Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7lmy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N LEU 1.A O no hydrogen 3.262 N/A LEU 6.A N THR 3.A O no hydrogen 3.168 N/A LYS 7.A N ALA 4.A O no hydrogen 3.268 N/A LYS 9.A NZ LYS 7.A O no hydrogen 2.860 N/A ARG 11.A NH2 ASN 13.A OD1 no hydrogen 2.845 N/A ASN 13.A ND2 ILE 91.A O no hydrogen 2.502 N/A ARG 14.A N ARG 11.A O no hydrogen 3.088 N/A LEU 15.A N ILE 89.A O no hydrogen 2.884 N/A ILE 16.A N GLU 69.A O no hydrogen 2.868 N/A VAL 17.A N ASP 87.A O no hydrogen 2.702 N/A ASP 18.A N ILE 71.A O no hydrogen 2.789 N/A GLU 19.A N ASP 18.A OD1 no hydrogen 2.673 N/A ASN 25.A ND2 TYR 127.A OH no hydrogen 3.553 N/A SER 26.A N ASP 24.A OD1 no hydrogen 3.288 N/A VAL 28.A N ILE 59.A O no hydrogen 2.877 N/A SER 29.A N ARG 72.A O no hydrogen 3.498 N/A SER 29.A OG GLU 23.A OE2 no hydrogen 2.608 N/A LEU 30.A N LEU 61.A O no hydrogen 2.906 N/A SER 31.A OG ASP 68.A OD1 no hydrogen 2.782 N/A LYS 34.A N SER 31.A OG no hydrogen 3.297 N/A LYS 34.A NZ PRO 12.A O no hydrogen 3.461 N/A LYS 34.A NZ GLU 37.A OE1 no hydrogen 2.754 N/A MET 35.A N SER 31.A O no hydrogen 3.138 N/A ASP 36.A N GLN 32.A O no hydrogen 2.944 N/A GLU 37.A N PRO 33.A O no hydrogen 2.877 N/A LEU 38.A N LYS 34.A O no hydrogen 2.892 N/A LEU 40.A N MET 35.A O no hydrogen 2.927 N/A PHE 41.A N ASP 44.A OD2 no hydrogen 3.166 N/A GLY 43.A N VAL 60.A O no hydrogen 2.927 N/A ASP 44.A N PHE 41.A O no hydrogen 3.205 N/A VAL 46.A N CYS 58.A O no hydrogen 2.882 N/A LEU 47.A N GLN 92.A O no hydrogen 2.879 N/A LEU 48.A N ALA 56.A O no hydrogen 2.850 N/A LYS 49.A N SER 90.A O no hydrogen 2.870 N/A LYS 49.A NZ GLN 92.A OE1 no hydrogen 3.213 N/A GLY 50.A N ARG 54.A O no hydrogen 2.912 N/A ARG 54.A NH2 SER 186.A OG no hydrogen 2.797 N/A ALA 56.A N LEU 48.A O no hydrogen 2.909 N/A CYS 58.A N VAL 46.A O no hydrogen 2.938 N/A ILE 59.A N SER 26.A O no hydrogen 2.851 N/A VAL 60.A N ASP 44.A O no hydrogen 3.026 N/A LEU 61.A N VAL 28.A O no hydrogen 2.894 N/A ASP 63.A N LEU 30.A O no hydrogen 3.004 N/A THR 65.A N ASP 63.A OD1 no hydrogen 3.308 N/A THR 65.A OG1 ASP 63.A OD1 no hydrogen 2.907 N/A THR 65.A OG1 ASP 63.A OD2 no hydrogen 3.096 N/A CYS 66.A N ASP 63.A O no hydrogen 3.160 N/A CYS 66.A SG SER 29.A O no hydrogen 3.639 N/A CYS 66.A SG SER 67.A O no hydrogen 3.571 N/A CYS 66.A SG LYS 70.A O no hydrogen 3.264 N/A GLU 69.A N GLU 69.A OE1 no hydrogen 2.725 N/A LYS 70.A N SER 67.A O no hydrogen 3.385 N/A ILE 71.A N ILE 16.A O no hydrogen 2.851 N/A ARG 72.A N SER 29.A O no hydrogen 2.940 N/A ARG 72.A NE ASP 63.A OD2 no hydrogen 2.784 N/A ARG 72.A NH1 GLU 19.A O no hydrogen 3.086 N/A VAL 77.A N ASN 74.A OD1 no hydrogen 3.392 N/A ARG 78.A N ASN 74.A O no hydrogen 3.189 N/A ASN 79.A N ARG 75.A O no hydrogen 2.912 N/A ASN 80.A N VAL 76.A O no hydrogen 2.926 N/A ASN 80.A ND2 ILE 140.A O no hydrogen 2.933 N/A LEU 81.A N VAL 77.A O no hydrogen 2.981 N/A ARG 82.A N ASN 79.A O no hydrogen 3.240 N/A VAL 83.A N ARG 78.A O no hydrogen 3.059 N/A ARG 84.A N ASP 87.A OD2 no hydrogen 2.564 N/A GLY 86.A N VAL 17.A O no hydrogen 3.047 N/A ASP 87.A N ARG 84.A O no hydrogen 3.126 N/A ILE 89.A N LEU 15.A O no hydrogen 2.914 N/A SER 90.A N LYS 49.A O no hydrogen 2.937 N/A ILE 91.A N ASN 13.A O no hydrogen 3.205 N/A GLN 92.A N LEU 47.A O no hydrogen 2.928 N/A CYS 94.A N THR 45.A O no hydrogen 3.381 N/A GLY 100.A N ILE 164.A O no hydrogen 2.514 N/A LYS 101.A N ASP 158.A O no hydrogen 2.373 N/A ARG 102.A N ASP 158.A O no hydrogen 2.929 N/A ILE 103.A N VAL 170.A O no hydrogen 2.892 N/A HIS 104.A N GLU 156.A O no hydrogen 2.883 N/A VAL 105.A N HIS 172.A O no