Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7s3d_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N GLN 12.A O no hydrogen 3.479 N/A THR 2.A OG1 PHE 4.A O no hydrogen 2.777 N/A GLN 9.A N ASP 34.A OD2 no hydrogen 2.675 N/A GLN 12.A N GLN 9.A O no hydrogen 3.201 N/A GLN 12.A NE2 PRO 5.A O no hydrogen 2.464 N/A GLN 13.A N GLN 9.A O no hydrogen 3.240 N/A ASP 14.A N LEU 11.A O no hydrogen 3.372 N/A THR 16.A OG1 ASP 14.A OD1 no hydrogen 3.096 N/A THR 17.A N LYS 704.A O no hydrogen 3.015 N/A ARG 18.A N THR 16.A OG1 no hydrogen 3.185 N/A TYR 22.A N ARG 18.A O no hydrogen 2.888 N/A TYR 22.A OH SER 709.A OG no hydrogen 2.692 N/A SER 23.A N ARG 19.A O no hydrogen 2.945 N/A SER 23.A OG ARG 19.A O no hydrogen 2.230 N/A THR 26.A OG1 TYR 22.A O no hydrogen 2.429 N/A GLU 31.A N GLU 31.A OE1 no hydrogen 2.476 N/A SER 32.A OG ASP 29.A OD2 no hydrogen 3.190 N/A SER 32.A OG SER 32.A O no hydrogen 2.374 N/A HIS 33.A NE2 THR 26.A O no hydrogen 2.894 N/A ASP 34.A N PHE 7.A O no hydrogen 3.061 N/A SER 40.A N THR 37.A OG1 no hydrogen 3.334 N/A LEU 41.A N THR 37.A O no hydrogen 2.954 N/A TYR 42.A N GLU 38.A O no hydrogen 3.004 N/A GLN 43.A N GLU 39.A O no hydrogen 2.996 N/A GLN 43.A NE2 PRO 162.A O no hydrogen 2.690 N/A ARG 44.A N SER 40.A O no hydrogen 3.075 N/A ILE 45.A N LEU 41.A O no hydrogen 2.986 N/A PHE 46.A N TYR 42.A O no hydrogen 2.937 N/A ALA 47.A N GLN 43.A O no hydrogen 3.077 N/A SER 48.A N ARG 44.A O no hydrogen 2.940 N/A SER 48.A OG ARG 44.A O no hydrogen 2.829 N/A HIS 49.A N ILE 45.A O no hydrogen 2.886 N/A PHE 50.A N PHE 46.A O no hydrogen 3.091 N/A GLY 51.A N ALA 47.A O no hydrogen 3.033 N/A HIS 52.A N SER 48.A O no hydrogen 2.916 N/A LEU 53.A N HIS 49.A O no hydrogen 2.957 N/A ALA 54.A N PHE 50.A O no hydrogen 2.982 N/A ILE 55.A N GLY 51.A O no hydrogen 3.010 N/A ILE 56.A N HIS 52.A O no hydrogen 2.989 N/A PHE 57.A N LEU 53.A O no hydrogen 2.938 N/A LEU 58.A N ALA 54.A O no hydrogen 2.910 N/A TRP 59.A N ILE 55.A O no hydrogen 2.904 N/A THR 60.A N ILE 56.A O no hydrogen 3.008 N/A THR 60.A OG1 ILE 56.A O no hydrogen 3.057 N/A SER 61.A N PHE 57.A O no hydrogen 2.888 N/A SER 61.A OG ALA 138.A O no hydrogen 2.734 N/A GLY 62.A N LEU 58.A O no hydrogen 2.901 N/A ILE 63.A N TRP 59.A O no hydrogen 3.002 N/A LEU 64.A N THR 60.A O no hydrogen 2.988 N/A PHE 65.A N SER 61.A O no hydrogen 2.838 N/A HIS 66.A N GLY 62.A O no hydrogen 2.953 N/A HIS 66.A ND1 GLN 70.A OE1 no hydrogen 2.621 N/A VAL 67.A N ILE 63.A O no hydrogen 3.018 N/A ALA 68.A N LEU 64.A O no hydrogen 3.083 N/A GLN 70.A N HIS 66.A O no hydrogen 3.028 N/A GLY 71.A N VAL 67.A O no hydrogen 3.129 N/A ASN 72.A N TYR 120.A OH no hydrogen 3.123 N/A ASN 72.A ND2 SER 84.A O no hydrogen 3.030 N/A TRP 76.A N PHE 73.A O no hydrogen 3.199 N/A ILE 77.A N PHE 73.A O no hydrogen 3.172 N/A ASP 79.A N TRP 76.A O no hydrogen 3.168 N/A ILE 86.A N ASN 72.A OD1 no hydrogen 3.034 N/A ALA 87.A N ASN 113.A O no hydrogen 2.812 N/A HIS 88.A ND1 ALA 89.A O no hydrogen 2.969 N/A ALA 89.A N GLN 70.A OE1 no hydrogen 3.396 N/A ILE 90.A N PRO 111.A O no hydrogen 2.865 N/A GLN 94.A N ASP 92.A OD1 no hydrogen 3.504 N/A PHE 95.A N ASP 92.A O no hydrogen 3.471 N/A ALA 99.A N GLY 96.A O no hydrogen 3.098 N/A MET 100.A N GLY 96.A O no hydrogen 3.064 N/A ASP 101.A N PRO 97.A O no hydrogen 2.953 N/A ALA 102.A N ALA 98.A O no hydrogen 3.235 N/A PHE 103.A N ALA 99.A O no hydrogen 3.131 N/A THR 104.A N ASP 101.A O no hydrogen 3.429 N/A THR 104.A OG1 MET 100.A O no hydrogen 2.258 N/A ASN 110.A ND2 PRO 111.A O no hydrogen 3.058 N/A VAL 112.A N PHE 103.A O no hydrogen 2.913 N/A ASN 113.A N HIS 88.A O no hydrogen 2.956 N/A ASN 