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*** IMMUNE SYSTEM 08-OCT-20 7AMA ***elNémo ID: 2608031209262334017Job options:ID = 2608031209262334017 JOBID = IMMUNE SYSTEM 08-OCT-20 7AMA USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:HEADER IMMUNE SYSTEM 08-OCT-20 7AMA TITLE IL-17A IN COMPLEX WITH SMALL MOLECULE MODULATORS EXPDTA X-RAY DIFFRACTION REMARK 2 RESOLUTION. 2.48 ANGSTROMS REMARK 3 R VALUE : 0.210000 REMARK 3 FREE R VALUE : 0.255000 REMARK 4 7AMA COMPLIES WITH FORMAT V. 3.30, REMARK 200 TEMPERATURE (KELVIN) : 100.00 REMARK 200 PH : NULL REMARK 350 BIOMOLECULE: 1 REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.000000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.000000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.000000 REMARK 888 REMARK 888 WRITTEN BY MAESTRO (A PRODUCT OF SCHRODINGER, LLC) CRYST1 67.360 85.200 118.220 90.00 90.00 90.00 C 2 2 21 16 ATOM 1 N PRO A 19 -12.978 -12.635 -36.948 1.00185.63 N ANISOU 1 N PRO A 19 23668 26342 20520 1110 953 1439 ATOM 2 CA PRO A 19 -12.252 -13.557 -36.052 1.00184.83 C ANISOU 2 CA PRO A 19 23668 25889 20670 914 860 1153 ATOM 3 C PRO A 19 -10.927 -12.997 -35.438 1.00170.45 C ANISOU 3 C PRO A 19 22039 23545 19178 900 944 1126 ATOM 4 O PRO A 19 -9.948 -13.730 -35.295 1.00156.65 O ANISOU 4 O PRO A 19 20344 21633 17543 750 919 894 ATOM 5 CB PRO A 19 -12.050 -14.880 -36.824 1.00185.55 C ANISOU 5 CB PRO A 19 23673 26188 20638 689 782 839 ATOM 6 CG PRO A 19 -13.101 -14.775 -37.916 1.00179.28 C ANISOU 6 CG PRO A 19 22655 25991 19471 737 752 911 ATOM 7 CD PRO A 19 -13.019 -13.290 -38.256 1.00180.32 C ANISOU 7 CD PRO A 19 22783 26222 19510 1030 861 1319 ATOM 8 H PRO A 19 -13.941 -12.581 -36.629 1.00185.63 H ATOM 9 HA PRO A 19 -12.882 -13.740 -35.182 1.00184.83 H ATOM 10 HB3 PRO A 19 -12.205 -15.762 -36.201 1.00185.55 H ATOM 11 HB2 PRO A 19 -11.061 -14.950 -37.284 1.00185.55 H ATOM 12 HG3 PRO A 19 -14.101 -15.042 -37.568 1.00179.28 H ATOM 13 HG2 PRO A 19 -12.886 -15.415 -38.773 1.00179.28 H ATOM 14 HD2 PRO A 19 -12.115 -13.065 -38.830 1.00180.32 H ATOM 15 HD3 PRO A 19 -13.880 -12.957 -38.841 1.00180.32 H ATOM 16 N ARG A 20 -10.918 -11.719 -35.018 1.00155.13 N ANISOU 16 N ARG A 20 20187 21369 17387 1048 1055 1340 ATOM 17 CA ARG A 20 -9.787 -11.059 -34.341 1.00134.35 C ANISOU 17 CA ARG A 20 17698 18328 15020 1042 1199 1332 ATOM 18 C ARG A 20 -9.194 -11.870 -33.161 1.00120.55 C ANISOU 18 C ARG A 20 16019 16299 13487 883 1099 1053 ATOM 19 O ARG A 20 -9.926 -12.353 -32.288 1.00113.35 O ANISOU 19 O ARG A 20 15113 15327 12628 855 994 986 ATOM 20 CB ARG A 20 -10.158 -9.623 -33.903 1.00136.55 C ANISOU 20 CB ARG A 20 18056 18408 15419 1215 1409 1601 ATOM 21 CG ARG A 20 -11.294 -9.522 -32.862 1.00153.81 C ANISOU 21 CG ARG A 20 20247 20525 17669 1286 1376 1686 ATOM 22 CD ARG A 20 -12.560 -8.825 -33.387 1.00166.36 C ANISOU 22 CD ARG A 20 21751 22411 19048 1514 1429 2008 ATOM 23 NE ARG A 20 -13.685 -8.960 -32.439 1.00170.30 N ANISOU 23 NE ARG A 20 22202 22961 19543 1519 1297 1986 ATOM 24 CZ ARG A 20 -14.475 -10.045 -32.293 1.00160.35 C ANISOU 24 CZ ARG A 20 20819 21996 18110 1429 1085 1840 ATOM 25 NH1 ARG A 20 -14.307 -11.148 -33.043 1.00160.69 N ANISOU 25 NH1 ARG A 20 20762 22339 17954 1325 981 1698 ATOM 26 NH2 ARG A 20 -15.445 -10.025 -31.373 1.00151.92 N1+ ANISOU 26 NH2 ARG A 20 19728 20920 17074 1429 1003 1822 ATOM 27 H ARG A 20 -11.669 -11.153 -35.381 1.00155.13 H ATOM 28 HA ARG A 20 -9.010 -10.973 -35.103 1.00134.35 H ATOM 29 HB3 ARG A 20 -10.381 -9.009 -34.778 1.00136.55 H ATOM 30 HB2 ARG A 20 -9.258 -9.165 -33.481 1.00136.55 H ATOM 31 HG3 ARG A 20 -10.888 -8.902 -32.059 1.00153.81 H ATOM 32 HG2 ARG A 20 -11.527 -10.471 -32.376 1.00153.81 H ATOM 33 HD3 ARG A 20 -12.817 -9.116 -34.408 1.00166.36 H ATOM 34 HD2 ARG A 20 -12.365 -7.750 -33.424 1.00166.36 H ATOM 35 HH22 ARG A 20 -15.895 -10.886 -31.084 1.00151.92 H ATOM 36 HH21 ARG A 20 -15.682 -9.185 -30.864 1.00151.92 H ATOM 37 HH12 ARG A 20 -14.949 -11.935 -33.040 1.00160.69 H ATOM 38 HH11 ARG A 20 -13.507 -11.223 -33.652 1.00160.69 H ATOM 39 HE ARG A 20 -13.827 -8.161 -31.832 1.00170.30 H ATOM 40 N THR A 21 -7.869 -11.983 -33.178 1.00107.32 N ANISOU 40 N THR A 21 14384 14481 11913 797 1145 904 ATOM 41 CA THR A 21 -7.065 -12.660 -32.180 1.00105.93 C ANISOU 41 CA THR A 21 14253 14080 11916 683 1082 654 ATOM 42 C THR A 21 -6.252 -11.589 -31.445 1.00103.87 C ANISOU 42 C THR A 21 14055 13547 11863 698 1228 659 ATOM 43 O THR A 21 -5.808 -10.632 -32.084 1.00101.35 O ANISOU 43 O THR A 21 13761 13179 11569 738 1421 775 ATOM 44 CB THR A 21 -6.134 -13.669 -32.898 1.00106.21 C ANISOU 44 CB THR A 21 14260 14191 11904 586 1053 476 ATOM 45 OG1 THR A 21 -6.967 -14.668 -33.469 1.00112.97 O ANISOU 45 OG1 THR A 21 15050 15294 12577 544 943 439 ATOM 46 CG2 THR A 21 -5.081 -14.365 -32.023 1.00109.54 C ANISOU 46 CG2 THR A 21 14710 14418 12492 515 1003 247 ATOM 47 H THR A 21 -7.320 -11.494 -33.870 1.00107.32 H ATOM 48 HA THR A 21 -7.692 -13.179 -31.459 1.00105.93 H ATOM 49 HB THR A 21 -5.611 -13.170 -33.719 1.00106.21 H ATOM 50 HG1 THR A 21 -7.399 -14.317 -34.256 1.00112.97 H ATOM 51 HG21 THR A 21 -4.496 -15.085 -32.601 1.00109.54 H ATOM 52 HG22 THR A 21 -4.362 -13.659 -31.603 1.00109.54 H ATOM 53 HG23 THR A 21 -5.548 -14.900 -31.196 1.00109.54 H ATOM 54 N VAL A 22 -6.134 -11.725 -30.121 1.00 96.92 N ANISOU 54 N VAL A 22 13195 12507 11122 658 1161 524 ATOM 55 CA VAL A 22 -5.444 -10.768 -29.269 1.00 90.17 C ANISOU 55 CA VAL A 22 12368 11434 10457 633 1304 464 ATOM 56 C VAL A 22 -4.464 -11.521 -28.362 1.00 88.37 C ANISOU 56 C VAL A 22 12107 11162 10308 558 1192 207 ATOM 57 O VAL A 22 -4.593 -12.731 -28.165 1.00 97.63 O ANISOU 57 O VAL A 22 13269 12416 11412 561 1020 138 ATOM 58 CB VAL A 22 -6.439 -9.947 -28.398 1.00 95.31 C ANISOU 58 CB VAL A 22 13054 11981 11178 694 1374 603 ATOM 59 CG1 VAL A 22 -7.463 -9.221 -29.292 1.00 98.86 C ANISOU 59 CG1 VAL A 22 13517 12542 11504 826 1452 897 ATOM 60 CG2 VAL A 22 -7.125 -10.718 -27.244 1.00 92.33 C ANISOU 60 CG2 VAL A 22 12667 11610 10804 680 1182 513 ATOM 61 H VAL A 22 -6.493 -12.553 -29.640 1.00 96.92 H ATOM 62 HA VAL A 22 -4.851 -10.081 -29.877 1.00 90.17 H ATOM 63 HB VAL A 22 -5.851 -9.162 -27.919 1.00 95.31 H ATOM 64 HG11 VAL A 22 -8.084 -8.530 -28.726 1.00 98.86 H ATOM 65 HG12 VAL A 22 -6.960 -8.647 -30.069 1.00 98.86 H ATOM 66 HG13 VAL A 22 -8.129 -9.927 -29.790 1.00 98.86 H ATOM 67 HG21 VAL A 22 -7.811 -10.080 -26.688 1.00 92.33 H ATOM 68 HG22 VAL A 22 -7.680 -11.584 -27.603 1.00 92.33 H ATOM 69 HG23 VAL A 22 -6.407 -11.085 -26.510 1.00 92.33 H ATOM 70 N MET A 23 -3.500 -10.772 -27.834 1.00 86.99 N ANISOU 70 N MET A 23 11911 10868 10272 501 1315 77 ATOM 71 CA MET A 23 -2.454 -11.256 -26.957 1.00 93.88 C ANISOU 71 CA MET A 23 12714 11753 11204 452 1230 -167 ATOM 72 C MET A 23 -2.796 -10.809 -25.529 1.00 98.74 C ANISOU 72 C MET A 23 13316 12306 11895 447 1223 -211 ATOM 73 O MET A 23 -3.169 -9.648 -25.350 1.00 89.30 O ANISOU 73 O MET A 23 12155 10993 10783 424 1394 -132 ATOM 74 CB MET A 23 -1.141 -10.655 -27.491 1.00 97.64 C ANISOU 74 CB MET A 23 13137 12201 11760 365 1398 -322 ATOM 75 CG MET A 23 0.111 -11.178 -26.795 1.00115.98 C ANISOU 75 CG MET A 23 15354 14632 14081 343 1289 -564 ATOM 76 SD MET A 23 1.640 -10.832 -27.706 1.00118.24 S ANISOU 76 SD MET A 23 15579 14939 14408 248 1450 -722 ATOM 77 CE MET A 23 1.720 -9.027 -27.541 1.00102.64 C ANISOU 77 CE MET A 23 13633 12781 12583 132 1777 -724 ATOM 78 H MET A 23 -3.496 -9.765 -27.999 1.00 86.99 H ATOM 79 HA MET A 23 -2.394 -12.344 -27.007 1.00 93.88 H ATOM 80 HB3 MET A 23 -1.170 -9.569 -27.389 1.00 97.64 H ATOM 81 HB2 MET A 23 -1.052 -10.856 -28.560 1.00 97.64 H ATOM 82 HG3 MET A 23 0.034 -12.260 -26.677 1.00115.98 H ATOM 83 HG2 MET A 23 0.186 -10.748 -25.796 1.00115.98 H ATOM 84 HE1 MET A 23 2.667 -8.662 -27.940 1.00102.64 H ATOM 85 HE2 MET A 23 0.912 -8.541 -28.086 1.00102.64 H ATOM 86 HE3 MET A 23 1.652 -8.730 -26.493 1.00102.64 H ATOM 87 N VAL A 24 -2.692 -11.716 -24.552 1.00 95.13 N ANISOU 87 N VAL A 24 12811 11926 11408 477 1054 -328 ATOM 88 CA VAL A 24 -3.033 -11.445 -23.155 1.00 97.11 C ANISOU 88 CA VAL A 24 13036 12167 11694 479 1017 -380 ATOM 89 C VAL A 24 -1.864 -11.868 -22.251 1.00 93.93 C ANISOU 89 C VAL A 24 12507 11908 11276 480 940 -609 ATOM 90 O VAL A 24 -1.415 -13.007 -22.351 1.00101.93 O ANISOU 90 O VAL A 24 13507 13016 12206 574 796 -624 ATOM 91 CB VAL A 24 -4.302 -12.227 -22.692 1.00 95.00 C ANISOU 91 CB VAL A 24 12844 11898 11352 563 863 -229 ATOM 92 CG1 VAL A 24 -4.721 -11.904 -21.236 1.00 97.04 C ANISOU 92 CG1 VAL A 24 13082 12143 11646 559 845 -271 ATOM 93 CG2 VAL A 24 -5.503 -11.993 -23.631 1.00 96.12 C ANISOU 93 CG2 VAL A 24 13071 11996 11456 585 897 -12 ATOM 94 H VAL A 24 -2.354 -12.655 -24.767 1.00 95.13 H ATOM 95 HA VAL A 24 -3.230 -10.386 -23.017 1.00 97.11 H ATOM 96 HB VAL A 24 -4.077 -13.294 -22.729 1.00 95.00 H ATOM 97 HG11 VAL A 24 -5.635 -12.432 -20.955 1.00 97.04 H ATOM 98 HG12 VAL A 24 -3.961 -12.189 -20.510 1.00 97.04 H ATOM 99 HG13 VAL A 24 -4.898 -10.836 -21.103 1.00 97.04 H ATOM 100 HG21 VAL A 24 -6.402 -12.491 -23.265 1.00 96.12 H ATOM 101 HG22 VAL A 24 -5.728 -10.930 -23.725 1.00 96.12 H ATOM 102 HG23 VAL A 24 -5.307 -12.378 -24.633 1.00 96.12 H ATOM 103 N ASN A 25 -1.415 -10.978 -21.359 1.00 91.58 N ANISOU 103 N ASN A 25 12111 11640 11045 391 1045 -781 ATOM 104 CA ASN A 25 -0.553 -11.305 -20.216 1.00 97.53 C ANISOU 104 CA ASN A 25 12705 12612 11739 409 953 -997 ATOM 105 C ASN A 25 -1.435 -11.835 -19.072 1.00 96.68 C ANISOU 105 C ASN A 25 12630 12548 11556 513 799 -904 ATOM 106 O ASN A 25 -2.297 -11.092 -18.598 1.00101.06 O ANISOU 106 O ASN A 25 13206 13026 12167 444 872 -892 ATOM 107 CB ASN A 25 0.251 -10.050 -19.785 1.00 90.00 C ANISOU 107 CB ASN A 25 11613 11712 10873 234 1149 -1258 ATOM 108 CG ASN A 25 1.264 -10.292 -18.658 1.00 97.86 C ANISOU 108 CG ASN A 25 12392 13027 11764 251 1051 -1510 ATOM 109 OD1 ASN A 25 1.495 -11.421 -18.223 1.00113.31 O ANISOU 109 OD1 ASN A 25 14313 15153 13585 431 844 -1454 ATOM 110 ND2 ASN A 25 1.873 -9.223 -18.158 1.00110.59 N ANISOU 110 ND2 ASN A 25 13851 14739 13428 74 1216 -1784 ATOM 111 H ASN A 25 -1.815 -10.042 -21.400 1.00 91.58 H ATOM 112 HA ASN A 25 0.159 -12.084 -20.491 1.00 97.53 H ATOM 113 HB3 ASN A 