hydrogen 2.925 N/A LEU 106.A N LYS 153.A O no hydrogen 2.865 N/A ILE 108.A N GLU 151.A O no hydrogen 2.839 N/A THR 111.A OG1 ILE 108.A O no hydrogen 2.531 N/A THR 111.A OG1 GLU 151.A O no hydrogen 3.507 N/A VAL 112.A N ILE 108.A O no hydrogen 3.038 N/A VAL 112.A N ASP 109.A O no hydrogen 3.044 N/A ILE 115.A N VAL 112.A O no hydrogen 2.835 N/A PHE 120.A N ASN 118.A OD1 no hydrogen 3.071 N/A VAL 122.A N ASN 118.A O no hydrogen 3.237 N/A TYR 123.A N LEU 119.A O no hydrogen 2.925 N/A TYR 123.A OH ARG 148.A O no hydrogen 2.758 N/A LEU 124.A N LEU 119.A O no hydrogen 3.481 N/A LYS 125.A N PHE 120.A O no hydrogen 2.946 N/A TYR 127.A N TYR 123.A O no hydrogen 3.301 N/A PHE 128.A N LEU 124.A O no hydrogen 2.894 N/A PHE 128.A N LYS 125.A O no hydrogen 3.342 N/A ARG 133.A NE TYR 127.A O no hydrogen 2.664 N/A ARG 133.A NH1 ASP 24.A OD2 no hydrogen 2.772 N/A ARG 133.A NH1 SER 26.A OG no hydrogen 3.412 N/A ARG 133.A NH2 TYR 127.A O no hydrogen 3.401 N/A ILE 135.A N CYS 163.A O no hydrogen 3.156 N/A ARG 136.A N ASP 139.A OD2 no hydrogen 2.709 N/A ARG 136.A NE TYR 162.A OH no hydrogen 3.368 N/A ARG 136.A NH1 LYS 137.A O no hydrogen 3.141 N/A ARG 136.A NH2 GLU 55.A OE1 no hydrogen 3.199 N/A GLY 138.A N VAL 154.A O no hydrogen 2.557 N/A ASP 139.A N ARG 136.A O no hydrogen 3.132 N/A ILE 140.A N ASN 80.A OD1 no hydrogen 2.665 N/A PHE 141.A N PHE 152.A O no hydrogen 2.950 N/A VAL 143.A N VAL 150.A O no hydrogen 2.891 N/A ARG 148.A NH1 ASP 110.A O no hydrogen 2.996 N/A VAL 150.A N VAL 143.A O no hydrogen 2.927 N/A GLU 151.A N THR 111.A OG1 no hydrogen 3.379 N/A PHE 152.A N PHE 141.A O no hydrogen 2.864 N/A LYS 153.A N LEU 106.A O no hydrogen 2.630 N/A VAL 154.A N ASP 139.A O no hydrogen 2.925 N/A VAL 155.A N HIS 104.A O no hydrogen 2.867 N/A GLU 156.A N HIS 104.A O no hydrogen 2.954 N/A THR 157.A OG1 SER 160.A OG no hydrogen 3.326 N/A THR 157.A OG1 PRO 161.A O no hydrogen 3.083 N/A ASP 158.A N ARG 102.A O no hydrogen 2.899 N/A SER 160.A OG THR 157.A O no hydrogen 2.352 N/A SER 160.A OG THR 157.A OG1 no hydrogen 3.326 N/A TYR 162.A OH GLU 55.A OE1 no hydrogen 2.326 N/A CYS 163.A N ILE 135.A O no hydrogen 3.435 N/A ILE 164.A N LYS 98.A O no hydrogen 2.972 N/A VAL 165.A N ARG 133.A O no hydrogen 2.997 N/A ALA 166.A N THR 169.A OG1 no hydrogen 2.862 N/A THR 169.A N ALA 166.A O no hydrogen 2.995 N/A THR 169.A OG1 GLY 100.A O no hydrogen 2.448 N/A THR 169.A OG1 ILE 164.A O no hydrogen 3.559 N/A THR 169.A OG1 ALA 166.A O no hydrogen 3.326 N/A VAL 170.A N LYS 101.A O no hydrogen 3.486 N/A HIS 172.A N ILE 103.A O no hydrogen 2.980 N/A CYS 173.A N GLU 174.A OE1 no hydrogen 3.093 N/A ILE 178.A N PRO 107.A O no hydrogen 3.183 N/A GLU 184.A N ARG 180.A O no hydrogen 2.873 N/A GLU 185.A N GLU 181.A O no hydrogen 2.896 N/A SER 186.A N ASP 182.A O no hydrogen 2.918 N/A LEU 187.A N GLU 183.A O no hydrogen 2.875 N/A ASN 188.A N GLU 184.A O no hydrogen 2.896 N/A GLU 189.A N SER 186.A O no hydrogen 3.485 N/A GLY 191.A N ASP 194.A OD2 no hydrogen 2.913 N/A TYR 192.A N GLU 250.A OE2 no hydrogen 2.894 N/A ASP 194.A N GLY 191.A O no hydrogen 3.163 N/A ILE 195.A N TYR 192.A O no hydrogen 3.217 N/A GLY 197.A N GLU 368.A OE1 no hydrogen 3.098 N/A CYS 198.A SG GLY 196.A O no hydrogen 3.880 N/A LEU 202.A N CYS 198.A O no hydrogen 2.839 N/A ALA 203.A N ARG 199.A O no hydrogen 2.973 N/A GLN 204.A N LYS 200.A O no hydrogen 2.903 N/A ILE 205.A N GLN 201.A O no hydrogen 2.884 N/A LYS 206.A N LEU 202.A O no hydrogen 2.936 N/A GLU 207.A N ALA 203.A O no hydrogen 2.923 N/A MET 208.A N GLN 204.A O no hydrogen 2.904 N/A VAL 209.A N ILE 205.A O no hydrogen 2.761 N/A LEU 211.A N LYS 