Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ajw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 7.A N LEU 3.A O no hydrogen 2.811 N/A ILE 8.A N ILE 4.A O no hydrogen 3.123 N/A SER 9.A OG ASN 5.A O no hydrogen 3.317 N/A LEU 11.A N GLN 7.A O no hydrogen 3.103 N/A ILE 12.A N ILE 8.A O no hydrogen 2.650 N/A LYS 14.A N SER 9.A O no hydrogen 3.176 N/A GLY 15.A N GLU 18.A OE2 no hydrogen 3.044 N/A LEU 16.A N SER 9.A OG no hydrogen 3.292 N/A GLU 18.A N GLY 15.A O no hydrogen 3.355 N/A SER 21.A N HIS 17.A O no hydrogen 2.858 N/A SER 21.A OG HIS 17.A O no hydrogen 3.504 N/A SER 21.A OG GLU 18.A O no hydrogen 2.735 N/A ARG 23.A N ASP 20.A O no hydrogen 3.233 N/A ARG 23.A NE ASP 20.A O no hydrogen 3.043 N/A GLU 26.A N ASP 24.A OD1 no hydrogen 3.272 N/A ASN 28.A N ASP 24.A O no hydrogen 3.360 N/A ASP 29.A N PRO 25.A O no hydrogen 2.848 N/A PHE 30.A N GLU 26.A O no hydrogen 3.113 N/A ARG 31.A N VAL 27.A O no hydrogen 3.106 N/A ARG 31.A NH1 LEU 16.A O no hydrogen 3.276 N/A ARG 31.A NH1 ASP 20.A OD2 no hydrogen 3.045 N/A THR 32.A N ASN 28.A O no hydrogen 3.252 N/A THR 32.A OG1 ASN 28.A O no hydrogen 2.973 N/A THR 32.A OG1 ASP 29.A O no hydrogen 3.074 N/A LYS 33.A N ASP 29.A O no hydrogen 3.177 N/A MET 34.A N PHE 30.A O no hydrogen 2.937 N/A ARG 35.A NE GLU 39.A OE2 no hydrogen 3.524 N/A PHE 37.A N LYS 33.A O no hydrogen 3.242 N/A CYS 38.A N MET 34.A O no hydrogen 2.846 N/A CYS 38.A SG MET 34.A O no hydrogen 3.260 N/A CYS 38.A SG ALA 429.A O no hydrogen 3.232 N/A GLU 39.A N ARG 35.A O no hydrogen 2.857 N/A GLU 40.A N GLN 36.A O no hydrogen 3.048 N/A ALA 41.A N PHE 37.A O no hydrogen 3.323 N/A ALA 42.A N CYS 38.A O no hydrogen 3.130 N/A ALA 43.A N GLU 39.A O no hydrogen 2.971 N/A HIS 44.A N GLU 40.A O no hydrogen 3.160 N/A ARG 45.A N ALA 41.A O no hydrogen 3.301 N/A GLN 46.A NE2 ARG 158.A O no hydrogen 3.266 N/A GLN 47.A N HIS 44.A O no hydrogen 3.187 N/A GLY 49.A N GLU 52.A OE1 no hydrogen 2.962 N/A TRP 53.A N GLY 49.A O no hydrogen 2.908 N/A LEU 54.A N TRP 50.A O no hydrogen 3.279 N/A GLN 55.A N VAL 51.A O no hydrogen 3.088 N/A TYR 56.A N TRP 53.A O no hydrogen 3.220 N/A SER 57.A N TRP 53.A O no hydrogen 3.022 N/A PHE 58.A N LEU 54.A O no hydrogen 2.859 N/A GLN 61.A NE2 PRO 59.A O no hydrogen 3.016 N/A GLU 63.A N HIS 130.A O no hydrogen 2.778 N/A ARG 67.A NH1 SER 65.A OG no hydrogen 3.070 N/A LEU 69.A N VAL 86.A O no hydrogen 3.177 N/A VAL 71.A N PHE 84.A O no hydrogen 2.801 N/A ASN 72.A N PRO 144.A O no hydrogen 3.118 N/A ASN 72.A ND2 THR 83.A OG1 no hydrogen 2.805 N/A VAL 73.A N PHE 82.A O no hydrogen 3.192 N/A LYS 74.A N LEU 146.A O no hydrogen 3.207 N/A LYS 74.A NZ GLU 526.A OE2 no hydrogen 2.805 N/A PHE 82.A N VAL 73.A O no hydrogen 2.838 N/A PHE 84.A N VAL 71.A O no hydrogen 3.150 N/A VAL 86.A N LEU 69.A O no hydrogen 3.366 N/A SER 87.A N ASP 90.A OD2 no hydrogen 3.290 N/A SER 87.A OG ARG 67.A O no hydrogen 3.260 N/A THR 88.A N ARG 67.A O no hydrogen 2.812 N/A THR 88.A OG1 ARG 67.A O no hydrogen 2.829 N/A ASP 90.A N SER 87.A O no hydrogen 3.402 N/A ALA 94.A N MET 91.A O no hydrogen 3.236 N/A MET 96.A N PRO 92.A O no hydrogen 3.005 N/A ALA 97.A N LEU 93.A O no hydrogen 2.872 N/A CYS 98.A N ALA 94.A O no hydrogen 3.123 N/A ALA 99.A N LEU 95.A O no hydrogen 3.086 N/A LEU 100.A N MET 96.A O no hydrogen 3.093 N/A THR 105.A OG1 LYS 102.A O no hydrogen 3.160 N/A VAL 106.A N LYS 102.A O no hydrogen 3.353 N/A GLU 110.A N GLN 107.A O no hydrogen 3.492 N/A TYR 111.A N PRO 108.A O no hydrogen 3.288 N/A ALA 112.A N VAL 149.A O no hydrogen 2.797 N/A LEU 113.A N LEU 122.A O no hydrogen 3.414 N/A GLN 114.A