113.A ND2 HIS 88.A NE2 no hydrogen 3.343 N/A CYS 115.A N PRO 85.A O no hydrogen 2.739 N/A CYS 115.A SG SER 117.A OG no hydrogen 3.156 N/A TYR 120.A OH ASN 72.A OD1 no hydrogen 3.364 N/A TYR 120.A OH ILE 86.A O no hydrogen 2.427 N/A TRP 122.A N GLY 118.A O no hydrogen 3.216 N/A TRP 123.A N VAL 119.A O no hydrogen 2.889 N/A TYR 124.A N TYR 120.A O no hydrogen 2.900 N/A THR 125.A N HIS 121.A O no hydrogen 2.985 N/A THR 125.A N TRP 122.A O no hydrogen 3.214 N/A THR 125.A OG1 HIS 121.A O no hydrogen 2.729 N/A LEU 128.A N TRP 123.A O no hydrogen 2.969 N/A ARG 129.A N ASP 133.A OD2 no hydrogen 3.236 N/A ARG 129.A NE ASN 244.A OD1 no hydrogen 2.512 N/A ARG 129.A NH1 TYR 124.A O no hydrogen 2.393 N/A ARG 129.A NH2 GLU 200.A O no hydrogen 3.063 N/A THR 130.A OG1 ASP 133.A OD1 no hydrogen 2.925 N/A ASP 133.A N THR 130.A OG1 no hydrogen 3.253 N/A LEU 134.A N THR 130.A O no hydrogen 3.311 N/A PHE 135.A N ASN 131.A O no hydrogen 2.886 N/A ALA 136.A N GLY 132.A O no hydrogen 2.894 N/A GLY 137.A N ASP 133.A O no hydrogen 2.957 N/A ALA 138.A N LEU 134.A O no hydrogen 2.898 N/A MET 139.A N PHE 135.A O no hydrogen 2.918 N/A PHE 140.A N ALA 136.A O no hydrogen 2.947 N/A LEU 141.A N GLY 137.A O no hydrogen 2.952 N/A LEU 142.A N ALA 138.A O no hydrogen 2.905 N/A LEU 143.A N MET 139.A O no hydrogen 3.012 N/A LEU 144.A N PHE 140.A O no hydrogen 2.831 N/A ALA 145.A N LEU 141.A O no hydrogen 2.881 N/A ALA 146.A N LEU 142.A O no hydrogen 3.040 N/A VAL 147.A N LEU 143.A O no hydrogen 2.904 N/A MET 148.A N LEU 144.A O no hydrogen 2.939 N/A LEU 149.A N ALA 145.A O no hydrogen 2.933 N/A TYR 150.A N ALA 146.A O no hydrogen 2.930 N/A ALA 151.A N VAL 147.A O no hydrogen 2.899 N/A GLY 152.A N MET 148.A O no hydrogen 2.959 N/A TRP 153.A N LEU 149.A O no hydrogen 2.982 N/A LEU 154.A N TYR 150.A O no hydrogen 2.847 N/A HIS 155.A N ALA 151.A O no hydrogen 3.109 N/A HIS 155.A ND1 TYR 160.A O no hydrogen 3.069 N/A LEU 156.A N TRP 153.A O no hydrogen 3.356 N/A GLN 157.A N LEU 154.A O no hydrogen 3.121 N/A GLN 157.A NE2 TRP 153.A O no hydrogen 2.807 N/A TYR 160.A N GLN 157.A O no hydrogen 2.915 N/A ARG 161.A N GLN 157.A O no hydrogen 2.879 N/A ARG 161.A NE LEU 156.A O no hydrogen 2.881 N/A ARG 161.A NH1 GLN 43.A OE1 no hydrogen 2.456 N/A TRP 166.A N SER 163.A OG no hydrogen 3.361 N/A PHE 167.A N SER 163.A O no hydrogen 3.345 N/A LYS 168.A N LEU 164.A O no hydrogen 2.955 N/A LYS 168.A NZ ASN 334.A OD1 no hydrogen 2.777 N/A ASN 169.A N TRP 166.A O no hydrogen 3.321 N/A SER 172.A N ASN 169.A OD1 no hydrogen 3.441 N/A ASN 175.A N GLU 171.A O no hydrogen 3.319 N/A ASN 175.A ND2 TYR 290.A O no hydrogen 2.459 N/A HIS 176.A N SER 172.A O no hydrogen 2.949 N/A HIS 176.A ND1 SER 172.A O no hydrogen 2.334 N/A HIS 177.A N ARG 173.A O no hydrogen 2.853 N/A LEU 178.A N LEU 174.A O no hydrogen 2.926 N/A ALA 179.A N ASN 175.A O no hydrogen 2.956 N/A LEU 181.A N HIS 177.A O no hydrogen 3.320 N/A PHE 182.A N HIS 177.A O no hydrogen 2.829 N/A SER 185.A OG LEU 181.A O no hydrogen 3.211 N/A SER 186.A OG HIS 276.A O no hydrogen 2.517 N/A LEU 187.A N GLY 183.A O no hydrogen 2.784 N/A ALA 188.A N VAL 184.A O no hydrogen 2.836 N/A TRP 189.A N SER 185.A O no hydrogen 2.910 N/A THR 190.A N SER 186.A O no hydrogen 2.914 N/A THR 190.A OG1 SER 186.A O no hydrogen 3.091 N/A THR 190.A OG1 ALA 273.A O no hydrogen 3.420 N/A GLY 191.A N LEU 187.A O no hydrogen 2.933 N/A HIS 192.A N ALA 188.A O no hydrogen 2.934 N/A HIS 192.A NE2 ILE 126.A O no hydrogen 2.590 N/A LEU 193.A N TRP 189.A O no hydrogen 2.897 N/A VAL 194.A N THR 190.A O no hydrogen 3.042 N/A HIS 195.A N GLY 191.A O no hydrogen 2.983 N/A VAL 196.A N HIS 192.A