206.A O no hydrogen 2.716 N/A ARG 214.A N GLU 210.A O no hydrogen 2.823 N/A HIS 215.A N LEU 211.A O no hydrogen 2.961 N/A LEU 218.A N HIS 215.A O no hydrogen 3.121 N/A LYS 220.A N PRO 216.A O no hydrogen 2.958 N/A GLU 221.A N ALA 217.A O no hydrogen 2.882 N/A GLY 223.A N LYS 220.A O no hydrogen 3.151 N/A VAL 224.A N PHE 219.A O no hydrogen 3.120 N/A ARG 228.A NE GLY 350.A O no hydrogen 2.955 N/A ARG 228.A NH1 LEU 324.A O no hydrogen 2.239 N/A ARG 228.A NH2 GLY 350.A O no hydrogen 2.505 N/A ILE 230.A N VAL 332.A O no hydrogen 3.153 N/A LEU 231.A N ARG 354.A O no hydrogen 2.861 N/A LEU 232.A N ALA 334.A O no hydrogen 2.544 N/A TYR 233.A N VAL 356.A O no hydrogen 2.926 N/A THR 238.A OG1 PRO 235.A O no hydrogen 2.708 N/A THR 238.A OG1 ILE 358.A O no hydrogen 3.356 N/A LYS 240.A NZ GLY 234.A O no hydrogen 3.353 N/A THR 241.A OG1 ASP 293.A OD1 no hydrogen 3.472 N/A THR 241.A OG1 ASP 293.A OD2 no hydrogen 2.747 N/A ILE 243.A N GLY 239.A O no hydrogen 2.755 N/A ALA 244.A N LYS 240.A O no hydrogen 2.911 N/A ARG 245.A N THR 241.A O no hydrogen 2.894 N/A ALA 246.A N LEU 242.A O no hydrogen 2.909 N/A VAL 247.A N ILE 243.A O no hydrogen 2.866 N/A ALA 248.A N ALA 244.A O no hydrogen 2.912 N/A ASN 249.A N ARG 245.A O no hydrogen 2.932 N/A ASN 249.A ND2 VAL 190.A O no hydrogen 2.880 N/A GLU 250.A N VAL 247.A O no hydrogen 3.222 N/A THR 251.A OG1 GLU 210.A OE1 no hydrogen 3.079 N/A THR 251.A OG1 GLU 210.A OE2 no hydrogen 3.551 N/A ALA 253.A N THR 251.A OG1 no hydrogen 3.264 N/A PHE 254.A N PRO 287.A O no hydrogen 3.031 N/A PHE 256.A N ILE 289.A O no hydrogen 2.902 N/A ILE 258.A N PHE 291.A O no hydrogen 2.601 N/A ASN 259.A N GLU 262.A OE1 no hydrogen 3.346 N/A ASN 259.A ND2 GLU 262.A OE1 no hydrogen 3.058 N/A ILE 263.A N ASN 259.A O no hydrogen 3.265 N/A MET 264.A N GLY 260.A O no hydrogen 2.919 N/A SER 265.A N PRO 261.A O no hydrogen 3.101 N/A SER 265.A OG PRO 261.A O no hydrogen 3.242 N/A SER 265.A OG GLU 262.A O no hydrogen 3.246 N/A LYS 266.A N ILE 263.A O no hydrogen 3.313 N/A LYS 266.A NZ GLU 262.A O no hydrogen 3.429 N/A GLY 269.A N GLU 272.A OE1 no hydrogen 3.198 N/A GLU 270.A N LEU 267.A O no hydrogen 2.951 N/A SER 271.A N LEU 267.A O no hydrogen 3.435 N/A SER 271.A OG ILE 263.A O no hydrogen 2.316 N/A GLU 272.A N GLU 272.A OE1 no hydrogen 2.955 N/A SER 273.A OG GLY 269.A O no hydrogen 3.554 N/A SER 273.A OG GLU 270.A O no hydrogen 2.771 N/A ASN 274.A N GLU 270.A O no hydrogen 2.891 N/A ASN 274.A ND2 GLU 270.A O no hydrogen 2.372 N/A LEU 275.A N SER 271.A O no hydrogen 2.942 N/A ARG 276.A N GLU 272.A O no hydrogen 2.928 N/A LYS 277.A N SER 273.A O no hydrogen 2.862 N/A ALA 278.A N ASN 274.A O no hydrogen 2.881 N/A PHE 279.A N LEU 275.A O no hydrogen 3.013 N/A GLU 280.A N ARG 276.A O no hydrogen 2.909 N/A GLU 281.A N LYS 277.A O no hydrogen 2.833 N/A ALA 282.A N ALA 278.A O no hydrogen 2.940 N/A GLU 283.A N PHE 279.A O no hydrogen 2.944 N/A LYS 284.A N GLU 280.A O no hydrogen 2.906 N/A ASN 285.A N GLU 281.A O no hydrogen 3.122 N/A ASN 285.A ND2 GLU 281.A O no hydrogen 2.696 N/A ASN 285.A ND2 GLU 281.A OE2 no hydrogen 3.549 N/A ALA 288.A N HIS 329.A O no hydrogen 3.071 N/A ILE 289.A N PHE 254.A O no hydrogen 2.662 N/A ILE 290.A N ILE 331.A O no hydrogen 2.908 N/A PHE 291.A N PHE 256.A O no hydrogen 2.913 N/A ILE 292.A N MET 333.A O no hydrogen 2.711 N/A ASP 293.A N ILE 258.A O no hydrogen 2.575 N/A LEU 295.A N ALA 335.A O no hydrogen 3.032 N/A ALA 297.A N GLU 294.A O no hydrogen 3.156 N/A ILE 298.A N LEU 295.A O no hydrogen 3.135 N/A ALA 299.A N LEU 295.A O no hydrogen 2.935 N/A ARG 302.A N ASP 343.A OD1 no hydrogen 3.449 N/A ARG 