N THR 147.A O no hydrogen 2.791 N/A VAL 115.A N GLU 120.A O no hydrogen 3.089 N/A ASN 116.A N HIS 145.A O no hydrogen 3.217 N/A ASN 116.A ND2 GLU 526.A O no hydrogen 3.607 N/A ARG 118.A N VAL 115.A O no hydrogen 3.060 N/A ARG 118.A NE SER 497.A O no hydrogen 3.568 N/A HIS 119.A N SER 497.A O no hydrogen 2.760 N/A LEU 122.A N LEU 113.A O no hydrogen 2.701 N/A TYR 123.A OH PHE 58.A O no hydrogen 2.891 N/A TYR 126.A N GLY 124.A O no hydrogen 2.960 N/A LEU 128.A N ASP 90.A O no hydrogen 2.885 N/A CYS 129.A N THR 88.A O no hydrogen 3.084 N/A CYS 129.A SG THR 88.A O no hydrogen 4.045 N/A HIS 130.A N PRO 127.A O no hydrogen 2.960 N/A PHE 131.A N LEU 128.A O no hydrogen 3.371 N/A GLN 132.A N GLN 61.A O no hydrogen 2.954 N/A GLN 132.A NE2 LEU 62.A O no hydrogen 2.854 N/A CYS 135.A N PHE 131.A O no hydrogen 3.452 N/A CYS 135.A SG GLU 63.A OE2 no hydrogen 3.375 N/A CYS 135.A SG PHE 131.A O no hydrogen 3.544 N/A CYS 135.A SG GLN 132.A O no hydrogen 3.317 N/A SER 136.A OG GLN 132.A O no hydrogen 3.131 N/A SER 136.A OG TYR 133.A O no hydrogen 2.697 N/A CYS 137.A N TYR 133.A O no hydrogen 3.291 N/A CYS 137.A SG TYR 133.A O no hydrogen 3.344 N/A LEU 138.A N ILE 134.A O no hydrogen 3.221 N/A HIS 139.A ND1 CYS 135.A O no hydrogen 3.215 N/A SER 140.A OG SER 136.A O no hydrogen 2.934 N/A THR 143.A OG1 LEU 70.A O no hydrogen 2.715 N/A HIS 145.A N TYR 133.A OH no hydrogen 3.189 N/A LEU 146.A N ASN 72.A O no hydrogen 3.049 N/A THR 147.A N GLN 114.A O no hydrogen 2.706 N/A THR 147.A OG1 ASN 116.A OD1 no hydrogen 2.847 N/A MET 148.A N LYS 74.A O no hydrogen 2.787 N/A VAL 149.A N ALA 112.A O no hydrogen 2.897 N/A HIS 150.A ND1 SER 152.A OG no hydrogen 2.897 N/A SER 151.A N GLU 110.A O no hydrogen 2.748 N/A SER 151.A OG GLU 110.A OE1 no hydrogen 3.000 N/A SER 152.A N HIS 150.A ND1 no hydrogen 3.245 N/A SER 152.A OG HIS 150.A ND1 no hydrogen 2.897 N/A SER 153.A N HIS 150.A O no hydrogen 3.123 N/A SER 153.A OG GLU 76.A OE1 no hydrogen 2.891 N/A SER 153.A OG GLU 76.A OE2 no hydrogen 3.566 N/A LEU 155.A N SER 151.A O no hydrogen 2.949 N/A ALA 156.A N SER 152.A O no hydrogen 3.022 N/A MET 157.A N SER 153.A O no hydrogen 3.123 N/A ARG 158.A N ILE 154.A O no hydrogen 3.079 N/A ARG 158.A NE GLN 46.A O no hydrogen 2.800 N/A ARG 158.A NH2 GLN 46.A O no hydrogen 2.992 N/A ASP 159.A N LEU 155.A O no hydrogen 3.269 N/A SER 162.A OG ASP 159.A O no hydrogen 3.153 N/A ASN 163.A ND2 GLY 433.A O no hydrogen 2.803 N/A PHE 166.A N ILE 195.A O no hydrogen 2.847 N/A GLU 169.A N TYR 265.A O no hydrogen 3.062 N/A ILE 171.A N VAL 263.A O no hydrogen 3.180 N/A GLN 180.A N ALA 209.A O no hydrogen 2.929 N/A GLY 182.A N CYS 207.A O no hydrogen 2.995 N/A PHE 184.A N ARG 205.A O no hydrogen 2.816 N/A HIS 185.A N GLU 188.A O no hydrogen 3.248 N/A LEU 190.A N LEU 183.A O no hydrogen 2.971 N/A VAL 197.A N GLN 164.A O no hydrogen 2.794 N/A CYS 198.A SG SER 196.A OG no hydrogen 3.416 N/A ASP 199.A N SER 196.A O no hydrogen 3.163 N/A ARG 202.A NE ASP 228.A OD1 no hydrogen 2.770 N/A ARG 202.A NH1 ARG 202.A O no hydrogen 3.227 N/A ARG 202.A NH1 TYR 383.A OH no hydrogen 2.759 N/A ARG 202.A NH2 ASP 228.A OD1 no hydrogen 2.887 N/A ARG 205.A N PHE 184.A O no hydrogen 2.707 N/A ARG 205.A NH1 PRO 246.A O no hydrogen 2.946 N/A LEU 206.A N LEU 221.A O no hydrogen 2.910 N/A CYS 207.A N GLY 182.A O no hydrogen 2.848 N/A CYS 207.A SG ASN 220.A OD1 no hydrogen 3.477 N/A PHE 208.A N ALA 219.A O no hydrogen 2.752 N/A ALA 209.A N GLN 180.A O no hydrogen 3.040 N/A LEU 210.A N ALA 217.A O no hydrogen 2.801 N/A ALA 212.A N CYS 214.A O no hydrogen 3.039 N/A CYS 214.A N ALA 