GLY 598.A N VAL 924.A O no hydrogen 3.121 N/A THR 599.A OG1 ALA 563.A O no hydrogen 2.772 N/A ARG 604.A NH1 VAL 21.A O no hydrogen 3.530 N/A ALA 605.A N MET 601.A O no hydrogen 3.311 N/A ALA 606.A N GLU 602.A O no hydrogen 2.916 N/A ILE 607.A N LEU 603.A O no hydrogen 2.949 N/A ASP 608.A N ARG 604.A O no hydrogen 2.925 N/A ALA 609.A N ALA 605.A O no hydrogen 2.919 N/A VAL 613.A N ALA 674.A O no hydrogen 3.382 N/A ALA 615.A N GLN 671.A O no hydrogen 3.181 N/A GLU 616.A N TYR 641.A OH no hydrogen 3.066 N/A GLY 619.A N VAL 667.A O no hydrogen 3.335 N/A VAL 620.A N MET 632.A O no hydrogen 3.319 N/A ILE 621.A N ASP 665.A O no hydrogen 3.186 N/A GLU 622.A N THR 630.A O no hydrogen 2.868 N/A SER 625.A N TYR 628.A O no hydrogen 3.145 N/A TYR 628.A OH GLU 623.A OE2 no hydrogen 3.083 N/A ILE 629.A N TYR 641.A O no hydrogen 2.956 N/A THR 630.A N GLU 623.A O no hydrogen 2.966 N/A VAL 631.A N ARG 639.A O no hydrogen 2.899 N/A MET 632.A N VAL 620.A O no hydrogen 2.938 N/A HIS 633.A N THR 637.A O no hydrogen 3.113 N/A THR 637.A N ASN 635.A O no hydrogen 2.705 N/A THR 637.A OG1 ASN 635.A O no hydrogen 3.338 N/A ARG 639.A N VAL 631.A O no hydrogen 2.919 N/A TYR 641.A N ILE 629.A O no hydrogen 2.889 N/A MET 643.A N ASP 627.A O no hydrogen 3.068 N/A LYS 645.A NZ GLN 657.A O no hydrogen 2.958 N/A PHE 646.A N ASN 656.A OD1 no hydrogen 3.269 N/A ARG 648.A NE ILE 723.A O no hydrogen 3.240 N/A SER 649.A N THR 653.A O no hydrogen 3.310 N/A SER 649.A OG THR 653.A O no hydrogen 3.232 N/A ASN 650.A N GLN 413.A OE1 no hydrogen 3.269 N/A ASN 650.A ND2 MET 411.A O no hydrogen 3.264 N/A GLY 652.A N SER 649.A O no hydrogen 3.056 N/A THR 653.A OG1 GLN 413.A O no hydrogen 3.533 N/A THR 653.A OG1 ASN 414.A O no hydrogen 3.480 N/A ASP 662.A N ASP 665.A OD2 no hydrogen 3.117 N/A VAL 667.A N GLY 619.A O no hydrogen 2.944 N/A GLU 668.A N GLN 671.A OE1 no hydrogen 2.961 N/A GLY 670.A N ALA 615.A O no hydrogen 3.160 N/A GLN 671.A N GLU 668.A O no hydrogen 2.930 N/A ILE 673.A N VAL 613.A O no hydrogen 2.989 N/A ASP 675.A N CYS 658.A O no hydrogen 3.001 N/A GLY 676.A N THR 679.A OG1 no hydrogen 2.482 N/A ASP 680.A N GLU 683.A O no hydrogen 2.927 N/A ASP 681.A N ASP 675.A OD1 no hydrogen 3.070 N/A GLU 683.A N ASP 680.A O no hydrogen 3.490 N/A ALA 685.A N CYS 678.A O no hydrogen 2.717 N/A LYS 688.A N ILE 982.A O no hydrogen 2.907 N/A LYS 688.A NZ VAL 717.A O no hydrogen 2.547 N/A ASN 689.A ND2 GLU 593.A OE2 no hydrogen 3.394 N/A ASN 689.A ND2 ALA 594.A O