302.A NE ASP 343.A OD2 no hydrogen 2.796 N/A THR 305.A N ARG 302.A O no hydrogen 3.140 N/A THR 305.A OG1 LYS 301.A O no hydrogen 2.441 N/A ARG 311.A N GLY 307.A O no hydrogen 3.351 N/A ARG 311.A NE ARG 302.A O no hydrogen 3.069 N/A ARG 312.A N GLU 308.A O no hydrogen 2.967 N/A ARG 312.A NH1 GLU 308.A OE1 no hydrogen 3.051 N/A ILE 313.A N VAL 309.A O no hydrogen 2.875 N/A VAL 314.A N GLU 310.A O no hydrogen 2.976 N/A SER 315.A N ARG 311.A O no hydrogen 2.920 N/A SER 315.A OG ARG 311.A O no hydrogen 3.099 N/A GLN 316.A N ARG 312.A O no hydrogen 2.883 N/A LEU 317.A N ILE 313.A O no hydrogen 2.921 N/A LEU 318.A N VAL 314.A O no hydrogen 2.961 N/A THR 319.A N SER 315.A O no hydrogen 2.913 N/A THR 319.A OG1 SER 315.A O no hydrogen 3.137 N/A LEU 320.A N GLN 316.A O no hydrogen 2.901 N/A MET 321.A N LEU 317.A O no hydrogen 2.915 N/A ASP 322.A N LEU 318.A O no hydrogen 2.941 N/A GLY 323.A N LEU 320.A O no hydrogen 3.155 N/A GLN 326.A NE2 PRO 226.A O no hydrogen 2.366 N/A ILE 331.A N ALA 288.A O no hydrogen 3.111 N/A VAL 332.A N ARG 228.A O no hydrogen 3.136 N/A MET 333.A N ILE 290.A O no hydrogen 2.463 N/A ALA 334.A N ILE 230.A O no hydrogen 2.915 N/A ALA 335.A N ILE 292.A O no hydrogen 3.194 N/A THR 336.A N LEU 232.A O no hydrogen 2.880 N/A THR 336.A OG1 ASP 296.A OD1 no hydrogen 2.520 N/A ARG 338.A N THR 336.A OG1 no hydrogen 3.158 N/A ARG 338.A NH2 ASP 296.A OD2 no hydrogen 2.543 N/A SER 341.A N ARG 338.A O no hydrogen 2.978 N/A ILE 342.A N PRO 339.A O no hydrogen 3.310 N/A ASP 343.A N ALA 299.A O no hydrogen 3.383 N/A LEU 346.A N ASP 343.A O no hydrogen 3.080 N/A ARG 347.A N PRO 344.A O no hydrogen 2.922 N/A ARG 347.A NE GLU 355.A OE2 no hydrogen 2.805 N/A ARG 347.A NH2 GLU 355.A OE1 no hydrogen 3.156 N/A ARG 347.A NH2 GLU 355.A OE2 no hydrogen 2.557 N/A ARG 348.A N ALA 345.A O no hydrogen 3.429 N/A ARG 351.A NH1 ALA 345.A O no hydrogen 2.986 N/A ARG 351.A NH2 ASP 322.A OD2 no hydrogen 2.445 N/A PHE 352.A N LEU 346.A O no hydrogen 2.924 N/A ASP 353.A N ARG 351.A O no hydrogen 2.469 N/A ARG 354.A N GLY 229.A O no hydrogen 2.957 N/A VAL 356.A N LEU 231.A O no hydrogen 2.893 N/A ILE 358.A N TYR 233.A O no hydrogen 2.693 N/A GLY 365.A N ASP 362.A OD1 no hydrogen 3.000 N/A ARG 366.A N ASP 362.A O no hydrogen 2.810 N/A LEU 367.A N ALA 363.A O no hydrogen 2.899 N/A GLU 368.A N THR 364.A O no hydrogen 2.938 N/A ILE 369.A N GLY 365.A O no hydrogen 2.919 N/A LEU 370.A N ARG 366.A O no hydrogen 2.877 N/A GLN 371.A N LEU 367.A O no hydrogen 2.924 N/A ILE 372.A N GLU 368.A O no hydrogen 2.926 N/A HIS 373.A N ILE 369.A O no hydrogen 2.899 N/A THR 374.A N LEU 370.A O no hydrogen 3.017 N/A THR 374.A OG1 LEU 370.A O no hydrogen 2.605 N/A LYS 375.A N ILE 372.A O no hydrogen 3.427 N/A LYS 375.A NZ ASP 194.A OD1 no hydrogen 2.672 N/A MET 377.A N THR 374.A O no hydrogen 3.211 N/A LYS 378.A NZ MET 431.A O no hydrogen 2.936 N/A LYS 378.A NZ LEU 434.A O no hydrogen 3.294 N/A ALA 380.A N VAL 436.A O no hydrogen 2.999 N/A VAL 383.A N ALA 380.A O no hydrogen 3.364 N/A GLU 386.A N ASP 384.A OD1 no hydrogen 3.282 N/A GLN 387.A N ASP 384.A O no hydrogen 2.951 N/A GLN 387.A NE2 GLU 391.A OE2 no hydrogen 2.888 N/A VAL 388.A N ASP 384.A O no hydrogen 3.232 N/A ALA 389.A N LEU 385.A O no hydrogen 2.970 N/A ASN 390.A N GLU 386.A O no hydrogen 2.957 N/A ASN 390.A ND2 GLU 386.A OE2 no hydrogen 2.866 N/A GLU 391.A N GLN 387.A O no hydrogen 3.226 N/A GLU 391.A N VAL 388.A O no hydrogen 3.081 N/A THR 392.A OG1 VAL 388.A O no hydrogen 2.950 N/A THR 392.A OG1 ALA 389.A O no hydrogen 3.138 N/A HIS 395.A N THR 392.A O no hydrogen 3.118 N/A HIS 395.A NE2 SER 448.A OG