212.A O no hydrogen 2.887 N/A ILE 216.A N LEU 210.A O no hydrogen 2.942 N/A ALA 217.A N LEU 210.A O no hydrogen 3.145 N/A TRP 218.A N TRP 240.A O no hydrogen 2.957 N/A ALA 219.A N PHE 208.A O no hydrogen 3.091 N/A ASN 220.A ND2 ASN 245.A O no hydrogen 2.803 N/A ASN 220.A ND2 GLY 248.A O no hydrogen 3.344 N/A LEU 221.A N LEU 206.A O no hydrogen 3.163 N/A ASP 225.A N GLN 229.A O no hydrogen 2.796 N/A LYS 227.A N ASP 225.A OD1 no hydrogen 3.198 N/A LYS 227.A NZ ASP 29.A OD2 no hydrogen 3.473 N/A GLN 229.A N ASP 225.A OD1 no hydrogen 2.778 N/A GLN 229.A NE2 LEU 230.A O no hydrogen 2.925 N/A LEU 230.A N VAL 272.A O no hydrogen 3.061 N/A LYS 231.A N LEU 223.A O no hydrogen 2.793 N/A LYS 231.A NZ MET 222.A O no hydrogen 3.283 N/A ARG 235.A N ILE 264.A O no hydrogen 2.776 N/A LEU 237.A N LEU 262.A O no hydrogen 2.728 N/A MET 239.A N ALA 260.A O no hydrogen 2.764 N/A TRP 240.A N TRP 218.A O no hydrogen 2.878 N/A TRP 240.A NE1 ARG 251.A O no hydrogen 2.954 N/A SER 242.A N ILE 216.A O no hydrogen 3.073 N/A ARG 251.A N THR 249.A OG1 no hydrogen 3.409 N/A ASN 253.A N TYR 238.A O no hydrogen 2.814 N/A ASN 253.A ND2 MET 239.A O no hydrogen 3.300 N/A ASN 255.A N ASN 253.A OD1 no hydrogen 3.118 N/A THR 256.A N PRO 254.A O no hydrogen 2.957 N/A SER 258.A OG GLU 257.A OE1 no hydrogen 2.914 N/A ALA 259.A N ASN 255.A O no hydrogen 3.214 N/A LEU 262.A N LEU 237.A O no hydrogen 2.880 N/A VAL 263.A N GLU 172.A O no hydrogen 2.951 N/A ILE 264.A N ARG 235.A O no hydrogen 2.894 N/A TYR 265.A N GLU 169.A O no hydrogen 2.983 N/A TYR 265.A OH GLU 268.A OE1 no hydrogen 2.771 N/A LEU 266.A N GLY 233.A O no hydrogen 2.793 N/A GLU 268.A N GLU 268.A OE1 no hydrogen 2.800 N/A PHE 274.A N ASP 228.A O no hydrogen 2.751 N/A LYS 279.A N ALA 276.A O no hydrogen 2.932 N/A ILE 280.A N ALA 276.A O no hydrogen 3.288 N/A LEU 281.A N LEU 277.A O no hydrogen 3.166 N/A LEU 289.A N HIS 285.A O no hydrogen 3.373 N/A VAL 290.A N GLU 286.A O no hydrogen 2.943 N/A TRP 291.A N LYS 287.A O no hydrogen 3.264 N/A LYS 292.A N ASP 288.A O no hydrogen 3.092 N/A MET 293.A N LEU 289.A O no hydrogen 3.104 N/A ARG 294.A NH1 TRP 291.A O no hydrogen 3.285 N/A GLU 296.A N MET 293.A O no hydrogen 2.859 N/A VAL 297.A N MET 293.A O no hydrogen 3.107 N/A GLN 298.A N ARG 294.A O no hydrogen 3.320 N/A GLN 298.A NE2 GLN 298.A O no hydrogen 2.918 N/A GLU 299.A N HIS 295.A O no hydrogen 3.263 N/A HIS 300.A N GLU 296.A O no hydrogen 2.794 N/A PHE 301.A N VAL 297.A O no hydrogen 2.993 N/A ALA 304.A N PHE 301.A O no hydrogen 3.273 N/A LEU 308.A N ALA 304.A O no hydrogen 3.104 N/A LEU 309.A N LEU 305.A O no hydrogen 2.796 N/A TRP 314.A NE1 LEU 309.A O no hydrogen 3.027 N/A ASN 315.A ND2 LEU 190.A O no hydrogen 3.508 N/A LYS 316.A N LYS 313.A O no hydrogen 3.481 N/A HIS 317.A N ASP 199.A OD1 no hydrogen 3.088 N/A HIS 317.A ND1 ASP 199.A OD1 no hydrogen 2.753 N/A ALA 321.A N HIS 317.A O no hydrogen 3.296 N/A GLN 322.A N GLU 318.A O no hydrogen 3.223 N/A GLN 322.A NE2 GLU 318.A OE2 no hydrogen 2.973 N/A MET 323.A N ASP 319.A O no hydrogen 3.098 N/A LEU 324.A N VAL 320.A O no hydrogen 2.981 N/A TYR 325.A N ALA 321.A O no hydrogen 3.317 N/A LEU 327.A N MET 323.A O no hydrogen 2.993 N/A CYS 328.A N LEU 324.A O no hydrogen 3.160 N/A CYS 328.A SG LEU 324.A O no hydrogen 3.363 N/A SER 329.A N LEU 326.A O no hydrogen 3.247 N/A SER 329.A OG GLN 298.A OE1 no hydrogen 3.428 N/A SER 329.A OG TYR 325.A O no hydrogen 3.360 N/A SER 329.A OG LEU 326.A O no hydrogen 3.114 N/A TRP 330.A N LEU 327.A O no hydrogen 3.408 N/A TRP 330.A NE1 PRO 302.A O no hydrogen 3.197 N/A SER 337.A N PRO 334.A O