25 -0.428 -9.258 -19.465 1.00 90.00 H ATOM 114 HB2 ASN A 25 0.800 -9.654 -20.641 1.00 90.00 H ATOM 115 HD22 ASN A 25 2.497 -9.311 -17.372 1.00110.59 H ATOM 116 HD21 ASN A 25 1.699 -8.294 -18.530 1.00110.59 H ATOM 117 N LEU A 26 -1.225 -13.095 -18.659 1.00 98.51 N ANISOU 117 N LEU A 26 12869 12885 11675 676 622 -843 ATOM 118 CA LEU A 26 -1.987 -13.768 -17.600 1.00106.37 C ANISOU 118 CA LEU A 26 13914 13907 12594 789 499 -738 ATOM 119 C LEU A 26 -1.470 -13.469 -16.177 1.00114.49 C ANISOU 119 C LEU A 26 14775 15169 13555 791 476 -911 ATOM 120 O LEU A 26 -2.028 -14.031 -15.234 1.00112.34 O ANISOU 120 O LEU A 26 14530 14955 13198 900 376 -828 ATOM 121 CB LEU A 26 -1.997 -15.305 -17.831 1.00101.12 C ANISOU 121 CB LEU A 26 13326 13250 11845 968 381 -617 ATOM 122 CG LEU A 26 -2.632 -15.809 -19.148 1.00106.41 C ANISOU 122 CG LEU A 26 14145 13730 12554 947 403 -478 ATOM 123 CD1 LEU A 26 -2.630 -17.349 -19.209 1.00107.44 C ANISOU 123 CD1 LEU A 26 14355 13844 12622 1103 337 -395 ATOM 124 CD2 LEU A 26 -4.066 -15.284 -19.346 1.00106.69 C ANISOU 124 CD2 LEU A 26 14293 13608 12634 859 437 -344 ATOM 125 H LEU A 26 -0.489 -13.646 -19.104 1.00 98.51 H ATOM 126 HA LEU A 26 -3.017 -13.402 -17.614 1.00106.37 H ATOM 127 HB3 LEU A 26 -2.526 -15.776 -17.002 1.00101.12 H ATOM 128 HB2 LEU A 26 -0.969 -15.663 -17.764 1.00101.12 H ATOM 129 HG LEU A 26 -2.020 -15.442 -19.974 1.00106.41 H ATOM 130 HD11 LEU A 26 -3.305 -17.718 -19.981 1.00107.44 H ATOM 131 HD12 LEU A 26 -1.637 -17.734 -19.436 1.00107.44 H ATOM 132 HD13 LEU A 26 -2.953 -17.795 -18.269 1.00107.44 H ATOM 133 HD21 LEU A 26 -4.539 -15.717 -20.228 1.00106.69 H ATOM 134 HD22 LEU A 26 -4.693 -15.519 -18.485 1.00106.69 H ATOM 135 HD23 LEU A 26 -4.079 -14.204 -19.484 1.00106.69 H ATOM 136 N ASN A 27 -0.423 -12.644 -16.011 1.00121.28 N ANISOU 136 N ASN A 27 15457 16185 14439 667 574 -1159 ATOM 137 CA ASN A 27 0.029 -12.202 -14.683 1.00120.98 C ANISOU 137 CA ASN A 27 15217 16427 14324 618 578 -1383 ATOM 138 C ASN A 27 -0.917 -11.098 -14.186 1.00121.75 C ANISOU 138 C ASN A 27 15373 16363 14525 460 699 -1392 ATOM 139 O ASN A 27 -0.798 -9.949 -14.614 1.00121.47 O ANISOU 139 O ASN A 27 15360 16144 14648 272 909 -1474 ATOM 140 CB ASN A 27 1.515 -11.760 -14.723 1.00126.47 C ANISOU 140 CB ASN A 27 15673 17369 15010 492 678 -1707 ATOM 141 CG ASN A 27 2.475 -12.897 -14.370 1.00136.55 C ANISOU 141 CG ASN A 27 16762 19034 16085 693 513 -1779 ATOM 142 OD1 ASN A 27 2.256 -13.617 -13.403 1.00155.98 O ANISOU 142 OD1 ASN A 27 19119 21754 18392 805 406 -1795 ATOM 143 ND2 ASN A 27 3.559 -13.080 -15.110 1.00141.29 N ANISOU 143 ND2 ASN A 27 17334 19676 16675 774 489 -1783 ATOM 144 H ASN A 27 -0.024 -12.174 -16.816 1.00121.28 H ATOM 145 HA ASN A 27 -0.055 -13.084 -14.042 1.00120.98 H ATOM 146 HB3 ASN A 27 1.693 -11.020 -13.944 1.00126.47 H ATOM 147 HB2 ASN A 27 1.785 -11.278 -15.662 1.00126.47 H ATOM 148 HD22 ASN A 27 4.210 -13.799 -14.834 1.00141.29 H ATOM 149 HD21 ASN A 27 3.824 -12.460 -15.877 1.00141.29 H ATOM 150 N ILE A 28 -1.854 -11.510 -13.326 1.00124.29 N ANISOU 150 N ILE A 28 15715 16752 14759 544 594 -1313 ATOM 151 CA ILE A 28 -2.966 -10.711 -12.807 1.00122.94 C ANISOU 151 CA ILE A 28 15646 16381 14686 437 683 -1249 ATOM 152 C ILE A 28 -2.516 -9.481 -11.994 1.00129.66 C ANISOU 152 C ILE A 28 16311 17378 15577 227 849 -1563 ATOM 153 O ILE A 28 -1.544 -9.573 -11.245 1.00120.29 O ANISOU 153 O ILE A 28 14896 16561 14247 230 796 -1798 ATOM 154 CB ILE A 28 -3.945 -11.612 -11.986 1.00115.84 C ANISOU 154 CB ILE A 28 14857 15478 13680 606 514 -1036 ATOM 155 CG1 ILE A 28 -4.662 -12.590 -12.948 1.00105.17 C ANISOU 155 CG1 ILE A 28 13707 13905 12347 732 436 -767 ATOM 156 CG2 ILE A 28 -4.990 -10.858 -11.126 1.00118.34 C ANISOU 156 CG2 ILE A 28 15215 15682 14065 495 593 -1034 ATOM 157 CD1 ILE A 28 -5.356 -13.777 -12.269 1.00100.79 C ANISOU 157 CD1 ILE A 28 13264 13342 11690 897 303 -583 ATOM 158 H ILE A 28 -1.890 -12.495 -13.112 1.00124.29 H ATOM 159 HA ILE A 28 -3.490 -10.362 -13.690 1.00122.94 H ATOM 160 HB ILE A 28 -3.337 -12.202 -11.296 1.00115.84 H ATOM 161 HG13 ILE A 28 -3.947 -13.001 -13.662 1.00105.17 H ATOM 162 HG12 ILE A 28 -5.383 -12.034 -13.552 1.00105.17 H ATOM 163 HG21 ILE A 28 -5.638 -11.554 -10.592 1.00118.34 H ATOM 164 HG22 ILE A 28 -4.528 -10.232 -10.363 1.00118.34 H ATOM 165 HG23 ILE A 28 -5.623 -10.220 -11.747 1.00118.34 H ATOM 166 HD11 ILE A 28 -5.656 -14.516 -13.013 1.00100.79 H ATOM 167 HD12 ILE A 28 -4.697 -14.277 -11.559 1.00100.79 H ATOM 168 HD13 ILE A 28 -6.261 -13.472 -11.743 1.00100.79 H ATOM 169 N HIS A 29 -3.260 -8.363 -12.151 1.00142.54 N ANISOU 169 N HIS A 29 18028 18735 17396 56 1069 -1571 ATOM 170 CA HIS A 29 -3.165 -6.986 -11.584 1.00168.57 C ANISOU 170 CA HIS A 29 21211 22050 20789 -175 1297 -1842 ATOM 171 C HIS A 29 -2.157 -6.844 -10.435 1.00174.02 C ANISOU 171 C HIS A 29 21633 23204 21283 -209 1204 -2141 ATOM 172 O HIS A 29 -1.124 -6.190 -10.551 1.00159.33 O ANISOU 172 O HIS A 29 19562 21563 19415 -369 1331 -2475 ATOM 173 CB HIS A 29 -4.603 -6.480 -11.222 1.00166.28 C ANISOU 173 CB HIS A 29 21096 21464 20620 -187 1379 -1649 ATOM 174 CG HIS A 29 -5.046 -6.425 -9.775 1.00173.85 C ANISOU 174 CG HIS A 29 21964 22584 21509 -245 1356 -1778 ATOM 175 ND1 HIS A 29 -5.107 -7.530 -8.947 1.00174.01 N ANISOU 175 ND1 HIS A 29 21934 22877 21304 -81 1085 -1715 ATOM 176 CD2 HIS A 29 -5.455 -5.362 -9.004 1.00175.84 C ANISOU 176 CD2 HIS A 29 22175 22753 21884 -441 1587 -1958 ATOM 177 CE1 HIS A 29 -5.533 -7.110 -7.753 1.00170.18 C ANISOU 177 CE1 HIS A 29 21369 22504 20788 -178 1130 -1855 ATOM 178 NE2 HIS A 29 -5.753 -5.805 -7.715 1.00166.09 N ANISOU 178 NE2 HIS A 29 20849 21770 20487 -411 1436 -2021 ATOM 179 H HIS A 29 -3.959 -8.456 -12.883 1.00142.54 H ATOM 180 HA HIS A 29 -2.799 -6.352 -12.397 1.00168.57 H ATOM 181 HXT HIS A 29 -2.409 -7.384 -9.519 1.00174.02 H ATOM 182 HB3 HIS A 29 -5.369 -7.049 -11.748 1.00166.28 H ATOM 183 HB2 HIS A 29 -4.725 -5.464 -11.600 1.00166.28 H ATOM 184 HD1 HIS A 29 -4.882 -8.477 -9.206 1.00174.01 H ATOM 185 HD2 HIS A 29 -5.559 -4.322 -9.276 1.00175.84 H ATOM 186 HE1 HIS A 29 -5.691 -7.753 -6.897 1.00170.18 H ATOM 187 N SER A 40 -18.436 -10.701 5.136 1.00119.26 N ANISOU 187 N SER A 40 15779 16179 13356 218 493 -721 ATOM 188 CA SER A 40 -19.152 -11.018 3.865 1.00133.30 C ANISOU 188 CA SER A 40 17731 17591 15324 275 486 -523 ATOM 189 C SER A 40 -18.962 -12.500 3.436 1.00129.04 C ANISOU 189 C SER A 40 17312 17077 14639 511 363 -299 ATOM 190 O SER A 40 -19.820 -13.052 2.743 1.00 99.25 O ANISOU 190 O SER A 40 13713 13021 10977 561 359 -121 ATOM 191 CB SER A 40 -18.858 -10.031 2.701 1.00143.22 C ANISOU 191 CB SER A 40 18908 18707 16800 148 585 -647 ATOM 192 OG SER A 40 -17.520 -10.069 2.229 1.00158.47 O ANISOU 192 OG SER A 40 20816 20709 18687 254 511 -613 ATOM 193 H1 SER A 40 -18.294 -9.707 5.262 1.00119.26 H ATOM 194 H2 SER A 40 -18.931 -11.043 5.953 1.00119.26 H ATOM 195 HA SER A 40 -20.213 -10.923 4.069 1.00133.30 H ATOM 196 HB3 SER A 40 -19.087 -9.010 3.006 1.00143.22 H ATOM 197 HB2 SER A 40 -19.512 -10.242 1.854 1.00143.22 H ATOM 198 HG SER A 40 -17.409 -10.846 1.674 1.00158.47 H ATOM 199 N SER A 41 -17.854 -13.112 3.872 1.00124.81 N ANISOU 199 N SER A 41 16683 16884 13854 660 283 -309 ATOM 200 CA SER A 41 -17.408 -14.486 3.672 1.00132.96 C ANISOU 200 CA SER A 41 17827 17967 14726 927 204 -83 ATOM 201 C SER A 41 -18.474 -15.567 3.945 1.00134.34 C ANISOU 201 C SER A 41 18258 17863 14925 1005 242 149 ATOM 202 O SER A 41 -18.388 -16.655 3.387 1.00126.72 O ANISOU 202 O SER A 41 17449 16688 14011 1119 249 316 ATOM 203 CB SER A 41 -16.231 -14.706 4.647 1.00136.47 C ANISOU 203 CB SER A 41 18107 18890 14857 1099 134 -116 ATOM 204 OG SER A 41 -15.199 -13.757 4.421 1.00131.62 O ANISOU 204 OG SER A 41 17298 18505 14205 1112 87 -261 ATOM 205 H SER A 41 -17.228 -12.529 4.419 1.00124.81 H ATOM 206 HA SER A 41 -17.073 -14.596 2.642 1.00132.96 H ATOM 207 HB3 SER A 41 -15.829 -15.717 4.550 1.00136.47 H ATOM 208 HB2 SER A 41 -16.573 -14.604 5.678 1.00136.47 H ATOM 209 HG SER A 41 -14.475 -14.170 3.942 1.00131.62 H ATOM 210 N ASP A 42 -19.413 -15.269 4.842 1.00112.19 N ANISOU 210 N ASP A 42 15486 15047 12094 920 288 132 ATOM 211 CA ASP A 42 -20.320 -16.198 5.505 1.00112.66 C ANISOU 211 CA ASP A 42 15757 14955 12092 1010 343 327 ATOM 212 C ASP A 42 -21.759 -16.108 4.970 1.00106.13 C ANISOU 212 C ASP A 42 15063 13772 11490 828 420 330 ATOM 213 O ASP A 42 -22.629 -16.796 5.505 1.00116.24 O ANISOU 213 O ASP A 42 16480 14969 12717 844 485 424 ATOM 214 CB ASP A 42 -20.320 -15.983 7.034 1.00121.71 C ANISOU 214 CB ASP A 42 16831 16413 13001 1065 341 306 ATOM 215 CG ASP A 42 -20.733 -14.604 7.553 1.00137.75 C ANISOU 215 CG ASP A 42 18670 18578 15091 821 349 39 ATOM 216 OD1 ASP A 42 -20.703 -13.587 6.820 1.00127.30 O ANISOU 216 OD1 ASP A 42 17272 17095 13999 636 373 -112 ATOM 217 OD2 ASP A 42 -21.048 -14.542 8.754 1.00156.23 O1- ANISOU 217 OD2 ASP A 42 20927 21195 17238 826 352 -19 ATOM 218 H ASP A 42 -19.452 -14.340 5.254 1.00112.19 H ATOM 219 HA ASP A 42 -19.986 -17.221 5.326 1.00112.66 H ATOM 220 HB3 ASP A 42 -19.313 -16.151 7.409 1.00121.71 H ATOM 221 HB2 ASP A 42 -20.934 -16.740 7.519 1.00121.71 H ATOM 222 N TYR A 43 -22.024 -15.317 3.918 1.00 90.39 N ANISOU 222 N TYR A 43 13026 11600 9718 680 424 246 ATOM 223 CA TYR A 43 -23.362 -15.188 3.322 1.00 91.04 C ANISOU 223 CA TYR A 43 13198 11404 9989 543 486 262 ATOM 224 C TYR A 43 -23.960 -16.513 2.815 1.00 86.09 C ANISOU 224 C TYR A 43 12775 10597 9338 624 533 419 ATOM 225 O TYR A 43 -25.173 -16.673 2.870 1.00 88.84 O ANISOU 225 O TYR A 43 13231 10806 9718 549 611 446 ATOM 226 CB TYR A 43 -23.350 -14.195 2.157 1.00 94.02 C ANISOU 226 CB TYR A 43 13477 11681 10564 439 484 186 ATOM 227 CG TYR A 43 -23.027 -12.746 2.451 1.00 90.29 C ANISOU 227 CG TYR A 43 12832 11311 10162 326 518 15 ATOM 228 CD1 TYR A 43 -23.105 -12.177 3.741 1.00 94.82 C ANISOU 228 CD1 TYR A 43 13338 12045 10647 268 546 -94 ATOM 229 CD2 TYR A 43 -22.661 -11.940 1.359 1.00 83.39 C ANISOU 229 CD2 TYR A 43 11864 10385 9437 272 549 -51 ATOM 230 CE1 TYR A 43 -22.853 -10.802 3.922 1.00 84.93 C ANISOU 230 CE1 TYR A 43 11923 10880 9468 133 619 -293 ATOM 231 CE2 TYR A 43 -22.386 -10.583 1.544 1.00 84.95 C ANISOU 231 CE2 TYR A 43 11918 10632 9726 150 