no hydrogen 3.103 N/A VAL 396.A N ASP 399.A OD2 no hydrogen 3.021 N/A ALA 398.A N GLY 237.A O no hydrogen 3.117 N/A LEU 400.A N VAL 396.A O no hydrogen 2.959 N/A ALA 401.A N GLY 397.A O no hydrogen 2.920 N/A ALA 402.A N ALA 398.A O no hydrogen 2.940 N/A LEU 403.A N ASP 399.A O no hydrogen 2.862 N/A CYS 404.A N LEU 400.A O no hydrogen 2.939 N/A CYS 404.A SG LEU 400.A O no hydrogen 3.213 N/A SER 405.A N ALA 401.A O no hydrogen 2.955 N/A SER 405.A OG ALA 401.A O no hydrogen 2.797 N/A GLU 406.A N ALA 402.A O no hydrogen 2.896 N/A ALA 407.A N LEU 403.A O no hydrogen 2.922 N/A ALA 408.A N CYS 404.A O no hydrogen 2.963 N/A LEU 409.A N SER 405.A O no hydrogen 2.908 N/A GLN 410.A N GLU 406.A O no hydrogen 2.914 N/A ALA 411.A N ALA 407.A O no hydrogen 2.951 N/A ILE 412.A N ALA 408.A O no hydrogen 2.946 N/A ARG 413.A N LEU 409.A O no hydrogen 2.869 N/A ARG 413.A NH1 GLU 406.A OE2 no hydrogen 3.395 N/A ARG 413.A NH1 GLN 410.A OE1 no hydrogen 3.461 N/A ARG 413.A NH2 GLU 406.A OE2 no hydrogen 3.292 N/A LYS 414.A N GLN 410.A O no hydrogen 2.954 N/A LYS 414.A NZ ASP 439.A OD2 no hydrogen 3.305 N/A LYS 414.A NZ ASP 440.A OD1 no hydrogen 2.543 N/A LYS 415.A N ILE 412.A O no hydrogen 2.968 N/A LYS 415.A NZ LYS 414.A O no hydrogen 3.513 N/A MET 416.A N ARG 413.A O no hydrogen 3.157 N/A LEU 418.A N LYS 415.A O no hydrogen 3.043 N/A ILE 419.A N MET 416.A O no hydrogen 3.086 N/A GLU 422.A N GLU 422.A OE1 no hydrogen 2.706 N/A ASP 423.A N ASP 420.A O no hydrogen 3.316 N/A MET 431.A N ASP 427.A O no hydrogen 3.173 N/A ASN 432.A N ALA 428.A O no hydrogen 2.926 N/A SER 433.A N GLU 429.A O no hydrogen 2.945 N/A LEU 434.A N VAL 430.A O no hydrogen 2.947 N/A LEU 434.A N MET 431.A O no hydrogen 3.341 N/A VAL 436.A N LYS 378.A O no hydrogen 2.926 N/A THR 437.A N ASP 440.A OD2 no hydrogen 3.162 N/A THR 437.A OG1 ASP 440.A OD2 no hydrogen 3.337 N/A MET 438.A N ASP 382.A OD1 no hydrogen 3.201 N/A MET 438.A N ASP 382.A OD2 no hydrogen 3.181 N/A PHE 441.A N THR 437.A O no hydrogen 3.354 N/A ARG 442.A N MET 438.A O no hydrogen 2.881 N/A TRP 443.A N ASP 439.A O no hydrogen 2.927 N/A ALA 444.A N ASP 440.A O no hydrogen 2.917 N/A LEU 445.A N PHE 441.A O no hydrogen 2.853 N/A SER 446.A N ARG 442.A O no hydrogen 2.922 N/A SER 446.A OG TRP 443.A O no hydrogen 2.488 N/A GLN 447.A N TRP 443.A O no hydrogen 2.956 N/A GLN 447.A NE2 SER 446.A OG no hydrogen 2.937 N/A SER 448.A N LEU 445.A O no hydrogen 3.317 N/A SER 448.A OG HIS 395.A NE2 no hydrogen 3.103 N/A SER 448.A OG LEU 445.A O no hydrogen 3.209 N/A SER 451.A N ASP 399.A OD2 no hydrogen 3.198 N/A SER 451.A OG ASP 399.A OD1 no hydrogen 3.271 N/A SER 451.A OG ASP 399.A OD2 no hydrogen 2.902 N/A ALA 452.A N GLY 394.A O no hydrogen 3.171 N/A THR 464.A OG1 ASP 467.A OD1 no hydrogen 3.440 N/A TRP 465.A NE1 GLU 523.A OE1 no hydrogen 2.115 N/A ASP 467.A N THR 464.A O no hydrogen 3.194 N/A ILE 468.A N TRP 465.A O no hydrogen 3.132 N/A LYS 475.A N LEU 471.A O no hydrogen 2.742 N/A LYS 475.A NZ TRP 465.A O no hydrogen 3.372 N/A LYS 475.A NZ ILE 468.A O no hydrogen 3.076 N/A LYS 475.A NZ GLY 470.A O no hydrogen 3.104 N/A ARG 476.A N GLU 472.A O no hydrogen 2.920 N/A ARG 476.A NH1 GLU 480.A OE2 no hydrogen 2.831 N/A GLU 477.A N ASP 473.A O no hydrogen 2.895 N/A LEU 478.A N VAL 474.A O no hydrogen 2.910 N/A GLN 479.A N LYS 475.A O no hydrogen 2.915 N/A GLU 480.A N ARG 476.A O no hydrogen 2.906 N/A LEU 481.A N GLU 477.A O no hydrogen 2.939 N/A VAL 482.A N LEU 478.A O no hydrogen 2.940 N/A GLN 483.A N GLN 479.A O no hydrogen 2.856 N/A TYR 484.A N GLU 480.A O no hydrogen 2.962 N/A GLU 487.A N GLN 483.A O no hydrogen 2.677 N/A HIS 