no hydrogen 2.962 N/A ALA 338.A N PRO 334.A O no hydrogen 3.095 N/A LEU 339.A N VAL 335.A O no hydrogen 3.159 N/A SER 345.A OG ASP 343.A OD2 no hydrogen 3.321 N/A PHE 346.A N ASP 343.A O no hydrogen 3.209 N/A GLY 352.A N ASP 348.A O no hydrogen 2.992 N/A SER 353.A N CYS 349.A O no hydrogen 2.826 N/A PHE 354.A N TYR 350.A O no hydrogen 3.014 N/A ALA 355.A N VAL 351.A O no hydrogen 2.995 N/A ILE 356.A N GLY 352.A O no hydrogen 3.156 N/A LYS 357.A N SER 353.A O no hydrogen 3.029 N/A SER 358.A N PHE 354.A O no hydrogen 3.129 N/A SER 358.A OG GLU 332.A OE1 no hydrogen 3.256 N/A SER 358.A OG PHE 354.A O no hydrogen 3.115 N/A LEU 359.A N ALA 355.A O no hydrogen 2.803 N/A LYS 361.A NZ LEU 333.A O no hydrogen 2.735 N/A LYS 361.A NZ SER 358.A O no hydrogen 2.843 N/A LEU 362.A N LEU 359.A O no hydrogen 3.217 N/A THR 363.A OG1 GLU 366.A OE1 no hydrogen 3.249 N/A LEU 367.A N THR 363.A O no hydrogen 2.866 N/A PHE 368.A N ASP 364.A O no hydrogen 3.311 N/A GLN 369.A N ASP 365.A O no hydrogen 3.342 N/A TYR 370.A N GLU 366.A O no hydrogen 3.404 N/A LEU 374.A N TYR 370.A O no hydrogen 3.122 N/A VAL 375.A N LEU 371.A O no hydrogen 3.153 N/A LEU 378.A N VAL 375.A O no hydrogen 3.343 N/A LYS 379.A N GLN 376.A O no hydrogen 3.208 N/A LYS 379.A NZ GLU 413.A OE2 no hydrogen 2.783 N/A LYS 379.A NZ ALA 723.A O no hydrogen 3.439 N/A TYR 380.A N VAL 377.A O no hydrogen 3.058 N/A GLU 381.A N VAL 377.A O no hydrogen 3.215 N/A TYR 383.A OH PHE 224.A O no hydrogen 2.627 N/A CYS 386.A SG GLU 381.A OE1 no hydrogen 3.398 N/A CYS 386.A SG TYR 383.A O no hydrogen 3.948 N/A CYS 386.A SG LEU 384.A O no hydrogen 3.878 N/A CYS 386.A SG THR 389.A OG1 no hydrogen 3.002 N/A THR 389.A OG1 LEU 384.A O no hydrogen 3.564 N/A LYS 390.A N CYS 386.A O no hydrogen 3.243 N/A LYS 390.A NZ ASP 385.A OD1 no hydrogen 3.197 N/A LYS 390.A NZ GLU 387.A OE2 no hydrogen 2.847 N/A PHE 391.A N GLU 387.A O no hydrogen 2.921 N/A LEU 392.A N LEU 388.A O no hydrogen 2.873 N/A LEU 393.A N THR 389.A O no hydrogen 2.953 N/A GLY 394.A N LYS 390.A O no hydrogen 2.987 N/A ARG 395.A N PHE 391.A O no hydrogen 3.166 N/A ARG 395.A NE ASP 364.A OD1 no hydrogen 3.506 N/A ARG 395.A NH2 LEU 362.A O no hydrogen 2.806 N/A ARG 395.A NH2 ASP 364.A OD1 no hydrogen 3.389 N/A ALA 396.A N LEU 392.A O no hydrogen 3.127 N/A LEU 397.A N LEU 393.A O no hydrogen 3.158 N/A ASN 399.A N ARG 395.A O no hydrogen 3.128 N/A ASN 399.A ND2 ASP 364.A OD2 no hydrogen 2.929 N/A ARG 400.A N TYR 56.A O no hydrogen 2.896 N/A ARG 400.A NH1 HIS 436.A ND1 no hydrogen 3.379 N/A LYS 401.A N ASN 399.A OD1 no hydrogen 3.206 N/A LYS 401.A NZ GLN 61.A OE1 no hydrogen 3.111 N/A ILE 402.A N ASN 399.A OD1 no hydrogen 3.221 N/A GLY 403.A N ASN 399.A O no hydrogen 3.098 N/A HIS 404.A N ARG 400.A O no hydrogen 3.027 N/A HIS 404.A NE2 PRO 493.A O no hydrogen 2.846 N/A PHE 405.A N LYS 401.A O no hydrogen 3.349 N/A LEU 406.A N ILE 402.A O no hydrogen 2.911 N/A PHE 407.A N GLY 403.A O no hydrogen 3.439 N/A TRP 408.A N HIS 404.A O no hydrogen 3.447 N/A TRP 408.A NE1 GLN 444.A OE1 no hydrogen 3.000 N/A HIS 409.A N PHE 405.A O no hydrogen 3.074 N/A HIS 409.A N LEU 406.A O no hydrogen 3.240 N/A LEU 410.A N LEU 406.A O no hydrogen 3.212 N/A LEU 410.A N PHE 407.A O no hydrogen 3.188 N/A ARG 411.A N PHE 407.A O no hydrogen 2.799 N/A ARG 411.A NE LEU 11.A O no hydrogen 2.927 N/A ARG 411.A NH1 ARG 411.A O no hydrogen 3.513 N/A SER 412.A N TRP 408.A O no hydrogen 3.182 N/A SER 412.A OG TRP 408.A O no hydrogen 2.930 N/A SER 412.A OG HIS 409.A O no hydrogen 3.496 N/A MET 414.A N ARG 411.A O no hydrogen 3.359 N/A VAL 416.A N GLU 413.A