643 -227 ATOM 232 CZ TYR A 43 -22.492 -10.005 2.821 1.00 90.78 C ANISOU 232 CZ TYR A 43 12586 11515 10390 67 685 -363 ATOM 233 OH TYR A 43 -22.240 -8.673 2.969 1.00 94.88 O ANISOU 233 OH TYR A 43 12965 12073 11014 -84 818 -574 ATOM 234 H TYR A 43 -21.289 -14.710 3.561 1.00 90.39 H ATOM 235 HA TYR A 43 -24.044 -14.822 4.091 1.00 91.04 H ATOM 236 HB3 TYR A 43 -24.335 -14.183 1.689 1.00 94.02 H ATOM 237 HB2 TYR A 43 -22.660 -14.551 1.390 1.00 94.02 H ATOM 238 HD1 TYR A 43 -23.355 -12.769 4.608 1.00 94.82 H ATOM 239 HD2 TYR A 43 -22.583 -12.365 0.371 1.00 83.39 H ATOM 240 HE1 TYR A 43 -22.926 -10.368 4.905 1.00 84.93 H ATOM 241 HE2 TYR A 43 -22.113 -10.001 0.682 1.00 84.95 H ATOM 242 HH TYR A 43 -22.527 -8.318 3.814 1.00 94.88 H ATOM 243 N TYR A 44 -23.113 -17.459 2.384 1.00 92.15 N ANISOU 243 N TYR A 44 13602 11360 10051 766 517 509 ATOM 244 CA TYR A 44 -23.549 -18.799 1.985 1.00104.51 C ANISOU 244 CA TYR A 44 15370 12716 11625 822 615 632 ATOM 245 C TYR A 44 -24.188 -19.587 3.154 1.00100.70 C ANISOU 245 C TYR A 44 15034 12190 11039 863 724 717 ATOM 246 O TYR A 44 -24.953 -20.514 2.894 1.00116.15 O ANISOU 246 O TYR A 44 17164 13919 13047 830 861 770 ATOM 247 CB TYR A 44 -22.360 -19.560 1.348 1.00102.79 C ANISOU 247 CB TYR A 44 15188 12513 11355 997 604 718 ATOM 248 CG TYR A 44 -21.299 -20.073 2.310 1.00105.15 C ANISOU 248 CG TYR A 44 15492 13014 11446 1236 593 830 ATOM 249 CD1 TYR A 44 -21.326 -21.415 2.738 1.00123.04 C ANISOU 249 CD1 TYR A 44 17957 15174 13617 1423 730 1014 ATOM 250 CD2 TYR A 44 -20.300 -19.211 2.803 1.00108.57 C ANISOU 250 CD2 TYR A 44 15722 13765 11766 1281 472 748 ATOM 251 CE1 TYR A 44 -20.396 -21.884 3.682 1.00122.12 C ANISOU 251 CE1 TYR A 44 17835 15285 13279 1696 729 1159 ATOM 252 CE2 TYR A 44 -19.363 -19.681 3.744 1.00112.19 C ANISOU 252 CE2 TYR A 44 16142 14496 11989 1517 450 845 ATOM 253 CZ TYR A 44 -19.421 -21.012 4.194 1.00124.93 C ANISOU 253 CZ TYR A 44 17954 16024 13490 1748 570 1073 ATOM 254 OH TYR A 44 -18.542 -21.468 5.129 1.00114.50 O ANISOU 254 OH TYR A 44 16586 15008 11909 2034 556 1209 ATOM 255 H TYR A 44 -22.120 -17.278 2.390 1.00 92.15 H ATOM 256 HA TYR A 44 -24.325 -18.680 1.226 1.00104.51 H ATOM 257 HB3 TYR A 44 -21.882 -18.946 0.583 1.00102.79 H ATOM 258 HB2 TYR A 44 -22.761 -20.420 0.809 1.00102.79 H ATOM 259 HD1 TYR A 44 -22.077 -22.082 2.356 1.00123.04 H ATOM 260 HD2 TYR A 44 -20.241 -18.186 2.469 1.00108.57 H ATOM 261 HE1 TYR A 44 -20.434 -22.909 4.020 1.00122.12 H ATOM 262 HE2 TYR A 44 -18.601 -19.011 4.114 1.00112.19 H ATOM 263 HH TYR A 44 -17.874 -20.828 5.382 1.00114.50 H ATOM 264 N ASN A 45 -23.860 -19.194 4.396 1.00 88.21 N ANISOU 264 N ASN A 45 13375 10825 9316 915 683 708 ATOM 265 CA ASN A 45 -24.321 -19.777 5.653 1.00 96.68 C ANISOU 265 CA ASN A 45 14576 11926 10232 1008 780 819 ATOM 266 C ASN A 45 -25.502 -18.979 6.208 1.00 86.60 C ANISOU 266 C ASN A 45 13261 10643 9001 817 799 709 ATOM 267 O ASN A 45 -26.498 -19.598 6.559 1.00 91.73 O ANISOU 267 O ASN A 45 14065 11156 9631 796 924 773 ATOM 268 CB ASN A 45 -23.150 -19.797 6.685 1.00111.65 C ANISOU 268 CB ASN A 45 16397 14151 11873 1243 723 907 ATOM 269 CG ASN A 45 -22.587 -21.180 7.024 1.00125.03 C ANISOU 269 CG ASN A 45 18294 15787 13425 1521 853 1159 ATOM 270 OD1 ASN A 45 -23.054 -22.211 6.549 1.00123.52 O ANISOU 270 OD1 ASN A 45 18322 15266 13344 1512 1018 1251 ATOM 271 ND2 ASN A 45 -21.579 -21.226 7.888 1.00140.80 N ANISOU 271 ND2 ASN A 45 20212 18118 15167 1774 805 1268 ATOM 272 H ASN A 45 -23.277 -18.372 4.490 1.00 88.21 H ATOM 273 HA ASN A 45 -24.673 -20.787 5.439 1.00 96.68 H ATOM 274 HB3 ASN A 45 -23.454 -19.356 7.636 1.00111.65 H ATOM 275 HB2 ASN A 45 -22.322 -19.176 6.343 1.00111.65 H ATOM 276 HD22 ASN A 45 -21.174 -22.120 8.128 1.00140.80 H ATOM 277 HD21 ASN A 45 -21.216 -20.389 8.320 1.00140.80 H ATOM 278 N ARG A 46 -25.370 -17.645 6.299 1.00 77.81 N ANISOU 278 N ARG A 46 11953 9651 7962 675 705 540 ATOM 279 CA ARG A 46 -26.384 -16.793 6.934 1.00 77.97 C ANISOU 279 CA ARG A 46 11913 9679 8035 501 733 422 ATOM 280 C ARG A 46 -27.578 -16.443 6.028 1.00 76.83 C ANISOU 280 C ARG A 46 11785 9290 8117 324 776 361 ATOM 281 O ARG A 46 -28.495 -15.784 6.516 1.00 72.74 O ANISOU 281 O ARG A 46 11226 8745 7666 186 817 275 ATOM 282 CB ARG A 46 -25.731 -15.501 7.476 1.00 89.64 C ANISOU 282 CB ARG A 46 13164 11414 9482 452 651 262 ATOM 283 CG ARG A 46 -24.911 -15.707 8.763 1.00 97.97 C ANISOU 283 CG ARG A 46 14149 12807 10269 571 622 263 ATOM 284 CD ARG A 46 -24.588 -14.396 9.508 1.00103.59 C ANISOU 284 CD ARG A 46 14623 13749 10988 416 597 18 ATOM 285 NE ARG A 46 -23.702 -13.509 8.731 1.00108.48 N ANISOU 285 NE ARG A 46 15073 14435 11709 363 551 -125 ATOM 286 CZ ARG A 46 -23.882 -12.300 8.200 1.00106.43 C ANISOU 286 CZ ARG A 46 14687 14092 11661 163 609 -320 ATOM 287 NH1 ARG A 46 -25.058 -11.683 8.283 1.00 95.68 N ANISOU 287 NH1 ARG A 46 13337 12569 10447 4 703 -391 ATOM 288 NH2 ARG A 46 -22.859 -11.719 7.575 1.00101.58 N1+ ANISOU 288 NH2 ARG A 46 13932 13552 11110 128 599 -445 ATOM 289 H ARG A 46 -24.518 -17.198 5.974 1.00 77.81 H ATOM 290 HA ARG A 46 -26.830 -17.335 7.774 1.00 77.97 H ATOM 