O no hydrogen 2.732 N/A ALA 197.A N HIS 192.A O no hydrogen 3.126 N/A ILE 198.A N LEU 193.A O no hydrogen 2.795 N/A GLU 200.A N VAL 196.A O no hydrogen 2.875 N/A SER 201.A N ALA 197.A O no hydrogen 2.970 N/A ARG 202.A N ILE 198.A O no hydrogen 3.202 N/A ARG 202.A N PRO 199.A O no hydrogen 2.916 N/A ARG 202.A NE ASP 237.A OD1 no hydrogen 2.765 N/A ARG 202.A NE ASP 237.A OD2 no hydrogen 3.252 N/A ARG 202.A NH2 ASP 237.A OD1 no hydrogen 2.781 N/A ARG 202.A NH2 ALA 252.A O no hydrogen 2.995 N/A GLY 203.A N GLU 200.A O no hydrogen 3.377 N/A GLN 204.A N PRO 199.A O no hydrogen 3.151 N/A ASN 210.A ND2 HIS 205.A O no hydrogen 3.598 N/A ASN 210.A ND2 ASP 209.A OD1 no hydrogen 2.705 N/A MET 214.A N ASN 210.A O no hydrogen 3.036 N/A LYS 222.A N GLU 219.A O no hydrogen 3.442 N/A THR 226.A N LYS 222.A O no hydrogen 3.225 N/A THR 226.A OG1 LYS 222.A O no hydrogen 2.557 N/A GLY 227.A N PRO 223.A O no hydrogen 3.179 N/A TRP 229.A NE1 PHE 224.A O no hydrogen 3.049 N/A TYR 232.A N TRP 229.A O no hydrogen 3.295 N/A ALA 233.A N GLY 230.A O no hydrogen 3.368 N/A LEU 234.A N ALA 231.A O no hydrogen 3.354 N/A THR 238.A N GLY 248.A O no hydrogen 3.174 N/A THR 238.A OG1 GLY 248.A O no hydrogen 2.445 N/A SER 239.A OG GLU 240.A OE1 no hydrogen 2.488 N/A HIS 241.A NE2 THR 245.A O no hydrogen 3.170 N/A LEU 242.A N GLN 247.A O no hydrogen 3.106 N/A PHE 243.A N GLN 263.A OE1 no hydrogen 3.291 N/A ASN 244.A N SER 201.A O no hydrogen 2.880 N/A THR 245.A N LEU 242.A O no hydrogen 3.141 N/A THR 245.A OG1 LEU 242.A O no hydrogen 2.745 N/A THR 245.A OG1 GLN 247.A OE1 no hydrogen 3.370 N/A ALA 249.A N SER 246.A O no hydrogen 3.277 N/A GLY 250.A N ASP 237.A OD1 no hydrogen 2.860 N/A THR 251.A N ASN 235.A O no hydrogen 2.878 N/A THR 251.A OG1 ASN 235.A OD1 no hydrogen 3.006 N/A ALA 252.A N ASN 235.A O no hydrogen 2.935 N/A ILE 253.A N TYR 232.A O no hydrogen 3.193 N/A LEU 254.A N TYR 232.A O no hydrogen 3.311 N/A LEU 257.A N ASP 271.A OD2 no hydrogen 3.054 N/A GLY 258.A N ASP 271.A OD1 no hydrogen 3.023 N/A HIS 261.A N SER 266.A O no hydrogen 2.625 N/A HIS 261.A NE2 HIS 241.A O no hydrogen 3.073 N/A THR 264.A OG1 SER 266.A OG no hydrogen 2.688 N/A GLU 265.A N HIS 261.A O no hydrogen 2.736 N/A SER 266.A OG THR 264.A OG1 no hydrogen 2.688 N/A SER 266.A OG LEU 267.A O no hydrogen 3.431 N/A LEU 267.A N PRO 362.A O no hydrogen 2.813 N/A MET 272.A N TRP 268.A O no hydrogen 2.948 N/A ALA 273.A N LEU 269.A O no hydrogen 2.920 N/A HIS 274.A N THR 270.A O no hydrogen 2.914 N/A HIS 275.A N ASP 271.A O no hydrogen 2.803 N/A HIS 276.A N MET 272.A O no hydrogen 2.941 N/A HIS 276.A ND1 MET 272.A O no hydrogen 2.389 N/A LEU 277.A N ALA 273.A O no hydrogen 3.004 N/A ALA 278.A N HIS 274.A O no hydrogen 2.944 N/A ILE 279.A N HIS 275.A O no hydrogen 2.874 N/A ALA 280.A N HIS 276.A O no hydrogen 2.824 N/A VAL 281.A N LEU 277.A O no hydrogen 2.987 N/A PHE 283.A N ILE 279.A O no hydrogen 2.912 N/A ILE 284.A N ALA 280.A O no hydrogen 2.877 N/A ILE 285.A N VAL 281.A O no hydrogen 2.930 N/A ALA 286.A N ILE 282.A O no hydrogen 2.881 N/A GLY 287.A N PHE 283.A O no hydrogen 2.977 N/A TYR 290.A N ASN 175.A OD1 no hydrogen 3.340 N/A ARG 291.A N HIS 298.A O no hydrogen 2.654 N/A THR 292.A OG1 ASN 293.A OD1 no hydrogen 3.077 N/A ASN 293.A N THR 292.A OG1 no hydrogen 2.418 N/A ILE 296.A N PHE 294.A O no hydrogen 2.743 N/A HIS 298.A N MET 289.A O no hydrogen 2.606 N/A LYS 301.A NZ ASP 330.A OD1 no hydrogen 3.403 N/A MET 303.A N SER 299.A O no hydrogen 3.188 N/A THR 304.A N ILE 300.A O no hydrogen 2.933 N/A THR 304.A OG1 ILE 300.A O no hydrogen 3.379 N/A THR 304.A OG1 LYS 301.A O no hydrogen 2.970 N/A GLU 305.A N