O no hydrogen 3.228 N/A ARG 422.A NH1 TYR 383.A O no hydrogen 2.788 N/A ARG 422.A NH2 TYR 383.A O no hydrogen 3.046 N/A PHE 423.A N VAL 419.A O no hydrogen 3.042 N/A LEU 425.A N LEU 421.A O no hydrogen 3.098 N/A ILE 426.A N ARG 422.A O no hydrogen 3.144 N/A MET 427.A N PHE 423.A O no hydrogen 3.144 N/A GLU 428.A N GLY 424.A O no hydrogen 3.041 N/A ALA 429.A N LEU 425.A O no hydrogen 3.209 N/A TYR 430.A N ILE 426.A O no hydrogen 3.066 N/A TYR 430.A OH HIS 437.A ND1 no hydrogen 2.943 N/A CYS 431.A N MET 427.A O no hydrogen 3.065 N/A CYS 431.A SG MET 427.A O no hydrogen 3.279 N/A ARG 432.A N ALA 429.A O no hydrogen 3.252 N/A SER 434.A N TYR 430.A O no hydrogen 2.935 N/A SER 434.A OG TYR 56.A OH no hydrogen 3.017 N/A THR 435.A N ASN 163.A OD1 no hydrogen 3.270 N/A VAL 440.A N HIS 436.A O no hydrogen 3.172 N/A LEU 441.A N HIS 437.A O no hydrogen 2.947 N/A MET 442.A N MET 438.A O no hydrogen 3.131 N/A LYS 443.A NZ GLU 485.A O no hydrogen 2.948 N/A LYS 443.A NZ GLU 485.A OE2 no hydrogen 3.104 N/A GLN 444.A NE2 VAL 440.A O no hydrogen 3.607 N/A GLY 445.A N LEU 441.A O no hydrogen 2.995 N/A GLU 446.A N MET 442.A O no hydrogen 2.888 N/A ALA 447.A N LYS 443.A O no hydrogen 3.154 N/A LEU 448.A N GLN 444.A O no hydrogen 3.028 N/A SER 449.A N GLY 445.A O no hydrogen 3.185 N/A SER 449.A OG GLY 445.A O no hydrogen 2.727 N/A LYS 450.A N GLU 446.A O no hydrogen 3.148 N/A LEU 451.A N ALA 447.A O no hydrogen 3.018 N/A LYS 452.A N LEU 448.A O no hydrogen 3.096 N/A LYS 452.A NZ ASP 456.A OD1 no hydrogen 3.418 N/A LYS 452.A NZ ASP 456.A OD2 no hydrogen 3.171 N/A ALA 453.A N SER 449.A O no hydrogen 3.335 N/A LEU 454.A N LYS 450.A O no hydrogen 2.937 N/A ASN 455.A N LEU 451.A O no hydrogen 2.845 N/A ASP 456.A N LYS 452.A O no hydrogen 2.953 N/A PHE 457.A N ALA 453.A O no hydrogen 3.041 N/A VAL 458.A N LEU 454.A O no hydrogen 3.066 N/A LYS 459.A N ASN 455.A O no hydrogen 2.817 N/A LYS 459.A NZ ASN 455.A OD1 no hydrogen 2.804 N/A LYS 459.A NZ MET 515.A O no hydrogen 2.813 N/A LYS 459.A NZ ASN 539.A O no hydrogen 3.499 N/A VAL 460.A N ASP 456.A O no hydrogen 3.249 N/A SER 461.A N PHE 457.A O no hydrogen 3.221 N/A SER 462.A N VAL 458.A O no hydrogen 3.015 N/A SER 462.A OG VAL 458.A O no hydrogen 2.984 N/A SER 462.A OG LYS 459.A O no hydrogen 3.421 N/A GLN 463.A N VAL 460.A O no hydrogen 3.381 N/A LYS 464.A N VAL 460.A O no hydrogen 3.367 N/A THR 465.A N SER 461.A O no hydrogen 2.692 N/A THR 465.A OG1 THR 466.A O no hydrogen 2.809 N/A THR 465.A OG1 THR 470.A OG1 no hydrogen 3.085 N/A LYS 467.A NZ PHE 510.A O no hydrogen 3.413 N/A THR 470.A N THR 466.A O no hydrogen 3.037 N/A THR 470.A OG1 THR 465.A OG1 no hydrogen 3.085 N/A THR 470.A OG1 THR 466.A O no hydrogen 2.528 N/A LYS 471.A N LYS 467.A O no hydrogen 3.195 N/A GLU 472.A N PRO 468.A O no hydrogen 3.301 N/A MET 473.A N GLN 469.A O no hydrogen 3.140 N/A MET 474.A N THR 470.A O no hydrogen 2.991 N/A HIS 475.A N LYS 471.A O no hydrogen 3.056 N/A HIS 475.A NE2 CYS 508.A O no hydrogen 2.738 N/A MET 476.A N GLU 472.A O no hydrogen 2.903 N/A CYS 477.A N MET 473.A O no hydrogen 3.105 N/A MET 478.A N MET 474.A O no hydrogen 3.003 N/A ARG 479.A N HIS 475.A O no hydrogen 3.150 N/A ARG 479.A NH2 GLU 506.A OE2 no hydrogen 2.816 N/A GLN 480.A NE2 CYS 477.A O no hydrogen 3.017 N/A MET 484.A N GLN 480.A O no hydrogen 2.868 N/A GLU 485.A N GLU 481.A O no hydrogen 3.149 N/A ALA 486.A N THR 482.A O no hydrogen 3.346 N/A LEU 487.A N TYR 483.A O no hydrogen 3.182 N/A SER 488.A OG MET 484.A O no hydrogen 3.063 N/A HIS 489.A N GLU 501.A O no hydrogen 3.219 N/A HIS 489.A NE2 GLU 502.A OE2 no