291 HB3 ARG A 46 -26.513 -14.784 7.728 1.00 89.64 H ATOM 292 HB2 ARG A 46 -25.133 -15.023 6.698 1.00 89.64 H ATOM 293 HG3 ARG A 46 -24.006 -16.288 8.575 1.00 97.97 H ATOM 294 HG2 ARG A 46 -25.516 -16.307 9.445 1.00 97.97 H ATOM 295 HD3 ARG A 46 -24.054 -14.628 10.434 1.00103.59 H ATOM 296 HD2 ARG A 46 -25.507 -13.908 9.826 1.00103.59 H ATOM 297 HH22 ARG A 46 -22.855 -10.772 7.242 1.00101.58 H ATOM 298 HH21 ARG A 46 -22.000 -12.282 7.398 1.00101.58 H ATOM 299 HH12 ARG A 46 -25.257 -10.759 7.945 1.00 95.68 H ATOM 300 HH11 ARG A 46 -25.842 -12.166 8.739 1.00 95.68 H ATOM 301 HE ARG A 46 -22.724 -13.881 8.718 1.00108.48 H ATOM 302 N SER A 47 -27.551 -16.816 4.741 1.00 80.66 N ANISOU 302 N SER A 47 12293 9645 8709 327 762 389 ATOM 303 CA SER A 47 -28.667 -16.587 3.827 1.00 82.84 C ANISOU 303 CA SER A 47 12545 9774 9158 186 790 334 ATOM 304 C SER A 47 -29.890 -17.448 4.189 1.00 83.02 C ANISOU 304 C SER A 47 12707 9664 9172 105 912 344 ATOM 305 O SER A 47 -29.731 -18.604 4.578 1.00 91.65 O ANISOU 305 O SER A 47 13971 10679 10172 183 1000 434 ATOM 306 CB SER A 47 -28.200 -16.805 2.370 1.00 78.08 C ANISOU 306 CB SER A 47 11935 9114 8617 221 754 362 ATOM 307 OG SER A 47 -29.259 -16.742 1.431 1.00 78.29 O ANISOU 307 OG SER A 47 11907 9076 8763 102 776 310 ATOM 308 H SER A 47 -26.773 -17.356 4.389 1.00 80.66 H ATOM 309 HA SER A 47 -28.959 -15.549 3.923 1.00 82.84 H ATOM 310 HB3 SER A 47 -27.698 -17.767 2.268 1.00 78.08 H ATOM 311 HB2 SER A 47 -27.472 -16.040 2.096 1.00 78.08 H ATOM 312 HG SER A 47 -29.154 -15.917 0.913 1.00 78.29 H ATOM 313 N THR A 48 -31.086 -16.900 3.954 1.00 78.18 N ANISOU 313 N THR A 48 12024 9020 8662 -39 942 257 ATOM 314 CA THR A 48 -32.340 -17.649 3.943 1.00 73.73 C ANISOU 314 CA THR A 48 11550 8339 8123 -158 1062 219 ATOM 315 C THR A 48 -32.400 -18.660 2.771 1.00 76.08 C ANISOU 315 C THR A 48 11898 8558 8450 -176 1102 216 ATOM 316 O THR A 48 -33.161 -19.621 2.832 1.00 84.57 O ANISOU 316 O THR A 48 13075 9530 9527 -281 1243 163 ATOM 317 CB THR A 48 -33.540 -16.682 3.799 1.00 70.47 C ANISOU 317 CB THR A 48 10997 7966 7814 -288 1064 119 ATOM 318 OG1 THR A 48 -33.446 -15.926 2.599 1.00 70.97 O ANISOU 318 OG1 THR A 48 10902 8090 7971 -284 988 102 ATOM 319 CG2 THR A 48 -33.647 -15.648 4.925 1.00 65.93 C ANISOU 319 CG2 THR A 48 10354 7456 7238 -295 1047 91 ATOM 320 H THR A 48 -31.153 -15.935 3.634 1.00 78.18 H ATOM 321 HA THR A 48 -32.424 -18.201 4.877 1.00 73.73 H ATOM 322 HB THR A 48 -34.464 -17.266 3.798 1.00 70.47 H ATOM 323 HG1 THR A 48 -34.271 -15.388 2.569 1.00 70.97 H ATOM 324 HG21 THR A 48 -34.574 -15.080 4.843 1.00 65.93 H ATOM 325 HG22 THR A 48 -33.651 -16.114 5.910 1.00 65.93 H ATOM 326 HG23 THR A 48 -32.826 -14.932 4.889 1.00 65.93 H ATOM 327 N SER A 49 -31.558 -18.479 1.749 1.00 79.64 N ANISOU 327 N SER A 49 12284 9054 8921 -96 1008 249 ATOM 328 CA SER A 49 -31.376 -19.394 0.638 1.00 72.12 C ANISOU 328 CA SER A 49 11387 8037 7979 -108 1055 239 ATOM 329 C SER A 49 -29.900 -19.828 0.605 1.00 77.58 C ANISOU 329 C SER A 49 12158 8708 8611 63 1019 348 ATOM 330 O SER A 49 -29.180 -19.382 -0.292 1.00 69.12 O ANISOU 330 O SER A 49 10987 7705 7569 113 916 355 ATOM 331 CB SER A 49 -31.850 -18.671 -0.640 1.00 81.10 C ANISOU 331 CB SER A 49 12340 9287 9187 -171 975 172 ATOM 332 OG SER A 49 -31.163 -17.435 -0.799 1.00 69.54 O ANISOU 332 OG SER A 49 10734 7925 7763 -79 840 222 ATOM 333 H SER A 49 -30.894 -17.707 1.789 1.00 79.64 H ATOM 334 HA SER A 49 -31.977 -20.293 0.758 1.00 72.12 H ATOM 335 HB3 SER A 49 -32.927 -18.507 -0.590 1.00 81.10 H ATOM 336 HB2 SER A 49 -31.680 -19.298 -1.515 1.00 81.10 H ATOM 337 HG SER A 49 -30.213 -17.627 -0.704 1.00 69.54 H ATOM 338 N PRO A 50 -29.444 -20.621 1.605 1.00 79.13 N ANISOU 338 N PRO A 50 12526 8828 8713 174 1109 447 ATOM 339 CA PRO A 50 -28.014 -20.939 1.742 1.00 73.96 C ANISOU 339 CA PRO A 50 11923 8206 7974 378 1071 569 ATOM 340 C PRO A 50 -27.517 -21.843 0.604 1.00 85.57 C ANISOU 340 C PRO A 50 13495 9538 9479 407 1166 588 ATOM 341 O PRO A 50 -28.327 -22.547 -0.012 1.00 92.40 O ANISOU 341 O PRO A 50 14424 10268 10416 253 1304 497 ATOM 342 CB PRO A 50 -27.932 -21.619 3.114 1.00 81.63 C ANISOU 342 CB PRO A 50 13042 9162 8810 502 1171 688 ATOM 343 CG PRO A 50 -29.282 -22.294 3.296 1.00 81.06 C ANISOU 343 CG PRO A 50 13103 8907 8790 346 1358 635 ATOM 344 CD PRO A 50 -30.238 -21.305 2.636 1.00 93.17 C ANISOU 344 CD PRO A 50 14456 10499 10446 131 1269 463 ATOM 345 HA PRO A 50 -27.430 -20.018 1.744 1.00 73.96 H ATOM 346 HB3 PRO A 50 -27.792 -20.854 3.881 1.00 81.63 H ATOM 347 HB2 PRO A 50 -27.090 -22.304 3.195 1.00 81.63 H ATOM 348 HG3 PRO A 50 -29.528 -22.498 4.340 1.00 81.06 H ATOM 349 HG2 PRO A 50 -29.304 -23.239 2.756 1.00 81.06 H ATOM 350 HD2 PRO A 50 -31.129 -21.799 2.249 1.00 93.17 H ATOM 351 HD3 PRO A 50 -30.561 -20.584 3.380 1.00 93.17 H ATOM 352 N TRP A 51 -26.208 -21.814 0.338 1.00 90.79 N ANISOU 352 N TRP A 51 14159 10251 10084 591 1108 684 ATOM 353 CA TRP A 51 -25.597 -22.581 -0.740 1.00 79.45 C ANISOU 353 CA TRP A 51 12768 8721 8697 624 1158 686 ATOM 354 C TRP A 51 -24.301 -23.233 -0.263 1.00 86.28 C ANISOU 354 C TRP A 51 13695 9629 