LYS 301.A O no hydrogen 2.903 N/A SER 306.A OG GLU 302.A O no hydrogen 2.280 N/A LEU 307.A N THR 304.A O no hydrogen 3.199 N/A GLN 308.A NE2 GLY 322.A O no hydrogen 2.527 N/A GLY 314.A N GLY 311.A O no hydrogen 3.188 N/A THR 321.A OG1 ALA 318.A O no hydrogen 2.948 N/A ARG 323.A N ASN 411.A O no hydrogen 2.663 N/A ARG 323.A NE GLU 410.A O no hydrogen 2.440 N/A ARG 323.A NH1 GLU 410.A O no hydrogen 3.400 N/A GLY 324.A N THR 321.A O no hydrogen 2.973 N/A LYS 326.A N ARG 323.A O no hydrogen 3.142 N/A LYS 326.A NZ GLU 305.A O no hydrogen 3.278 N/A LYS 326.A NZ GLU 305.A OE2 no hydrogen 3.270 N/A GLY 327.A N GLU 305.A OE1 no hydrogen 2.849 N/A ILE 328.A N HIS 325.A O no hydrogen 3.210 N/A ALA 331.A N GLY 327.A O no hydrogen 2.897 N/A TYR 332.A N ILE 328.A O no hydrogen 2.905 N/A ASN 333.A N TYR 329.A O no hydrogen 2.833 N/A ASN 333.A ND2 LYS 168.A O no hydrogen 3.169 N/A ASN 334.A N ASP 330.A O no hydrogen 2.904 N/A SER 335.A OG ASP 403.A OD1 no hydrogen 2.481 N/A HIS 337.A ND1 HIS 395.A ND1 no hydrogen 2.930 N/A PHE 338.A N SER 335.A OG no hydrogen 3.077 N/A GLN 339.A N SER 335.A O no hydrogen 3.355 N/A LEU 340.A N LEU 336.A O no hydrogen 2.927 N/A GLY 341.A N HIS 337.A O no hydrogen 2.876 N/A TRP 342.A N PHE 338.A O no hydrogen 2.913 N/A HIS 343.A N GLN 339.A O no hydrogen 2.834 N/A HIS 343.A NE2 TYR 332.A OH no hydrogen 2.397 N/A LEU 344.A N LEU 340.A O no hydrogen 2.874 N/A ALA 345.A N GLY 341.A O no hydrogen 3.436 N/A CYS 346.A N TRP 342.A O no hydrogen 3.045 N/A CYS 346.A SG TRP 342.A O no hydrogen 3.310 N/A LEU 347.A N HIS 343.A O no hydrogen 2.864 N/A GLY 348.A N LEU 344.A O no hydrogen 2.832 N/A VAL 349.A N ALA 345.A O no hydrogen 3.005 N/A VAL 350.A N CYS 346.A O no hydrogen 2.983 N/A THR 351.A N LEU 347.A O no hydrogen 2.872 N/A THR 351.A OG1 LEU 347.A O no hydrogen 2.519 N/A SER 352.A N GLY 348.A O no hydrogen 3.403 N/A SER 352.A OG GLY 348.A O no hydrogen 2.872 N/A SER 352.A OG GLN 382.A OE1 no hydrogen 3.553 N/A LEU 353.A N VAL 349.A O no hydrogen 2.968 N/A VAL 354.A N VAL 350.A O no hydrogen 2.854 N/A ALA 355.A N THR 351.A O no hydrogen 2.994 N/A GLN 356.A N SER 352.A O no hydrogen 2.868 N/A HIS 357.A N LEU 353.A O no hydrogen 2.875 N/A MET 358.A N VAL 354.A O no hydrogen 2.948 N/A MET 361.A N HIS 357.A O no hydrogen 2.842 N/A ALA 365.A N THR 125.A OG1 no hydrogen 2.763 N/A PHE 366.A N THR 264.A O no hydrogen 3.212 N/A ILE 367.A N TYR 364.A O no hydrogen 3.427 N/A ASP 370.A N ILE 367.A O no hydrogen 3.300 N/A THR 373.A N ASP 370.A OD1 no hydrogen 3.255 N/A THR 373.A OG1 ASP 370.A OD1 no hydrogen 2.962 N/A THR 374.A N ASP 370.A O no hydrogen 3.088 N/A THR 374.A OG1 ASP 370.A O no hydrogen 2.949 N/A ALA 375.A N TYR 371.A O no hydrogen 2.978 N/A ALA 376.A N THR 372.A O no hydrogen 2.885 N/A LEU 377.A N THR 373.A O no hydrogen 2.909 N/A TYR 378.A N THR 374.A O no hydrogen 3.030 N/A THR 379.A N ALA 375.A O no hydrogen 3.002 N/A THR 379.A OG1 ALA 375.A O no hydrogen 2.736 N/A HIS 380.A N ALA 376.A O no hydrogen 2.857 N/A HIS 381.A N LEU 377.A O no hydrogen 3.047 N/A GLN 382.A N TYR 378.A O no hydrogen 2.940 N/A GLN 382.A NE2 TYR 378.A OH no hydrogen 2.949 N/A TYR 383.A N THR 379.A O no hydrogen 2.986 N/A ILE 384.A N HIS 380.A O no hydrogen 2.988 N/A ALA 385.A N HIS 381.A O no hydrogen 2.884 N/A GLY 386.A N GLN 382.A O no hydrogen 2.949 N/A PHE 387.A N TYR 383.A O no hydrogen 3.024 N/A LEU 388.A N ILE 384.A O no hydrogen 2.929 N/A MET 389.A N ALA 385.A O no hydrogen 2.923 N/A LEU 390.A N GLY 386.A O no hydrogen 2.978 N/A GLY 391.A N PHE 387.A O no hydrogen 2.972 N/A ALA 392.A N LEU 388.A O no hydrogen 2.938 N/A ALA 394.A N LEU 390.A O no