hydrogen 3.153 N/A LEU 490.A N LEU 500.A O no hydrogen 2.731 N/A SER 492.A N THR 498.A O no hydrogen 2.998 N/A ASP 495.A N SER 492.A O no hydrogen 3.305 N/A THR 498.A N ASP 495.A O no hydrogen 3.199 N/A THR 498.A OG1 ASP 495.A OD2 no hydrogen 2.709 N/A LEU 500.A N LEU 490.A O no hydrogen 2.715 N/A GLU 502.A N SER 523.A O no hydrogen 3.248 N/A CYS 504.A N MET 521.A O no hydrogen 3.159 N/A CYS 504.A SG SER 523.A OG no hydrogen 3.257 N/A GLN 507.A N CYS 504.A O no hydrogen 3.194 N/A CYS 508.A N CYS 504.A O no hydrogen 3.185 N/A CYS 508.A N VAL 505.A O no hydrogen 3.223 N/A CYS 508.A SG CYS 504.A O no hydrogen 3.248 N/A THR 509.A N TRP 519.A O no hydrogen 3.114 N/A PHE 510.A N THR 509.A OG1 no hydrogen 2.752 N/A MET 511.A N PRO 517.A O no hydrogen 3.130 N/A SER 513.A N MET 511.A O no hydrogen 2.980 N/A LYS 516.A N SER 513.A O no hydrogen 2.866 N/A LYS 516.A NZ SER 513.A O no hydrogen 2.767 N/A LEU 518.A N PHE 537.A O no hydrogen 2.825 N/A TRP 519.A N THR 509.A O no hydrogen 2.780 N/A ILE 520.A N ILE 535.A O no hydrogen 2.884 N/A TYR 522.A N VAL 533.A O no hydrogen 2.741 N/A TYR 522.A OH LEU 487.A O no hydrogen 2.733 N/A SER 523.A N GLU 502.A O no hydrogen 2.915 N/A GLY 528.A N SER 524.A O no hydrogen 2.842 N/A ASN 532.A N SER 529.A O no hydrogen 3.313 N/A ILE 535.A N ILE 520.A O no hydrogen 2.759 N/A ILE 536.A N ILE 584.A O no hydrogen 2.702 N/A PHE 537.A N LEU 518.A O no hydrogen 2.852 N/A LYS 538.A N GLY 582.A O no hydrogen 3.245 N/A GLY 540.A N ARG 580.A O no hydrogen 2.944 N/A ARG 544.A NE ASP 542.A OD1 no hydrogen 3.376 N/A ARG 544.A NH1 GLU 413.A OE2 no hydrogen 2.793 N/A ARG 544.A NH1 ALA 723.A O no hydrogen 2.790 N/A ARG 544.A NH2 ALA 723.A O no hydrogen 3.462 N/A MET 547.A N LEU 543.A O no hydrogen 3.108 N/A LEU 548.A N ARG 544.A O no hydrogen 3.256 N/A THR 549.A N GLN 545.A O no hydrogen 3.244 N/A THR 549.A OG1 GLN 545.A O no hydrogen 2.713 N/A LEU 550.A N ASP 546.A O no hydrogen 3.164 N/A GLN 551.A N MET 547.A O no hydrogen 2.779 N/A MET 552.A N LEU 548.A O no hydrogen 2.970 N/A ILE 553.A N THR 549.A O no hydrogen 3.107 N/A GLN 554.A N LEU 550.A O no hydrogen 3.057 N/A LEU 555.A N GLN 551.A O no hydrogen 2.884 N/A MET 556.A N MET 552.A O no hydrogen 2.854 N/A ASP 557.A N ILE 553.A O no hydrogen 3.026 N/A VAL 558.A N GLN 554.A O no hydrogen 3.074 N/A LEU 559.A N LEU 555.A O no hydrogen 2.947 N/A TRP 560.A N MET 556.A O no hydrogen 2.993 N/A TRP 560.A NE1 ALA 702.A O no hydrogen 3.078 N/A LYS 561.A N ASP 557.A O no hydrogen 2.991 N/A GLN 562.A N VAL 558.A O no hydrogen 3.075 N/A GLU 563.A N TRP 560.A O no hydrogen 3.310 N/A GLY 564.A N LYS 561.A O no hydrogen 3.283 N/A LEU 565.A N TRP 560.A O no hydrogen 2.959 N/A THR 570.A N TYR 634.A OH no hydrogen 3.239 N/A TYR 572.A N THR 570.A O no hydrogen 3.181 N/A LEU 575.A N LEU 583.A O no hydrogen 2.949 N/A THR 577.A N THR 581.A O no hydrogen 2.754 N/A GLY 578.A N THR 581.A O no hydrogen 3.231 N/A ARG 580.A NE ASP 579.A OD1 no hydrogen 3.428 N/A THR 581.A OG1 ASN 539.A OD1 no hydrogen 3.063 N/A THR 581.A OG1 ASP 579.A O no hydrogen 2.903 N/A GLY 582.A N LYS 538.A O no hydrogen 3.208 N/A LEU 583.A N LEU 575.A O no hydrogen 2.859 N/A ILE 584.A N ILE 536.A O no hydrogen 2.880 N/A GLU 585.A N GLY 573.A O no hydrogen 2.746 N/A VAL 586.A N GLY 534.A O no hydrogen 2.992 N/A SER 590.A OG VAL 587.A O no hydrogen 2.592 N/A ASP 591.A N ILE 653.A O no hydrogen 3.199 N/A THR 592.A N ASP 591.A OD1 no hydrogen 3.142 N/A THR 592.A OG1 ASN 595.A OD1 no hydrogen 2.693 N/A ILE 593.A N ILE 651.A O no hydrogen 3.150 N/A ALA 594.A N SER 648.A O no hydrogen 3.305 N/A