no hydrogen 3.493 N/A LEU 690.A N MET 980.A O no hydrogen 2.898 N/A VAL 692.A N GLY 978.A O no hydrogen 2.846 N/A ALA 693.A N ILE 867.A O no hydrogen 3.306 N/A ILE 694.A N THR 976.A O no hydrogen 3.332 N/A TRP 697.A N ASN 701.A OD1 no hydrogen 3.265 N/A HIS 700.A N TRP 697.A O no hydrogen 3.175 N/A ASN 701.A ND2 MET 695.A O no hydrogen 3.629 N/A SER 709.A N ASP 866.A O no hydrogen 3.429 N/A ARG 711.A N SER 709.A OG no hydrogen 3.326 N/A ARG 711.A NE ASP 866.A OD1 no hydrogen 3.514 N/A ARG 711.A NE ASP 866.A OD2 no hydrogen 2.931 N/A ARG 711.A NH1 GLU 715.A OE1 no hydrogen 3.087 N/A ARG 711.A NH2 ASP 866.A OD2 no hydrogen 2.684 N/A VAL 713.A N ASN 710.A O no hydrogen 2.917 N/A GLU 714.A N ASN 710.A O no hydrogen 3.214 N/A THR 719.A OG1 ASP 716.A OD1 no hydrogen 2.704 N/A SER 720.A N ARG 829.A O no hydrogen 2.933 N/A SER 720.A OG ILE 721.A O no hydrogen 3.395 N/A SER 720.A OG HIS 722.A NE2 no hydrogen 2.817 N/A HIS 722.A N GLN 827.A O no hydrogen 2.927 N/A GLU 724.A N VAL 825.A O no hydrogen 2.864 N/A HIS 726.A N VAL 823.A O no hydrogen 2.901 N/A ILE 728.A N VAL 821.A O no hydrogen 3.366 N/A ALA 730.A N GLU 819.A O no hydrogen 3.091 N/A ASP 732.A N GLY 816.A O no hydrogen 2.420 N/A THR 733.A OG1 ASP 732.A O no hydrogen 2.155 N/A GLY 736.A N THR 733.A OG1 no hydrogen 2.884 N/A ARG 742.A NH2 LEU 752.A O no hydrogen 3.438 N/A LEU 752.A N ASP 749.A O no hydrogen 3.224 N/A ALA 753.A N GLU 750.A O no hydrogen 2.803 N/A ASP 756.A N ILE 760.A O no hydrogen 3.242 N/A GLU 757.A N ASP 756.A OD1 no hydrogen 2.810 N/A ARG 762.A NH1 ALA 753.A O no hydrogen 2.950 N/A ILE 772.A N ASP 771.A OD1 no hydrogen 2.348 N/A LEU 773.A N LEU 789.A O no hydrogen 3.217 N/A LYS 776.A NZ ASP 729.A O no hydrogen 2.839 N/A THR 778.A N ARG 785.A O no hydrogen 3.085 N/A THR 778.A OG1 GLU 738.A OE2 no hydrogen 2.348 N/A LYS 780.A N GLU 783.A O no hydrogen 2.943 N/A VAL 784.A N ARG 782.A O no hydrogen 2.806 N/A ARG 785.A N THR 778.A O no hydrogen 2.698 N/A HIS 793.A ND1 ASP 769.A OD2 no hydrogen 3.053 N/A GLY 794.A N ASP 769.A OD2 no hydrogen 3.375 N/A ILE 800.A N TYR 824.A O no hydrogen 3.323 N/A ARG 803.A N ARG 822.A O no hydrogen 2.901 N/A SER 806.A N ASP 811.A OD2 no hydrogen 3.194 N/A SER 806.A OG GLU 819.A OE2 no hydrogen 2.735 N/A ARG 807.A N ASN 818.A O no hydrogen 2.824 N/A ARG 807.A NE VAL 817.A O no hydrogen 2.562 N/A ARG 807.A NH2 VAL 817.A O no hydrogen 2.538 N/A GLU 808.A N SER 806.A OG no hydrogen 3.284 N/A ASP 809.A N SER 806.A O