488.A N TYR 484.A O no hydrogen 2.804 N/A LEU 493.A N PRO 489.A O no hydrogen 2.944 N/A LYS 494.A N ASP 490.A O no hydrogen 2.888 N/A PHE 495.A N LYS 491.A O no hydrogen 3.366 N/A GLY 496.A N LEU 493.A O no hydrogen 3.136 N/A MET 497.A N PHE 492.A O no hydrogen 3.191 N/A SER 500.A OG ASP 629.A OD1 no hydrogen 2.644 N/A LYS 501.A NZ MET 600.A O no hydrogen 2.851 N/A LYS 501.A NZ LYS 603.A O no hydrogen 3.096 N/A LYS 501.A NZ VAL 606.A O no hydrogen 2.910 N/A VAL 503.A N ILE 608.A O no hydrogen 3.234 N/A LEU 504.A N GLN 630.A O no hydrogen 2.833 N/A PHE 505.A N GLY 610.A O no hydrogen 2.617 N/A TYR 506.A N ILE 632.A O no hydrogen 2.940 N/A CYS 511.A SG PRO 508.A O no hydrogen 3.411 N/A CYS 511.A SG PRO 509.A O no hydrogen 3.822 N/A CYS 511.A SG PRO 635.A O no hydrogen 3.643 N/A LYS 513.A NZ GLY 507.A O no hydrogen 3.476 N/A LYS 513.A NZ ASN 613.A OD1 no hydrogen 2.765 N/A THR 514.A OG1 ASP 566.A OD2 no hydrogen 3.110 N/A LEU 516.A N GLY 512.A O no hydrogen 2.736 N/A ALA 517.A N LYS 513.A O no hydrogen 2.959 N/A LYS 518.A N THR 514.A O no hydrogen 2.950 N/A ALA 519.A N LEU 515.A O no hydrogen 2.846 N/A ILE 520.A N LEU 516.A O no hydrogen 2.924 N/A ALA 521.A N ALA 517.A O no hydrogen 2.990 N/A ASN 522.A N LYS 518.A O no hydrogen 2.875 N/A ASN 522.A ND2 PRO 461.A O no hydrogen 2.366 N/A GLU 523.A N ALA 519.A O no hydrogen 2.901 N/A CYS 524.A SG GLN 483.A OE1 no hydrogen 3.807 N/A CYS 524.A SG ILE 520.A O no hydrogen 3.478 N/A GLN 525.A N ASN 522.A O no hydrogen 2.952 N/A GLN 525.A NE2 ASN 522.A O no hydrogen 3.053 N/A ALA 526.A N ALA 521.A O no hydrogen 2.987 N/A ASN 527.A N PRO 560.A O no hydrogen 2.992 N/A ASN 527.A ND2 ALA 558.A O no hydrogen 2.829 N/A PHE 528.A N GLU 459.A O no hydrogen 2.837 N/A ILE 529.A N VAL 562.A O no hydrogen 3.007 N/A ILE 531.A N PHE 564.A O no hydrogen 2.782 N/A LYS 532.A NZ SER 530.A O no hydrogen 3.468 N/A GLY 533.A N GLN 567.A OE1 no hydrogen 3.365 N/A GLU 535.A N LYS 532.A O no hydrogen 3.194 N/A LEU 536.A N LYS 532.A O no hydrogen 3.376 N/A LEU 537.A N GLY 533.A O no hydrogen 2.899 N/A THR 538.A N PRO 534.A O no hydrogen 2.830 N/A THR 538.A OG1 PRO 534.A O no hydrogen 2.702 N/A MET 539.A N GLU 535.A O no hydrogen 3.001 N/A TRP 540.A N LEU 536.A O no hydrogen 2.896 N/A PHE 541.A N LEU 537.A O no hydrogen 2.860 N/A GLY 542.A N THR 538.A O no hydrogen 3.088 N/A GLU 543.A N TRP 540.A O no hydrogen 3.239 N/A SER 544.A N MET 539.A O no hydrogen 2.958 N/A SER 544.A OG MET 539.A O no hydrogen 3.477 N/A GLU 545.A N GLU 545.A OE1 no hydrogen 2.302 N/A ASN 547.A N SER 544.A O no hydrogen 3.294 N/A ASN 547.A ND2 GLU 550.A OE1 no hydrogen 2.701 N/A VAL 548.A N GLU 545.A O no hydrogen 2.914 N/A ILE 551.A N ASN 547.A O no hydrogen 3.319 N/A PHE 552.A N VAL 548.A O no hydrogen 3.276 N/A ASP 553.A N ARG 549.A O no hydrogen 2.849 N/A LYS 554.A N GLU 550.A O no hydrogen 2.966 N/A ALA 555.A N ILE 551.A O no hydrogen 3.056 N/A ARG 556.A N PHE 552.A O no hydrogen 2.969 N/A ARG 556.A N ASP 553.A O no hydrogen 2.961 N/A GLN 557.A N ASP 553.A O no hydrogen 3.062 N/A ALA 558.A N LYS 554.A O no hydrogen 2.906 N/A ALA 559.A N ARG 556.A O no hydrogen 3.496 N/A CYS 561.A N ASN 605.A O no hydrogen 3.167 N/A CYS 561.A SG ASN 527.A O no hydrogen 3.323 N/A VAL 562.A N ASN 527.A O no hydrogen 2.683 N/A LEU 563.A N PHE 607.A O no hydrogen 2.799 N/A PHE 564.A N ILE 529.A O no hydrogen 2.802 N/A PHE 565.A N ILE 609.A O no hydrogen 2.763 N/A ASP 566.A N ILE 531.A O no hydrogen 2.836 N/A LEU 568.A N ALA 611.A O no hydrogen 2.914 N/A SER 570.A N GLN 567.A O no hydrogen 3.279 N/A SER 570.A OG GLY 533.A O no hydrogen 3.414 N/A SER 