hydrogen 3.025 N/A HIS 395.A N GLY 391.A O no hydrogen 2.972 N/A HIS 395.A ND1 HIS 337.A ND1 no hydrogen 2.930 N/A GLY 396.A N ALA 392.A O no hydrogen 2.923 N/A GLY 397.A N PHE 393.A O no hydrogen 2.980 N/A ILE 398.A N ALA 394.A O no hydrogen 2.964 N/A PHE 399.A N HIS 395.A O no hydrogen 2.900 N/A LEU 400.A N GLY 396.A O no hydrogen 3.354 N/A ILE 401.A N GLY 397.A O no hydrogen 2.987 N/A ARG 402.A N ILE 398.A O no hydrogen 2.884 N/A ARG 402.A NH1 ASP 29.A OD1 no hydrogen 2.707 N/A ARG 402.A NH2 ASP 29.A OD1 no hydrogen 3.520 N/A ARG 402.A NH2 ASP 29.A OD2 no hydrogen 2.472 N/A ASP 403.A N PHE 399.A O no hydrogen 2.831 N/A TYR 404.A N PHE 399.A O no hydrogen 2.836 N/A ASN 409.A N ASP 405.A O no hydrogen 3.024 N/A ASN 409.A ND2 ASP 405.A O no hydrogen 2.577 N/A ASN 412.A ND2 LYS 326.A O no hydrogen 2.887 N/A ASN 412.A ND2 ASN 409.A OD1 no hydrogen 3.380 N/A VAL 413.A N GLY 324.A O no hydrogen 2.925 N/A ALA 415.A N ASN 412.A OD1 no hydrogen 3.046 N/A ARG 416.A N VAL 413.A O no hydrogen 3.207 N/A ARG 416.A NE ASN 411.A OD1 no hydrogen 3.093 N/A VAL 417.A N VAL 413.A O no hydrogen 2.940 N/A LEU 418.A N LEU 414.A O no hydrogen 3.056 N/A HIS 420.A ND1 ARG 416.A O no hydrogen 2.682 N/A LYS 421.A NZ LEU 548.A O no hydrogen 3.265 N/A LYS 421.A NZ ASP 549.A OD1 no hydrogen 3.209 N/A LYS 421.A NZ GLY 552.A O no hydrogen 2.975 N/A ALA 423.A N HIS 420.A O no hydrogen 2.832 N/A ILE 425.A N LYS 421.A O no hydrogen 2.952 N/A SER 426.A N GLU 422.A O no hydrogen 2.888 N/A SER 426.A OG GLU 422.A O no hydrogen 2.511 N/A SER 426.A OG ALA 423.A O no hydrogen 3.090 N/A HIS 427.A N ALA 423.A O no hydrogen 2.968 N/A HIS 427.A ND1 ALA 423.A O no hydrogen 2.306 N/A LEU 428.A N ILE 424.A O no hydrogen 2.974 N/A SER 429.A N ILE 425.A O no hydrogen 2.906 N/A TRP 430.A N SER 426.A O no hydrogen 2.902 N/A VAL 431.A N HIS 427.A O no hydrogen 3.001 N/A SER 432.A N LEU 428.A O no hydrogen 2.952 N/A SER 432.A OG LEU 428.A O no hydrogen 2.746 N/A LEU 433.A N SER 429.A O no hydrogen 2.902 N/A PHE 434.A N TRP 430.A O no hydrogen 2.908 N/A LEU 435.A N VAL 431.A O no hydrogen 2.978 N/A GLY 436.A N SER 432.A O no hydrogen 2.914 N/A PHE 437.A N LEU 433.A O no hydrogen 2.937 N/A HIS 438.A N PHE 434.A O no hydrogen 3.032 N/A THR 439.A N LEU 435.A O no hydrogen 2.904 N/A THR 439.A OG1 LEU 435.A O no hydrogen 2.872 N/A LEU 440.A N GLY 436.A O no hydrogen 2.985 N/A ALA 441.A N PHE 437.A O no hydrogen 2.934 N/A LEU 442.A N HIS 438.A O no hydrogen 2.915 N/A TYR 443.A N THR 439.A O no hydrogen 3.012 N/A VAL 444.A N LEU 440.A O no hydrogen 2.873 N/A HIS 445.A N ALA 441.A O no hydrogen 2.891 N/A HIS 445.A ND1 ASN 446.A OD1 no hydrogen 3.086 N/A ASN 446.A N LEU 442.A O no hydrogen 2.993 N/A ASN 446.A ND2 ILE 459.A O no hydrogen 3.475 N/A ASN 446.A ND2 THR 623.A O no hydrogen 2.637 N/A ASP 447.A N TYR 443.A O no hydrogen 2.898 N/A CYS 448.A N VAL 444.A O no hydrogen 2.927 N/A CYS 448.A SG VAL 444.A O no hydrogen 3.279 N/A GLU 449.A N HIS 445.A O no hydrogen 2.906 N/A VAL 450.A N ASN 446.A O no hydrogen 2.946 N/A ALA 451.A N ASP 447.A O no hydrogen 2.886 N/A PHE 452.A N CYS 448.A O no hydrogen 3.237 N/A GLY 453.A N VAL 450.A O no hydrogen 3.211 N/A SER 454.A N GLU 449.A O no hydrogen 2.772 N/A LYS 457.A N SER 454.A O no hydrogen 3.290 N/A GLN 458.A NE2 PRO 455.A O no hydrogen 3.149 N/A ILE 459.A N ASN 446.A OD1 no hydrogen 3.096 N/A VAL 464.A N GLU 462.A O no hydrogen 2.905 N/A GLN 467.A N PRO 463.A O no hydrogen 2.766 N/A GLN 467.A NE2 GLU 462.A OE1 no hydrogen 2.827 N/A GLN 467.A NE2 ILE 521.A O no hydrogen 2.991 N/A TRP 468.A N VAL 464.A O no hydrogen 2.894 N/A ILE 469.A N PHE 465.A O no