ASN 595.A N THR 592.A OG1 no hydrogen 3.274 N/A ILE 596.A N THR 592.A O no hydrogen 3.364 N/A GLN 597.A N ILE 593.A O no hydrogen 2.942 N/A LEU 598.A N ALA 594.A O no hydrogen 3.240 N/A ASP 605.A N PHE 602.A O no hydrogen 3.205 N/A ALA 606.A N PHE 602.A O no hydrogen 3.270 N/A ASN 609.A N ASP 605.A O no hydrogen 2.794 N/A ASN 609.A ND2 ASP 605.A O no hydrogen 2.799 N/A LEU 611.A N LEU 607.A O no hydrogen 3.290 N/A LYS 612.A N LEU 608.A O no hydrogen 3.047 N/A SER 613.A N ASN 609.A O no hydrogen 3.142 N/A SER 613.A OG ASN 609.A O no hydrogen 2.889 N/A LYS 614.A N TRP 610.A O no hydrogen 3.200 N/A ASN 615.A N LEU 611.A O no hydrogen 2.875 N/A ASN 615.A ND2 LEU 611.A O no hydrogen 3.610 N/A ASN 615.A ND2 GLU 655.A O no hydrogen 2.793 N/A ALA 619.A N PRO 616.A O no hydrogen 3.455 N/A ALA 623.A N ALA 619.A O no hydrogen 3.417 N/A ILE 624.A N LEU 620.A O no hydrogen 3.123 N/A GLU 626.A N ARG 622.A O no hydrogen 2.821 N/A PHE 627.A N ALA 623.A O no hydrogen 3.002 N/A THR 628.A N ILE 624.A O no hydrogen 2.881 N/A THR 628.A OG1 ILE 624.A O no hydrogen 2.695 N/A LEU 629.A N GLU 625.A O no hydrogen 3.087 N/A SER 630.A N GLU 626.A O no hydrogen 3.240 N/A SER 630.A OG GLU 626.A O no hydrogen 2.839 N/A SER 630.A OG PHE 627.A O no hydrogen 2.892 N/A CYS 631.A N PHE 627.A O no hydrogen 2.808 N/A ALA 632.A N THR 628.A O no hydrogen 3.137 N/A GLY 633.A N LEU 629.A O no hydrogen 3.049 N/A TYR 634.A N SER 630.A O no hydrogen 3.017 N/A CYS 635.A N CYS 631.A O no hydrogen 2.935 N/A CYS 635.A SG CYS 631.A O no hydrogen 3.351 N/A CYS 635.A SG ILE 672.A O no hydrogen 3.799 N/A ALA 637.A N GLY 633.A O no hydrogen 3.215 N/A THR 638.A N TYR 634.A O no hydrogen 2.848 N/A THR 638.A OG1 TYR 634.A O no hydrogen 2.700 N/A THR 638.A OG1 CYS 635.A O no hydrogen 3.298 N/A TYR 639.A N VAL 636.A O no hydrogen 3.188 N/A VAL 640.A N VAL 636.A O no hydrogen 2.840 N/A LEU 641.A N ALA 637.A O no hydrogen 3.184 N/A ILE 643.A N THR 638.A O no hydrogen 2.947 N/A ARG 646.A NE GLY 644.A O no hydrogen 3.206 N/A ARG 646.A NE ASP 645.A O no hydrogen 3.121 N/A ARG 646.A NH1 HIS 661.A ND1 no hydrogen 3.139 N/A ARG 646.A NH1 ILE 662.A O no hydrogen 3.123 N/A ARG 646.A NH2 ASP 645.A O no hydrogen 3.396 N/A ARG 646.A NH2 ILE 662.A O no hydrogen 3.294 N/A ARG 646.A NH2 ASP 663.A O no hydrogen 2.890 N/A HIS 647.A N ASN 650.A OD1 no hydrogen 3.006 N/A HIS 647.A ND1 ASP 649.A OD1 no hydrogen 2.772 N/A HIS 647.A NE2 ASP 645.A OD1 no hydrogen 3.058 N/A ASN 650.A N HIS 647.A O no hydrogen 3.247 N/A ASN 650.A ND2 ASP 645.A O no hydrogen 2.775 N/A MET 652.A N PHE 660.A O no hydrogen 2.747 N/A ILE 653.A N ASP 591.A O no hydrogen 2.991 N/A ARG 654.A N GLN 658.A O no hydrogen 2.746 N/A ARG 654.A NH2 THR 570.A OG1 no hydrogen 2.911 N/A GLU 655.A N HIS 589.A O no hydrogen 2.847 N/A SER 656.A OG GLN 658.A OE1 no hydrogen 2.719 N/A GLY 657.A N ARG 654.A O no hydrogen 3.063 N/A GLN 658.A NE2 ARG 568.A O no hydrogen 3.431 N/A LEU 659.A N SER 630.A OG no hydrogen 2.826 N/A PHE 660.A N MET 652.A O no hydrogen 2.802 N/A ILE 662.A N ASN 650.A O no hydrogen 3.035 N/A PHE 667.A N GLU 727.A OE1 no hydrogen 3.048 N/A LEU 668.A N LEU 641.A O no hydrogen 2.881 N/A GLY 669.A N GLY 642.A O no hydrogen 3.209 N/A PHE 677.A N THR 674.A O no hydrogen 3.146 N/A VAL 678.A N THR 674.A O no hydrogen 3.502 N/A HIS 679.A N TYR 675.A O no hydrogen 2.907 N/A VAL 680.A N PHE 677.A O no hydrogen 3.214 N/A ILE 681.A N PHE 677.A O no hydrogen 3.237 N/A GLN 682.A N VAL 678.A O no hydrogen 2.977 N/A GLN 683.A N VAL 680.A O no hydrogen 3.113 N/A GLY 684.A N HIS 679.A O no hydrogen 2.899 N/A LYS 