no hydrogen 3.259 N/A GLU 810.A N ARG 807.A O no hydrogen 2.895 N/A ASN 818.A N ALA 730.A O no hydrogen 3.232 N/A ASN 818.A ND2 GLU 738.A O no hydrogen 2.839 N/A LEU 820.A N PHE 805.A O no hydrogen 3.397 N/A ARG 822.A N ARG 803.A O no hydrogen 2.893 N/A ARG 822.A NE TYR 824.A OH no hydrogen 3.556 N/A ARG 822.A NH1 GLU 727.A OE2 no hydrogen 2.980 N/A VAL 823.A N HIS 726.A O no hydrogen 2.896 N/A TYR 824.A N GLY 801.A O no hydrogen 2.924 N/A VAL 825.A N GLU 724.A O no hydrogen 2.940 N/A ALA 826.A N LYS 798.A O no hydrogen 3.003 N/A GLN 827.A N HIS 722.A O no hydrogen 2.926 N/A ARG 829.A N SER 720.A O no hydrogen 2.896 N/A ARG 829.A NH1 ASP 991.A OD1 no hydrogen 2.532 N/A ARG 829.A NH1 ASP 991.A OD2 no hydrogen 3.216 N/A SER 832.A N ASP 835.A OD2 no hydrogen 2.547 N/A GLY 834.A N ILE 847.A O no hydrogen 3.507 N/A ASP 835.A N SER 832.A O no hydrogen 3.329 N/A GLY 839.A N ASN 843.A OD1 no hydrogen 2.547 N/A ARG 840.A NH1 VAL 597.A O no hydrogen 3.568 N/A ARG 840.A NH2 VAL 597.A O no hydrogen 2.892 N/A ARG 840.A NH2 GLU 885.A OE2 no hydrogen 2.890 N/A HIS 841.A ND1 ASP 571.A OD2 no hydrogen 2.638 N/A HIS 841.A NE2 GLU 885.A OE1 no hydrogen 2.397 N/A ASN 843.A ND2 GLN 882.A OE1 no hydrogen 2.719 N/A GLY 845.A N LEU 837.A O no hydrogen 3.165 N/A GLY 848.A N ILE 706.A O no hydrogen 2.604 N/A LEU 851.A N LEU 708.A O no hydrogen 3.185 N/A PHE 858.A N PHE 963.A O no hydrogen 3.194 N/A LEU 859.A N THR 863.A O no hydrogen 2.991 N/A GLY 862.A N LEU 859.A O no hydrogen 3.160 N/A THR 863.A N ASP 861.A OD1 no hydrogen 3.078 N/A THR 863.A OG1 ASP 861.A OD1 no hydrogen 2.984 N/A VAL 865.A N PRO 857.A O no hydrogen 3.180 N/A ASP 866.A N LEU 691.A O no hydrogen 3.031 N/A ILE 868.A N ILE 707.A O no hydrogen 3.126 N/A LEU 869.A N ALA 693.A O no hydrogen 3.128 N/A THR 871.A OG1 ILE 694.A O no hydrogen 2.717 N/A VAL 874.A N THR 871.A O no hydrogen 3.349 N/A ARG 876.A NH2 HIS 872.A O no hydrogen 3.493 N/A GLY 881.A N ASP 571.A OD1 no hydrogen 2.910 N/A GLN 882.A N ASN 879.A O no hydrogen 3.206 N/A GLN 882.A NE2 ASN 879.A O no hydrogen 3.538 N/A GLN 882.A NE2 ASN 879.A OD1 no hydrogen 2.311 N/A LEU 884.A N ILE 880.A O no hydrogen 3.441 N/A GLU 885.A N GLY 881.A O no hydrogen 2.891 N/A THR 886.A N GLN 882.A O no hydrogen 2.698 N/A THR 886.A OG1 GLN 882.A O no hydrogen 3.046 N/A HIS 887.A N ILE 883.A O no hydrogen 2.998 N/A LEU 888.A N LEU 884.A O no hydrogen 2.945 N/A GLY 889.A N GLU 885.A O no hydrogen 2.635 N/A TRP 890.A N THR 886.A O