hydrogen 2.921 N/A GLN 470.A N ALA 466.A O no hydrogen 2.868 N/A ALA 471.A N GLN 467.A O no hydrogen 2.930 N/A VAL 472.A N TRP 468.A O no hydrogen 2.815 N/A GLY 474.A N ALA 471.A O no hydrogen 3.150 N/A LYS 475.A N GLN 470.A O no hydrogen 3.328 N/A LEU 483.A N SER 482.A OG no hydrogen 2.584 N/A LEU 484.A N VAL 472.A O no hydrogen 3.406 N/A SER 485.A OG ILE 480.A O no hydrogen 3.127 N/A ASN 486.A N SER 482.A O no hydrogen 2.483 N/A SER 492.A OG LEU 483.A O no hydrogen 2.906 N/A SER 492.A OG ASN 486.A O no hydrogen 2.631 N/A THR 493.A N SER 489.A O no hydrogen 3.043 N/A THR 493.A OG1 SER 489.A O no hydrogen 2.713 N/A ALA 494.A N ILE 490.A O no hydrogen 3.334 N/A ASN 497.A N ALA 494.A O no hydrogen 2.690 N/A HIS 498.A N ALA 494.A O no hydrogen 2.644 N/A HIS 498.A ND1 THR 493.A O no hydrogen 2.514 N/A ASN 500.A ND2 SER 492.A O no hydrogen 2.382 N/A TRP 506.A N TRP 502.A O no hydrogen 2.855 N/A TRP 506.A NE1 HIS 473.A O no hydrogen 3.022 N/A LEU 507.A N LEU 503.A O no hydrogen 2.935 N/A GLU 508.A N PRO 504.A O no hydrogen 2.903 N/A ALA 509.A N TRP 506.A O no hydrogen 3.220 N/A ILE 510.A N TRP 506.A O no hydrogen 2.947 N/A ASN 511.A N LEU 507.A O no hydrogen 3.430 N/A THR 514.A OG1 ASN 512.A OD1 no hydrogen 2.710 N/A ASN 515.A ND2 ALA 509.A O no hydrogen 2.772 N/A ILE 521.A N TYR 478.A OH no hydrogen 3.481 N/A GLY 522.A N ASP 525.A OD1 no hydrogen 2.896 N/A ASP 525.A N GLY 522.A O no hydrogen 3.001 N/A HIS 529.A N ASP 525.A O no hydrogen 2.929 N/A HIS 530.A N PHE 526.A O no hydrogen 3.001 N/A HIS 530.A ND1 PHE 526.A O no hydrogen 3.000 N/A ALA 531.A N LEU 527.A O no hydrogen 2.915 N/A ILE 532.A N VAL 528.A O no hydrogen 2.903 N/A ALA 533.A N HIS 529.A O no hydrogen 2.893 N/A LEU 534.A N HIS 530.A O no hydrogen 2.905 N/A GLY 535.A N ALA 531.A O no hydrogen 2.904 N/A LEU 536.A N ILE 532.A O no hydrogen 2.936 N/A HIS 537.A N ALA 533.A O no hydrogen 2.942 N/A HIS 537.A ND1 ALA 533.A O no hydrogen 2.737 N/A VAL 538.A N LEU 534.A O no hydrogen 2.908 N/A THR 539.A N GLY 535.A O no hydrogen 2.991 N/A THR 539.A OG1 GLY 535.A O no hydrogen 2.633 N/A THR 540.A N LEU 536.A O no hydrogen 2.930 N/A THR 540.A OG1 LEU 536.A O no hydrogen 2.527 N/A LEU 541.A N HIS 537.A O no hydrogen 2.816 N/A ILE 542.A N VAL 538.A O no hydrogen 2.961 N/A LEU 543.A N THR 539.A O no hydrogen 3.016 N/A VAL 544.A N THR 540.A O no hydrogen 2.775 N/A LYS 545.A N LEU 541.A O no hydrogen 2.871 N/A GLY 546.A N ILE 542.A O no hydrogen 2.973 N/A ALA 547.A N LEU 543.A O no hydrogen 2.899 N/A LEU 548.A N VAL 544.A O no hydrogen 2.874 N/A ASP 549.A N LYS 545.A O no hydrogen 2.934 N/A ALA 550.A N ALA 547.A O no hydrogen 3.292 N/A ARG 551.A NH1 LEU 400.A O no hydrogen 2.935 N/A SER 553.A N MET 556.A O no hydrogen 3.162 N/A LYS 559.A NZ ASP 549.A O no hydrogen 2.963 N/A LYS 559.A NZ ILE 579.A O no hydrogen 2.826 N/A LYS 560.A N ARG 551.A O no hydrogen 3.294 N/A LYS 560.A NZ ASP 561.A OD2 no hydrogen 3.201 N/A ASP 561.A N ASP 558.A O no hydrogen 3.315 N/A PHE 562.A N LYS 559.A O no hydrogen 3.329 N/A ASP 569.A N THR 576.A OG1 no hydrogen 2.603 N/A ARG 573.A NE LEU 555.A O no hydrogen 2.827 N/A ARG 573.A NH1 ASP 569.A OD2 no hydrogen 2.971 N/A ARG 573.A NH2 LEU 555.A O no hydrogen 2.874 N/A ARG 573.A NH2 ASP 569.A OD2 no hydrogen 2.530 N/A GLY 575.A N GLY 572.A O no hydrogen 3.092 N/A THR 576.A OG1 GLY 570.A O no hydrogen 2.922 N/A SER 580.A OG TYR 564.A O no hydrogen 3.453 N/A SER 580.A OG PHE 566.A O no hydrogen 3.515 N/A SER 580.A OG ASP 583.A OD1 no hydrogen 2.185 N/A TRP 582.A N TYR 564.A O no hydrogen 3.237 N/A ASP 583.A N SER 580.A OG no hydrogen 3.297 N/A SER 584.A N ALA 581.A O no hydrogen 