9458 891 1153 845 ATOM 355 O TRP A 51 -23.794 -22.926 0.816 1.00 88.23 O ANISOU 355 O TRP A 51 13889 10051 9582 1032 1064 924 ATOM 356 CB TRP A 51 -25.397 -21.718 -2.010 1.00 85.54 C ANISOU 356 CB TRP A 51 13347 9602 9553 513 1006 572 ATOM 357 CG TRP A 51 -24.483 -20.537 -1.948 1.00 79.39 C ANISOU 357 CG TRP A 51 12396 9016 8752 601 811 586 ATOM 358 CD1 TRP A 51 -23.153 -20.541 -2.217 1.00 90.22 C ANISOU 358 CD1 TRP A 51 13730 10461 10088 744 741 634 ATOM 359 CD2 TRP A 51 -24.815 -19.164 -1.581 1.00 84.97 C ANISOU 359 CD2 TRP A 51 12944 9858 9484 536 696 531 ATOM 360 NE1 TRP A 51 -22.661 -19.258 -2.090 1.00 87.41 N ANISOU 360 NE1 TRP A 51 13200 10282 9729 755 598 594 ATOM 361 CE2 TRP A 51 -23.638 -18.371 -1.710 1.00 82.00 C ANISOU 361 CE2 TRP A 51 12445 9618 9091 626 582 531 ATOM 362 CE3 TRP A 51 -25.993 -18.502 -1.168 1.00 87.28 C ANISOU 362 CE3 TRP A 51 13185 10159 9819 409 704 472 ATOM 363 CZ2 TRP A 51 -23.627 -16.995 -1.456 1.00 87.22 C ANISOU 363 CZ2 TRP A 51 12951 10398 9791 576 506 464 ATOM 364 CZ3 TRP A 51 -25.993 -17.119 -0.889 1.00 83.99 C ANISOU 364 CZ3 TRP A 51 12611 9856 9447 381 617 426 ATOM 365 CH2 TRP A 51 -24.810 -16.370 -1.031 1.00 86.86 C ANISOU 365 CH2 TRP A 51 12873 10328 9803 458 535 418 ATOM 366 H TRP A 51 -25.571 -21.338 0.972 1.00 90.79 H ATOM 367 HA TRP A 51 -26.260 -23.406 -0.997 1.00 79.45 H ATOM 368 HB3 TRP A 51 -26.369 -21.371 -2.362 1.00 85.54 H ATOM 369 HB2 TRP A 51 -25.013 -22.337 -2.819 1.00 85.54 H ATOM 370 HD1 TRP A 51 -22.577 -21.410 -2.512 1.00 90.22 H ATOM 371 HE1 TRP A 51 -21.683 -18.965 -2.266 1.00 87.41 H ATOM 372 HE3 TRP A 51 -26.905 -19.064 -1.053 1.00 87.28 H ATOM 373 HZ2 TRP A 51 -22.715 -16.430 -1.583 1.00 87.22 H ATOM 374 HZ3 TRP A 51 -26.905 -16.636 -0.563 1.00 83.99 H ATOM 375 HH2 TRP A 51 -24.800 -15.314 -0.814 1.00 86.86 H ATOM 376 N ASN A 52 -23.814 -24.162 -1.080 1.00 98.61 N ANISOU 376 N ASN A 52 15364 11045 11059 951 1274 878 ATOM 377 CA ASN A 52 -22.523 -24.828 -0.936 1.00104.55 C ANISOU 377 CA ASN A 52 16157 11837 11731 1221 1279 1027 ATOM 378 C ASN A 52 -21.802 -24.641 -2.266 1.00107.26 C ANISOU 378 C ASN A 52 16380 12219 12156 1163 1176 930 ATOM 379 O ASN A 52 -22.456 -24.711 -3.309 1.00108.83 O ANISOU 379 O ASN A 52 16553 12331 12467 937 1206 784 ATOM 380 CB ASN A 52 -22.693 -26.347 -0.700 1.00106.78 C ANISOU 380 CB ASN A 52 16706 11865 12002 1374 1574 1179 ATOM 381 CG ASN A 52 -23.555 -26.685 0.514 1.00105.04 C ANISOU 381 CG ASN A 52 16637 11521 11751 1337 1742 1230 ATOM 382 OD1 ASN A 52 -23.468 -26.059 1.563 1.00 90.87 O ANISOU 382 OD1 ASN A 52 14777 9920 9828 1423 1627 1298 ATOM 383 ND2 ASN A 52 -24.441 -27.662 0.375 1.00100.14 N ANISOU 383 ND2 ASN A 52 16197 10603 11248 1176 2015 1160 ATOM 384 H ASN A 52 -24.309 -24.346 -1.950 1.00 98.61 H ATOM 385 HA ASN A 52 -21.914 -24.393 -0.138 1.00104.55 H ATOM 386 HB3 ASN A 52 -21.716 -26.818 -0.571 1.00106.78 H ATOM 387 HB2 ASN A 52 -23.139 -26.814 -1.579 1.00106.78 H ATOM 388 HD22 ASN A 52 -25.023 -27.918 1.160 1.00100.14 H ATOM 389 HD21 ASN A 52 -24.565 -28.120 -0.514 1.00100.14 H ATOM 390 N LEU A 53 -20.481 -24.458 -2.219 1.00100.07 N ANISOU 390 N LEU A 53 15402 11451 11171 1370 1082 1013 ATOM 391 CA LEU A 53 -19.650 -24.356 -3.415 1.00108.22 C ANISOU 391 CA LEU A 53 16357 12501 12261 1379 1025 961 ATOM 392 C LEU A 53 -19.266 -25.765 -3.907 1.00112.21 C ANISOU 392 C LEU A 53 17059 12774 12800 1503 1258 1050 ATOM 393 O LEU A 53 -19.088 -26.679 -3.094 1.00113.69 O ANISOU 393 O LEU A 53 17378 12921 12899 1751 1383 1233 ATOM 394 CB LEU A 53 -18.409 -23.489 -3.111 1.00110.79 C ANISOU 394 CB LEU A 53 16496 13117 12480 1533 824 984 ATOM 395 CG LEU A 53 -18.749 -22.033 -2.724 1.00109.89 C ANISOU 395 CG LEU A 53 16209 13201 12343 1411 659 887 ATOM 396 CD1 LEU A 53 -17.496 -21.294 -2.232 1.00106.18 C ANISOU 396 CD1 LEU A 53 15560 13039 11746 1556 516 881 ATOM 397 CD2 LEU A 53 -19.420 -21.272 -3.886 1.00113.80 C ANISOU 397 CD2 LEU A 53 16608 13648 12983 1160 597 739 ATOM 398 H LEU A 53 -19.987 -24.448 -1.342 1.00100.07 H ATOM 399 HA LEU A 53 -20.224 -23.854 -4.190 1.00108.22 H ATOM 400 HB3 LEU A 53 -17.768 -23.460 -3.992 1.00110.79 H ATOM 401 HB2 LEU A 53 -17.817 -23.967 -2.328 1.00110.79 H ATOM 402 HG LEU A 53 -19.445 -22.043 -1.884 1.00109.89 H ATOM 403 HD11 LEU A 53 -17.751 -20.306 -1.848 1.00106.18 H ATOM 404 HD12 LEU A 53 -16.998 -21.833 -1.425 1.00106.18 H ATOM 405 HD13 LEU A 53 -16.771 -21.157 -3.037 1.00106.18 H ATOM 406 HD21 LEU A 53 -19.349 -20.191 -3.752 1.00113.80 H ATOM 407 HD22 LEU A 53 -18.953 -21.506 -4.846 1.00113.80 H ATOM 408 HD23 LEU A 53 -20.482 -21.514 -3.961 1.00113.80 H ATOM 409 N HIS A 54 -19.172 -25.935 -5.225 1.00111.59 N ANISOU 409 N HIS A 54 16999 12554 12845 1331 1336 921 ATOM 410 CA HIS A 54 -18.705 -27.135 -5.906 1.00118.62 C ANISOU 410 CA HIS A 54 18024 13246 13799 1412 1540 948 ATOM 411 C HIS A 54 -17.619 -26.745 -6.903 1.00121.27 C ANISOU 411 C HIS A 54 18201 13746 14129 1483 1370 919 ATOM 412 O HIS A 54 -17.836 -25.866 -7.732 1.00133.73 O ANISOU 412 O HIS A 54 19603 15472 15736 1300 1186 778 ATOM 413 CB HIS A 54 -19.882 -27.830 -6.600 1.00121.83 C ANISOU 413 CB