no hydrogen 3.079 N/A CYS 891.A N HIS 887.A O no hydrogen 3.137 N/A CYS 891.A SG HIS 887.A O no hydrogen 3.751 N/A ALA 892.A N LEU 888.A O no hydrogen 2.865 N/A HIS 893.A N GLY 889.A O no hydrogen 2.927 N/A SER 894.A N TRP 890.A O no hydrogen 2.892 N/A GLY 895.A N CYS 891.A O no hydrogen 3.153 N/A TRP 896.A NE1 LEU 915.A O no hydrogen 3.102 N/A LYS 897.A NZ GLU 917.A OE1 no hydrogen 3.072 N/A VAL 898.A N LEU 916.A O no hydrogen 2.668 N/A ALA 908.A N PRO 905.A O no hydrogen 2.976 N/A ALA 909.A N ASP 906.A O no hydrogen 3.044 N/A LEU 911.A N ALA 908.A O no hydrogen 3.336 N/A GLU 914.A N ASP 913.A OD1 no hydrogen 2.658 N/A ALA 918.A N TRP 896.A O no hydrogen 3.051 N/A ASN 921.A N HIS 893.A O no hydrogen 3.043 N/A ALA 922.A N ALA 892.A O no hydrogen 3.226 N/A VAL 924.A N LEU 596.A O no hydrogen 3.029 N/A SER 925.A N VAL 10.A O no hydrogen 2.705 N/A SER 925.A OG VAL 10.A O no hydrogen 3.084 N/A THR 926.A N GLY 598.A O no hydrogen 3.156 N/A THR 926.A OG1 THR 926.A O no hydrogen 2.301 N/A GLN 933.A N GLU 936.A OE1 no hydrogen 2.970 N/A LEU 937.A N GLN 933.A O no hydrogen 3.194 N/A GLN 938.A N GLU 934.A O no hydrogen 2.945 N/A GLY 939.A N ALA 935.A O no hydrogen 2.927 N/A LEU 940.A N GLU 936.A O no hydrogen 2.903 N/A LEU 941.A N LEU 937.A O no hydrogen 2.916 N/A SER 942.A N GLN 938.A O no hydrogen 2.938 N/A CYS 943.A N LEU 940.A O no hydrogen 3.154 N/A CYS 943.A SG LYS 897.A O no hydrogen 3.801 N/A CYS 943.A SG GLY 939.A O no hydrogen 3.598 N/A CYS 943.A SG LEU 940.A O no hydrogen 3.829 N/A CYS 943.A SG CYS 943.A O no hydrogen 2.889 N/A LEU 945.A N GLY 895.A O no hydrogen 3.005 N/A ASN 947.A N ASN 947.A OD1 no hydrogen 2.476 N/A ASP 951.A N ASP 949.A O no hydrogen 2.524 N/A GLY 958.A N ASP 955.A O no hydrogen 2.960 N/A LYS 959.A N ASP 955.A OD1 no hydrogen 3.395 N/A ALA 960.A N VAL 975.A O no hydrogen 2.542 N/A PHE 963.A N PHE 858.A O no hydrogen 3.150 N/A ASP 964.A N GLU 969.A O no hydrogen 3.145 N/A ARG 966.A N ASP 964.A OD1 no hydrogen 3.151 N/A SER 967.A OG ASP 964.A OD2 no hydrogen 2.742 N/A GLY 968.A N ASP 964.A O no hydrogen 2.891 N/A PHE 971.A N LEU 962.A O no hydrogen 3.060 N/A VAL 975.A N ALA 960.A O no hydrogen 2.667 N/A GLY 978.A N VAL 692.A O no hydrogen 2.962 N/A MET 980.A N LEU 690.A O no hydrogen 2.966 N/A ILE 982.A N LYS 688.A O no hydrogen 2.951 N/A MET 983.A N ALA 838.A O no hydrogen 3.284 N/A HIS 986.A N GLN 585.A O no hydrogen 3.032 N/A HIS 987.A ND1 HIS 986.A O no hydrogen 2.642 N/A LYS 992.A N