570.A OG GLN 567.A O no hydrogen 3.466 N/A LYS 573.A N ASP 569.A O no hydrogen 2.816 N/A ALA 574.A N SER 570.A O no hydrogen 2.914 N/A ARG 575.A N ILE 571.A O no hydrogen 3.008 N/A GLY 576.A N LYS 573.A O no hydrogen 2.718 N/A GLY 577.A N ALA 572.A O no hydrogen 2.974 N/A ARG 588.A NH1 GLU 545.A OE2 no hydrogen 2.102 N/A ILE 590.A N ASP 587.A OD1 no hydrogen 2.833 N/A ASN 591.A N ASP 587.A O no hydrogen 2.958 N/A ASN 591.A ND2 GLN 592.A OE1 no hydrogen 3.630 N/A GLN 592.A N ARG 588.A O no hydrogen 3.009 N/A ILE 593.A N VAL 589.A O no hydrogen 2.919 N/A LEU 594.A N ILE 590.A O no hydrogen 2.865 N/A THR 595.A N ASN 591.A O no hydrogen 3.014 N/A THR 595.A OG1 GLN 592.A O no hydrogen 2.716 N/A GLU 596.A N GLN 592.A O no hydrogen 2.901 N/A MET 597.A N ILE 593.A O no hydrogen 2.850 N/A ASP 598.A N LEU 594.A O no hydrogen 2.972 N/A GLY 599.A N THR 595.A O no hydrogen 2.946 N/A MET 600.A N GLU 596.A O no hydrogen 2.846 N/A SER 601.A OG ASP 598.A O no hydrogen 2.960 N/A THR 602.A OG1 GLY 599.A O no hydrogen 3.428 N/A LYS 603.A N MET 600.A O no hydrogen 2.894 N/A PHE 607.A N CYS 561.A O no hydrogen 3.056 N/A ILE 608.A N LYS 501.A O no hydrogen 3.339 N/A ILE 609.A N LEU 563.A O no hydrogen 2.708 N/A GLY 610.A N VAL 503.A O no hydrogen 2.861 N/A ALA 611.A N PHE 565.A O no hydrogen 2.894 N/A THR 612.A N PHE 505.A O no hydrogen 2.988 N/A THR 612.A OG1 ASP 569.A OD1 no hydrogen 2.610 N/A ASN 613.A N ASP 569.A OD1 no hydrogen 3.404 N/A ARG 614.A N THR 612.A OG1 no hydrogen 3.077 N/A ARG 614.A NH2 ASP 616.A OD2 no hydrogen 3.196 N/A ASP 616.A N ASP 616.A OD1 no hydrogen 2.558 N/A ILE 617.A N ARG 614.A O no hydrogen 3.344 N/A ILE 618.A N PRO 615.A O no hydrogen 3.381 N/A ALA 621.A N ASP 619.A OD1 no hydrogen 3.293 N/A ILE 622.A N ASP 619.A O no hydrogen 3.167 N/A LEU 623.A N PRO 620.A O no hydrogen 2.917 N/A ARG 624.A N ALA 621.A O no hydrogen 3.506 N/A ARG 627.A N ARG 624.A O no hydrogen 3.013 N/A ARG 627.A NE ASP 598.A OD1 no hydrogen 3.057 N/A ARG 627.A NH1 ALA 621.A O no hydrogen 2.988 N/A ARG 627.A NH2 ASP 598.A OD1 no hydrogen 3.423 N/A ARG 627.A NH2 ASP 598.A OD2 no hydrogen 2.551 N/A GLN 630.A N GLY 502.A O no hydrogen 2.968 N/A GLN 630.A NE2 SER 500.A OG no hydrogen 3.126 N/A GLN 630.A NE2 ASP 629.A OD1 no hydrogen 3.378 N/A ILE 632.A N LEU 504.A O no hydrogen 2.927 N/A TYR 633.A OH GLU 733.A OE2 no hydrogen 3.379 N/A ILE 634.A N TYR 506.A O no hydrogen 2.716 N/A SER 641.A N ASP 638.A OD1 no hydrogen 3.276 N/A SER 641.A OG ASP 638.A OD1 no hydrogen 2.881 N/A ARG 642.A N ASP 638.A O no hydrogen 2.679 N/A ARG 642.A NE ALA 665.A O no hydrogen 2.729 N/A ARG 642.A NH1 PRO 637.A O no hydrogen 3.139 N/A ARG 642.A NH2 ALA 665.A O no hydrogen 2.741 N/A VAL 643.A N GLU 639.A O no hydrogen 2.904 N/A ALA 644.A N LYS 640.A O no hydrogen 2.970 N/A ILE 645.A N SER 641.A O no hydrogen 2.847 N/A LEU 646.A N ARG 642.A O no hydrogen 2.910 N/A LYS 647.A N VAL 643.A O no hydrogen 2.916 N/A ALA 648.A N ALA 644.A O no hydrogen 2.894 N/A ASN 649.A N ILE 645.A O no hydrogen 2.912 N/A LEU 650.A N LEU 646.A O no hydrogen 3.174 N/A ARG 651.A NE ALA 648.A O no hydrogen 3.240 N/A ARG 651.A NH1 ASP 467.A OD1 no hydrogen 3.461 N/A ARG 651.A NH2 ASP 467.A OD1 no hydrogen 2.985 N/A SER 653.A N LEU 650.A O no hydrogen 3.337 N/A ALA 656.A N ILE 708.A O no hydrogen 3.064 N/A VAL 659.A N ALA 656.A O no hydrogen 3.120 N/A GLU 662.A N GLU 662.A OE1 no hydrogen 2.683 N/A LEU 664.A N ASP 660.A O no hydrogen 3.480 N/A ALA 665.A N LEU 661.A O no hydrogen 2.907 N/A LYS 666.A N GLU 662.A O no hydrogen 2.915 N/A MET 667.A N PHE 663.A O no hydrogen 2.944 N/A THR 668.A N LEU 