3.165 N/A SER 584.A OG ALA 581.A O no hydrogen 2.811 N/A TYR 586.A N TRP 582.A O no hydrogen 2.977 N/A LEU 587.A N ASP 583.A O no hydrogen 2.833 N/A ALA 588.A N SER 584.A O no hydrogen 2.868 N/A THR 589.A N VAL 585.A O no hydrogen 2.940 N/A THR 589.A OG1 VAL 585.A O no hydrogen 2.507 N/A MET 592.A N ALA 588.A O no hydrogen 2.818 N/A LEU 593.A N THR 589.A O no hydrogen 2.908 N/A ASN 594.A N PHE 590.A O no hydrogen 2.916 N/A THR 595.A N TRP 591.A O no hydrogen 2.873 N/A THR 595.A OG1 TRP 591.A O no hydrogen 2.523 N/A LEU 596.A N MET 592.A O no hydrogen 2.888 N/A GLY 597.A N LEU 593.A O no hydrogen 2.847 N/A TRP 598.A N ASN 594.A O no hydrogen 2.934 N/A VAL 599.A N THR 595.A O no hydrogen 2.894 N/A THR 600.A N LEU 596.A O no hydrogen 2.871 N/A THR 600.A OG1 LEU 596.A O no hydrogen 2.557 N/A THR 600.A OG1 GLY 597.A O no hydrogen 3.304 N/A PHE 601.A N GLY 597.A O no hydrogen 2.826 N/A TYR 602.A N TRP 598.A O no hydrogen 2.946 N/A TYR 602.A OH ASP 525.A OD2 no hydrogen 2.216 N/A TYR 602.A OH HIS 529.A NE2 no hydrogen 3.152 N/A TRP 603.A N VAL 599.A O no hydrogen 2.959 N/A HIS 604.A N THR 600.A O no hydrogen 2.860 N/A HIS 604.A ND1 TYR 632.A OH no hydrogen 2.823 N/A HIS 604.A NE2 THR 737.A OG1 no hydrogen 2.717 N/A TRP 605.A N PHE 601.A O no hydrogen 2.929 N/A TRP 605.A NE1 GLN 617.A OE1 no hydrogen 3.279 N/A LYS 606.A N TYR 602.A O no hydrogen 2.948 N/A LYS 606.A NZ ALA 520.A O no hydrogen 2.476 N/A LYS 606.A NZ ASP 525.A OD1 no hydrogen 3.419 N/A LYS 606.A NZ ASP 525.A OD2 no hydrogen 3.440 N/A HIS 607.A N TRP 603.A O no hydrogen 2.962 N/A HIS 607.A ND1 TRP 603.A O no hydrogen 3.052 N/A LEU 608.A N HIS 604.A O no hydrogen 2.807 N/A ALA 609.A N TRP 605.A O no hydrogen 2.968 N/A ILE 610.A N LYS 606.A O no hydrogen 3.027 N/A TRP 611.A N HIS 607.A O no hydrogen 2.779 N/A SER 612.A N LEU 608.A O no hydrogen 2.958 N/A SER 612.A OG LEU 608.A O no hydrogen 2.791 N/A GLY 613.A N ILE 610.A O no hydrogen 3.150 N/A GLN 617.A N ASN 614.A O no hydrogen 3.215 N/A ASN 619.A N VAL 615.A O no hydrogen 2.964 N/A GLU 620.A N ALA 616.A O no hydrogen 3.056 N/A SER 622.A OG PHE 618.A O no hydrogen 2.717 N/A THR 623.A OG1 GLN 458.A OE1 no hydrogen 2.406 N/A LEU 625.A N ASP 447.A OD1 no hydrogen 2.427 N/A MET 626.A N ASP 447.A OD1 no hydrogen 3.350 N/A TRP 628.A NE1 SER 622.A O no hydrogen 3.031 N/A PHE 629.A N LEU 625.A O no hydrogen 2.959 N/A ARG 630.A N MET 626.A O no hydrogen 2.793 N/A ARG 630.A NE ASP 631.A OD1 no hydrogen 3.195 N/A ARG 630.A NH2 TYR 624.A OH no hydrogen 2.531 N/A ARG 630.A NH2 ASP 631.A OD2 no hydrogen 3.271 N/A ASP 631.A N GLY 627.A O no hydrogen 2.919 N/A TYR 632.A OH HIS 604.A ND1 no hydrogen 2.823 N/A LEU 633.A N TRP 628.A O no hydrogen 3.407 N/A TRP 634.A N PHE 629.A O no hydrogen 3.067 N/A ASN 636.A N TYR 632.A O no hydrogen 3.357 N/A ASN 636.A ND2 ASP 631.A O no hydrogen 3.398 N/A ASN 636.A ND2 TYR 632.A O no hydrogen 2.703 N/A SER 637.A OG LEU 633.A O no hydrogen 2.513 N/A ILE 641.A N SER 637.A O no hydrogen 2.975 N/A ASN 642.A ND2 ALA 638.A O no hydrogen 2.916 N/A GLY 643.A N LEU 640.A O no hydrogen 3.032 N/A ASN 645.A N GLY 648.A O no hydrogen 3.183 N/A ASN 645.A ND2 ASN 642.A OD1 no hydrogen 3.279 N/A TYR 647.A N ASN 645.A OD1 no hydrogen 3.238 N/A GLY 648.A N ASN 645.A OD1 no hydrogen 2.961 N/A ASN 650.A N GLY 643.A O no hydrogen 3.134 N/A LEU 652.A N ASN 650.A OD1 no hydrogen 3.143 N/A ALA 653.A N ASN 650.A O no hydrogen 3.296 N/A ALA 656.A N LEU 652.A O no hydrogen 2.981 N/A TRP 657.A N ALA 653.A O no hydrogen 2.957 N/A ILE 658.A N ILE 654.A O no hydrogen 2.850 N/A PHE 659.A N TRP 655.A O no hydrogen 2.888 N/A LEU 660.A N ALA 656.A O