VAL 989.A O no hydrogen 2.673 N/A ILE 993.A N VAL 989.A O no hydrogen 3.203 N/A HIS 994.A NE2 PHE 1015.A O no hydrogen 2.262 N/A ARG 996.A NH1 PRO 1000.A O no hydrogen 3.256 N/A ARG 996.A NH2 PRO 1000.A O no hydrogen 3.074 N/A THR 998.A OG1 SER 997.A O no hydrogen 2.653 N/A SER 1002.A N GLN 1007.A O no hydrogen 2.789 N/A LYS 1012.A NZ ILE 993.A O no hydrogen 3.054 N/A GLY 1017.A N LEU 1009.A O no hydrogen 3.279 N/A GLU 1024.A N GLY 1021.A O no hydrogen 3.331 N/A CYS 1025.A N GLU 1022.A O no hydrogen 3.194 N/A GLN 1029.A N CYS 1025.A O no hydrogen 3.326 N/A ALA 1030.A N TRP 1026.A O no hydrogen 2.747 N/A TYR 1031.A N ALA 1027.A O no hydrogen 2.930 N/A GLY 1032.A N GLN 1029.A O no hydrogen 3.018 N/A GLN 1038.A N ALA 1034.A O no hydrogen 2.918 N/A GLU 1039.A N TYR 1035.A O no hydrogen 2.941 N/A LEU 1040.A N THR 1036.A O no hydrogen 2.864 N/A LEU 1041.A N LEU 1037.A O no hydrogen 2.997 N/A LEU 1041.A N GLN 1038.A O no hydrogen 3.266 N/A THR 1042.A OG1 GLN 1038.A O no hydrogen 2.334 N/A SER 1045.A OG ASP 1046.A OD2 no hydrogen 3.169 N/A ARG 1051.A N ASP 1047.A O no hydrogen 3.171 N/A ARG 1051.A NH1 SER 1045.A O no hydrogen 3.404 N/A LYS 1053.A N VAL 1049.A O no hydrogen 3.002 N/A VAL 1054.A N GLY 1050.A O no hydrogen 2.861 N/A TYR 1055.A N ARG 1051.A O no hydrogen 2.967 N/A GLU 1056.A N VAL 1052.A O no hydrogen 2.961 N/A ALA 1057.A N LYS 1053.A O no hydrogen 2.901 N/A ILE 1058.A N VAL 1054.A O no hydrogen 2.901 N/A VAL 1059.A N TYR 1055.A O no hydrogen 3.007 N/A LYS 1060.A N GLU 1056.A O no hydrogen 2.945 N/A GLY 1061.A N ILE 1058.A O no hydrogen 3.289 N/A GLU 1062.A N ALA 1057.A O no hydrogen 2.843 N/A GLY 1068.A N ASP 1047.A OD2 no hydrogen 2.446 N/A GLU 1071.A N ASP 1046.A OD1 no hydrogen 3.059 N/A PHE 1073.A N PRO 1070.A O no hydrogen 3.161 N/A LYS 1074.A NZ GLU 1071.A OE1 no hydrogen 3.340 N/A VAL 1075.A N GLU 1071.A O no hydrogen 2.980 N/A LEU 1076.A N SER 1072.A O no hydrogen 2.879 N/A LEU 1077.A N PHE 1073.A O no hydrogen 2.941 N/A LYS 1078.A N LYS 1074.A O no hydrogen 2.972 N/A LYS 1078.A NZ GLN 1081.A OE1 no hydrogen 3.550 N/A GLU 1079.A N VAL 1075.A O no hydrogen 2.916 N/A LEU 1080.A N LEU 1076.A O no hydrogen 2.906 N/A GLN 1081.A N LEU 1077.A O no hydrogen 2.915 N/A GLN 1081.A NE2 VAL 1087.A O no hydrogen 3.699 N/A SER 1082.A N LYS 1078.A O no hydrogen 2.924 N/A LEU 1083.A N LEU 1080.A O no hydrogen 2.995 N/A CYS 1084.A N GLN 1081.A O no hydrogen 3.162 N/A VAL 1087.A N LEU 1085.A O no hydrogen 2.838 N/A