664.A O no hydrogen 3.196 N/A THR 668.A N ALA 665.A O no hydrogen 3.278 N/A THR 668.A OG1 LEU 664.A O no hydrogen 2.685 N/A THR 668.A OG1 ALA 665.A O no hydrogen 3.156 N/A SER 672.A N ASP 675.A OD2 no hydrogen 3.302 N/A SER 672.A OG GLY 510.A O no hydrogen 3.440 N/A ALA 674.A N GLY 510.A O no hydrogen 3.117 N/A ASP 675.A N SER 672.A OG no hydrogen 3.417 N/A LEU 676.A N SER 672.A O no hydrogen 3.057 N/A THR 677.A N GLY 673.A O no hydrogen 2.917 N/A THR 677.A OG1 GLY 673.A O no hydrogen 2.715 N/A GLU 678.A N ALA 674.A O no hydrogen 2.877 N/A ILE 679.A N ASP 675.A O no hydrogen 2.935 N/A CYS 680.A N LEU 676.A O no hydrogen 2.953 N/A CYS 680.A SG LEU 676.A O no hydrogen 3.205 N/A GLN 681.A N THR 677.A O no hydrogen 2.873 N/A ARG 682.A N GLU 678.A O no hydrogen 2.914 N/A ALA 683.A N ILE 679.A O no hydrogen 2.946 N/A CYS 684.A N CYS 680.A O no hydrogen 2.920 N/A CYS 684.A SG SER 653.A OG no hydrogen 3.479 N/A CYS 684.A SG CYS 680.A O no hydrogen 3.089 N/A LYS 685.A N GLN 681.A O no hydrogen 2.875 N/A LEU 686.A N ARG 682.A O no hydrogen 2.916 N/A ALA 687.A N ALA 683.A O no hydrogen 2.952 N/A ILE 688.A N CYS 684.A O no hydrogen 2.868 N/A ARG 689.A N LYS 685.A O no hydrogen 2.902 N/A GLU 690.A N LEU 686.A O no hydrogen 2.933 N/A SER 691.A N ALA 687.A O no hydrogen 2.926 N/A ILE 692.A N ILE 688.A O no hydrogen 2.894 N/A GLU 693.A N ARG 689.A O no hydrogen 2.918 N/A SER 694.A N GLU 690.A O no hydrogen 2.892 N/A SER 694.A OG GLU 690.A O no hydrogen 2.913 N/A GLU 695.A N SER 691.A O no hydrogen 2.907 N/A ILE 696.A N ILE 692.A O no hydrogen 2.892 N/A ARG 697.A N GLU 693.A O no hydrogen 2.864 N/A ARG 698.A N SER 694.A O no hydrogen 2.943 N/A GLU 699.A N GLU 695.A O no hydrogen 2.861 N/A ARG 700.A N ILE 696.A O no hydrogen 2.869 N/A GLU 701.A N ARG 697.A O no hydrogen 2.914 N/A ARG 702.A N ARG 698.A O no hydrogen 2.924 N/A ARG 702.A NE GLU 699.A O no hydrogen 3.212 N/A ARG 702.A NE GLU 699.A OE1 no hydrogen 2.722 N/A ARG 702.A NH2 GLU 699.A OE2 no hydrogen 2.199 N/A GLN 703.A N ARG 700.A O no hydrogen 3.112 N/A ILE 708.A N PRO 654.A O no hydrogen 2.863 N/A ARG 709.A N HIS 712.A ND1 no hydrogen 2.838 N/A ARG 709.A NE ASP 711.A OD1 no hydrogen 3.310 N/A ARG 709.A NH2 GLU 690.A OE2 no hydrogen 2.973 N/A ARG 709.A NH2 ASP 711.A OD2 no hydrogen 3.111 N/A HIS 712.A NE2 GLU 690.A OE1 no hydrogen 2.096 N/A PHE 713.A N ARG 709.A O no hydrogen 3.328 N/A GLU 714.A N ARG 710.A O no hydrogen 2.928 N/A GLU 715.A N ASP 711.A O no hydrogen 2.913 N/A ALA 716.A N HIS 712.A O no hydrogen 2.900 N/A MET 717.A N PHE 713.A O no hydrogen 2.873 N/A ARG 718.A N GLU 714.A O no hydrogen 3.017 N/A PHE 719.A N ALA 716.A O no hydrogen 3.090 N/A ARG 722.A NE VAL 724.A O no hydrogen 2.949 N/A ARG 722.A NH2 VAL 724.A O no hydrogen 3.014 N/A ARG 722.A NH2 ASP 726.A OD1 no hydrogen 3.545 N/A SER 723.A N ASP 675.A OD2 no hydrogen 3.024 N/A SER 723.A OG ASP 675.A OD1 no hydrogen 2.942 N/A ILE 729.A N SER 725.A O no hydrogen 3.300 N/A ARG 730.A N ASP 726.A O no hydrogen 2.938 N/A ARG 730.A NH2 ASN 727.A OD1 no hydrogen 3.156 N/A LYS 731.A N ASN 727.A O no hydrogen 2.971 N/A TYR 732.A N ASP 728.A O no hydrogen 3.017 N/A TYR 732.A OH ASN 613.A O no hydrogen 2.452 N/A GLU 733.A N ILE 729.A O no hydrogen 2.922 N/A MET 734.A N ARG 730.A O no hydrogen 2.946 N/A PHE 735.A N LYS 731.A O no hydrogen 2.949 N/A ALA 736.A N TYR 732.A O no hydrogen 2.865 N/A GLN 737.A N GLU 733.A O no hydrogen 2.879 N/A THR 738.A N MET 734.A O no hydrogen 3.283 N/A THR 738.A OG1 MET 734.A O no hydrogen 2.586 N/A THR 738.A OG1 PHE 735.A O no hydrogen 3.156 N/A LEU 739.A N ALA 736.A O no hydrogen 3.348 N/A