no hydrogen 3.049 N/A PHE 661.A N TRP 657.A O no hydrogen 2.832 N/A GLY 662.A N ILE 658.A O no hydrogen 2.823 N/A HIS 663.A N PHE 659.A O no hydrogen 3.057 N/A HIS 663.A ND1 PHE 659.A O no hydrogen 2.649 N/A LEU 664.A N LEU 660.A O no hydrogen 2.924 N/A VAL 665.A N PHE 661.A O no hydrogen 2.956 N/A TRP 666.A N GLY 662.A O no hydrogen 2.938 N/A ALA 667.A N HIS 663.A O no hydrogen 2.962 N/A ILE 668.A N LEU 664.A O no hydrogen 2.904 N/A SER 669.A N VAL 665.A O no hydrogen 2.982 N/A SER 669.A OG TRP 666.A O no hydrogen 2.165 N/A PHE 670.A N ALA 667.A O no hydrogen 3.094 N/A MET 671.A N ILE 668.A O no hydrogen 3.134 N/A LEU 673.A N SER 669.A O no hydrogen 2.911 N/A ILE 674.A N PHE 670.A O no hydrogen 2.861 N/A THR 675.A N MET 671.A O no hydrogen 3.345 N/A THR 675.A OG1 MET 671.A O no hydrogen 2.450 N/A TRP 676.A NE1 LEU 673.A O no hydrogen 3.190 N/A ARG 677.A NE ALA 707.A O no hydrogen 3.255 N/A ARG 677.A NE LEU 708.A O no hydrogen 3.213 N/A ARG 677.A NH2 ALA 707.A O no hydrogen 2.997 N/A TRP 680.A NE1 THR 675.A OG1 no hydrogen 2.775 N/A GLN 681.A N ARG 677.A O no hydrogen 2.959 N/A GLU 682.A N GLY 678.A O no hydrogen 3.033 N/A LEU 683.A N TYR 679.A O no hydrogen 3.058 N/A ILE 684.A N TRP 680.A O no hydrogen 2.892 N/A GLU 685.A N GLN 681.A O no hydrogen 2.939 N/A THR 686.A N GLU 682.A O no hydrogen 3.126 N/A THR 686.A OG1 LEU 683.A O no hydrogen 2.495 N/A LEU 687.A N LEU 683.A O no hydrogen 3.040 N/A MET 688.A N ILE 684.A O no hydrogen 2.869 N/A TRP 689.A N GLU 685.A O no hydrogen 3.003 N/A ALA 690.A N THR 686.A O no hydrogen 2.952 N/A HIS 691.A N LEU 687.A O no hydrogen 2.946 N/A HIS 691.A NE2 GLY 699.A O no hydrogen 2.404 N/A GLU 692.A N MET 688.A O no hydrogen 3.397 N/A THR 694.A OG1 ALA 690.A O no hydrogen 2.445 N/A SER 697.A OG PRO 695.A O no hydrogen 3.263 N/A TYR 700.A OH GLU 692.A OE2 no hydrogen 3.100 N/A LYS 704.A N PRO 15.A O no hydrogen 2.964 N/A SER 709.A OG TYR 22.A OH no hydrogen 2.692 N/A GLN 712.A N SER 709.A OG no hydrogen 3.328 N/A ALA 713.A N SER 709.A O no hydrogen 2.896 N/A ARG 714.A N ILE 710.A O no hydrogen 3.025 N/A ARG 714.A NH1 PRO 567.A O no hydrogen 3.437 N/A ARG 714.A NH2 PRO 567.A O no hydrogen 3.294 N/A LEU 715.A N VAL 711.A O no hydrogen 2.954 N/A VAL 716.A N GLN 712.A O no hydrogen 2.841 N/A GLY 717.A N ALA 713.A O no hydrogen 2.868 N/A LEU 718.A N ARG 714.A O no hydrogen 2.952 N/A VAL 719.A N LEU 715.A O no hydrogen 2.861 N/A HIS 720.A N VAL 716.A O no hydrogen 2.961 N/A HIS 720.A ND1 VAL 716.A O no hydrogen 2.851 N/A PHE 721.A N GLY 717.A O no hydrogen 2.895 N/A THR 722.A N LEU 718.A O no hydrogen 2.909 N/A THR 722.A OG1 LEU 718.A O no hydrogen 2.861 N/A VAL 723.A N VAL 719.A O no hydrogen 2.860 N/A GLY 724.A N HIS 720.A O no hydrogen 2.923 N/A TYR 725.A N PHE 721.A O no hydrogen 2.896 N/A ILE 726.A N THR 722.A O no hydrogen 2.890 N/A ALA 727.A N VAL 723.A O no hydrogen 2.881 N/A THR 728.A N GLY 724.A O no hydrogen 2.937 N/A THR 728.A OG1 GLY 724.A O no hydrogen 2.681 N/A TYR 729.A N TYR 725.A O no hydrogen 3.393 N/A TYR 729.A OH TYR 632.A OH no hydrogen 3.177 N/A GLY 730.A N ILE 726.A O no hydrogen 2.846 N/A ALA 731.A N ALA 727.A O no hydrogen 2.928 N/A PHE 732.A N THR 728.A O no hydrogen 2.964 N/A LEU 733.A N TYR 729.A O no hydrogen 2.862 N/A ILE 734.A N GLY 730.A O no hydrogen 3.199 N/A ALA 735.A N ALA 731.A O no hydrogen 3.255 N/A SER 736.A N PHE 732.A O no hydrogen 2.740 N/A SER 736.A OG PHE 732.A O no hydrogen 2.590 N/A THR 737.A OG1 LEU 733.A O no hydrogen 2.936 N/A GLY 738.A N ILE 734.A O no hydrogen 2.893 N/A SER 739.A OG ALA 735.A O no hydrogen 2.864 N/A PHE 741.A N THR 737.A O no hydrogen 2.940 N/A