685.A N GLN 682.A O no hydrogen 3.126 N/A ASN 688.A N GLN 682.A OE1 no hydrogen 2.803 N/A ASN 688.A ND2 GLN 682.A O no hydrogen 3.106 N/A PHE 692.A N ASN 688.A O no hydrogen 3.310 N/A GLU 693.A N SER 689.A O no hydrogen 2.815 N/A ARG 694.A NH1 GLU 625.A OE1 no hydrogen 3.320 N/A ARG 694.A NH1 GLU 625.A OE2 no hydrogen 3.210 N/A ARG 694.A NH2 GLU 625.A OE1 no hydrogen 2.771 N/A ARG 696.A N PHE 692.A O no hydrogen 2.940 N/A ARG 696.A NH1 ASN 759.A OD1 no hydrogen 3.296 N/A ARG 696.A NH2 ASN 759.A OD1 no hydrogen 2.971 N/A GLY 697.A N GLU 693.A O no hydrogen 3.172 N/A TYR 698.A N ARG 694.A O no hydrogen 3.101 N/A CYS 699.A N PHE 695.A O no hydrogen 3.209 N/A CYS 699.A SG PHE 695.A O no hydrogen 3.367 N/A GLU 700.A N ARG 696.A O no hydrogen 3.213 N/A ARG 701.A N GLY 697.A O no hydrogen 2.998 N/A ALA 702.A N TYR 698.A O no hydrogen 3.171 N/A TYR 703.A N CYS 699.A O no hydrogen 3.204 N/A TYR 703.A OH SER 740.A O no hydrogen 2.678 N/A THR 704.A N GLU 700.A O no hydrogen 3.212 N/A THR 704.A OG1 GLU 700.A O no hydrogen 3.141 N/A THR 704.A OG1 ARG 701.A O no hydrogen 2.760 N/A ILE 705.A N ARG 701.A O no hydrogen 3.069 N/A LEU 706.A N ALA 702.A O no hydrogen 3.399 N/A ARG 707.A N TYR 703.A O no hydrogen 3.218 N/A ARG 707.A NE LEU 741.A O no hydrogen 3.001 N/A ARG 707.A NE ALA 742.A O no hydrogen 3.324 N/A ARG 707.A NH2 ALA 742.A O no hydrogen 2.823 N/A ARG 708.A N THR 704.A O no hydrogen 3.252 N/A ARG 708.A NH2 GLU 747.A OE2 no hydrogen 3.511 N/A HIS 709.A N ILE 705.A O no hydrogen 3.386 N/A HIS 709.A ND1 ILE 705.A O no hydrogen 3.217 N/A GLY 710.A N ARG 707.A O no hydrogen 3.201 N/A LEU 714.A N GLY 710.A O no hydrogen 3.294 N/A HIS 715.A N LEU 711.A O no hydrogen 2.819 N/A LEU 716.A N LEU 712.A O no hydrogen 3.183 N/A PHE 717.A N PHE 713.A O no hydrogen 3.263 N/A ALA 718.A N LEU 714.A O no hydrogen 3.361 N/A LEU 719.A N HIS 715.A O no hydrogen 3.338 N/A MET 720.A N LEU 716.A O no hydrogen 3.307 N/A ARG 721.A NH2 SER 729.A O no hydrogen 3.294 N/A ALA 723.A N MET 720.A O no hydrogen 3.408 N/A SER 729.A N ASP 733.A OD2 no hydrogen 2.654 N/A CYS 730.A N ASP 733.A OD2 no hydrogen 2.716 N/A CYS 730.A SG ASP 733.A OD2 no hydrogen 3.108 N/A ASP 733.A N CYS 730.A O no hydrogen 3.045 N/A GLN 735.A N SER 731.A O no hydrogen 3.329 N/A GLN 735.A NE2 ASP 739.A OD1 no hydrogen 3.470 N/A LEU 737.A N ILE 734.A O no hydrogen 3.247 N/A ASP 739.A N GLN 735.A O no hydrogen 2.970 N/A ASP 739.A N TYR 736.A O no hydrogen 3.273 N/A SER 740.A N TYR 736.A O no hydrogen 2.826 N/A SER 740.A OG VAL 640.A O no hydrogen 3.227 N/A SER 740.A OG TYR 736.A O no hydrogen 2.982 N/A SER 740.A OG LEU 737.A O no hydrogen 3.382 N/A LEU 741.A N LEU 737.A O no hydrogen 3.100 N/A ALA 750.A N THR 746.A O no hydrogen 3.095 N/A LEU 751.A N GLU 747.A O no hydrogen 3.378 N/A LYS 752.A N GLU 748.A O no hydrogen 3.035 N/A HIS 753.A N GLU 749.A O no hydrogen 3.307 N/A PHE 754.A N ALA 750.A O no hydrogen 2.939 N/A ARG 755.A N LEU 751.A O no hydrogen 3.099 N/A ARG 755.A NE GLU 700.A OE1 no hydrogen 3.394 N/A ARG 755.A NH2 GLU 700.A OE1 no hydrogen 3.188 N/A LYS 757.A N HIS 753.A O no hydrogen 3.439 N/A PHE 758.A N PHE 754.A O no hydrogen 2.915 N/A ASN 759.A N ARG 755.A O no hydrogen 3.164 N/A GLU 760.A N VAL 756.A O no hydrogen 3.021 N/A ALA 761.A N LYS 757.A O no hydrogen 3.391 N/A LEU 762.A N PHE 758.A O no hydrogen 3.326 N/A ARG 763.A N ASN 759.A O no hydrogen 2.913 N/A ARG 763.A NE ASN 759.A O no hydrogen 2.995 N/A ARG 763.A NH2 VAL 756.A O no hydrogen 3.434 N/A GLU 764.A N GLU 760.A O no hydrogen 3.346 N/A SER 765.A OG LEU 673.A O no hydrogen 3.084 N/A