HIS A 54 18521 13436 14332 1127 1744 770 ATOM 414 CG HIS A 54 -19.525 -29.034 -7.444 1.00157.96 C ANISOU 414 CG HIS A 54 23216 17799 19001 1126 1980 725 ATOM 415 ND1 HIS A 54 -19.266 -28.946 -8.802 1.00179.37 N ANISOU 415 ND1 HIS A 54 26187 20197 21768 1241 2337 824 ATOM 416 CD2 HIS A 54 -19.386 -30.369 -7.123 1.00175.25 C ANISOU 416 CD2 HIS A 54 25313 20027 21248 1012 1948 585 ATOM 417 CE1 HIS A 54 -18.945 -30.175 -9.221 1.00179.26 C ANISOU 417 CE1 HIS A 54 26234 20020 21856 1187 2526 730 ATOM 418 NE2 HIS A 54 -19.010 -31.086 -8.257 1.00182.61 N ANISOU 418 NE2 HIS A 54 26436 20675 22274 1042 2276 576 ATOM 419 H HIS A 54 -19.484 -25.174 -5.841 1.00111.59 H ATOM 420 HA HIS A 54 -18.279 -27.834 -5.182 1.00118.62 H ATOM 421 HB3 HIS A 54 -20.447 -27.122 -7.209 1.00121.83 H ATOM 422 HB2 HIS A 54 -20.530 -28.157 -5.804 1.00121.83 H ATOM 423 HD1 HIS A 54 -19.305 -28.116 -9.385 1.00179.37 H ATOM 424 HD2 HIS A 54 -19.507 -30.866 -6.177 1.00175.25 H ATOM 425 HE1 HIS A 54 -18.662 -30.405 -10.242 1.00179.26 H ATOM 426 N ARG A 55 -16.491 -27.445 -6.806 1.00121.25 N ANISOU 426 N ARG A 55 18254 13731 14083 1756 1437 1061 ATOM 427 CA ARG A 55 -15.309 -27.230 -7.618 1.00121.20 C ANISOU 427 CA ARG A 55 18125 13844 14083 1839 1332 1031 ATOM 428 C ARG A 55 -15.375 -28.136 -8.854 1.00114.91 C ANISOU 428 C ARG A 55 17417 12816 13427 1672 1517 904 ATOM 429 O ARG A 55 -15.142 -29.337 -8.713 1.00114.44 O ANISOU 429 O ARG A 55 17565 12483 13433 1720 1809 954 ATOM 430 CB ARG A 55 -14.093 -27.557 -6.736 1.00124.24 C ANISOU 430 CB ARG A 55 18526 14329 14349 2222 1355 1239 ATOM 431 CG ARG A 55 -12.743 -27.288 -7.392 1.00124.44 C ANISOU 431 CG ARG A 55 18344 14614 14326 2319 1157 1198 ATOM 432 CD ARG A 55 -11.581 -27.668 -6.462 1.00122.03 C ANISOU 432 CD ARG A 55 17979 14524 13862 2707 1134 1380 ATOM 433 NE ARG A 55 -10.430 -28.188 -7.209 1.00112.95 N ANISOU 433 NE ARG A 55 16839 13315 12762 2851 1222 1403 ATOM 434 CZ ARG A 55 -10.343 -29.399 -7.782 1.00118.29 C ANISOU 434 CZ ARG A 55 17739 13647 13561 2898 1511 1469 ATOM 435 NH1 ARG A 55 -11.365 -30.262 -7.784 1.00126.04 N ANISOU 435 NH1 ARG A 55 18948 14324 14618 2820 1747 1515 ATOM 436 NH2 ARG A 55 -9.214 -29.753 -8.375 1.00138.31 N1+ ANISOU 436 NH2 ARG A 55 20270 16136 16144 3029 1592 1481 ATOM 437 H ARG A 55 -16.459 -28.239 -6.190 1.00121.25 H ATOM 438 HA ARG A 55 -15.245 -26.185 -7.923 1.00121.20 H ATOM 439 HB3 ARG A 55 -14.140 -28.598 -6.409 1.00124.24 H ATOM 440 HB2 ARG A 55 -14.128 -26.961 -5.833 1.00124.24 H ATOM 441 HG3 ARG A 55 -12.723 -26.209 -7.537 1.00124.44 H ATOM 442 HG2 ARG A 55 -12.655 -27.729 -8.388 1.00124.44 H ATOM 443 HD3 ARG A 55 -11.873 -28.365 -5.675 1.00122.03 H ATOM 444 HD2 ARG A 55 -11.232 -26.766 -5.957 1.00122.03 H ATOM 445 HH22 ARG A 55 -9.120 -30.538 -9.035 1.00138.31 H ATOM 446 HH21 ARG A 55 -8.486 -29.084 -8.617 1.00138.31 H ATOM 447 HH12 ARG A 55 -11.264 -31.177 -8.198 1.00126.04 H ATOM 448 HH11 ARG A 55 -12.287 -29.987 -7.477 1.00126.04 H ATOM 449 HE ARG A 55 -9.634 -27.540 -7.223 1.00112.95 H ATOM 450 N ASN A 56 -15.656 -27.555 -10.022 1.00120.68 N ANISOU 450 N ASN A 56 17994 13658 14202 1486 1378 741 ATOM 451 CA ASN A 56 -15.493 -28.207 -11.324 1.00118.88 C ANISOU 451 CA ASN A 56 17809 13284 14078 1340 1533 602 ATOM 452 C ASN A 56 -14.089 -27.835 -11.833 1.00113.71 C ANISOU 452 C ASN A 56 17024 12777 13403 1464 1397 610 ATOM 453 O ASN A 56 -13.782 -26.646 -11.926 1.00109.58 O ANISOU 453 O ASN A 56 16312 12497 12824 1439 1145 583 ATOM 454 CB ASN A 56 -16.673 -27.780 -12.247 1.00125.30 C ANISOU 454 CB ASN A 56 18560 14115 14933 995 1532 395 ATOM 455 CG ASN A 56 -16.379 -27.790 -13.752 1.00124.12 C ANISOU 455 CG ASN A 56 18279 14073 14807 832 1473 234 ATOM 456 OD1 ASN A 56 -16.423 -26.745 -14.392 1.00127.37 O ANISOU 456 OD1 ASN A 56 18757 14362 15276 850 1632 186 ATOM 457 ND2 ASN A 56 -16.016 -28.922 -14.341 1.00131.18 N ANISOU 457 ND2 ASN A 56 18991 15195 15655 682 1267 159 ATOM 458 H ASN A 56 -15.747 -26.536 -10.049 1.00120.68 H ATOM 459 HA ASN A 56 -15.582 -29.284 -11.167 1.00118.88 H ATOM 460 HB3 ASN A 56 -16.962 -26.752 -12.012 1.00125.30 H ATOM 461 HB2 ASN A 56 -17.556 -28.382 -12.046 1.00125.30 H ATOM 462 HD22 ASN A 56 -15.821 -28.926 -15.335 1.00131.18 H ATOM 463 HD21 ASN A 56 -15.914 -29.788 -13.836 1.00131.18 H ATOM 464 N GLU A 57 -13.279 -28.851 -12.155 1.00116.93 N ANISOU 464 N GLU A 57 17540 13030 13859 1621 1585 661 ATOM 465 CA GLU A 57 -11.971 -28.699 -12.790 1.00123.75 C ANISOU 465 CA GLU A 57 18293 14023 14704 1778 1489 680 ATOM 466 C GLU A 57 -12.052 -29.186 -14.243 1.00120.00 C ANISOU 466 C GLU A 57 17821 13442 14330 1579 1604 501 ATOM 467 O GLU A 57 -12.844 -30.080 -14.548 1.00108.74 O ANISOU 467 O GLU A 57 16554 11762 12999 1460 1879 425 ATOM 468 CB GLU A 57 -10.886 -29.434 -11.977 1.00134.97 C ANISOU 468 CB GLU A 57 19810 15387 16084 2157 1617 892 ATOM 469 CG GLU A 57 -9.447 -29.256 -12.523 1.00145.60 C ANISOU 469 CG GLU A 57 21003 16931 17389 2334 1490 905 ATOM 470 CD GLU A 57 -8.412 -29.642 -11.473 1.00152.77 C ANISOU 470 CD GLU A 57 21927 17930 18187 2760 1536 1142 ATOM 471 OE1 GLU A 57 -7.765 -28.719 -10.944 1.00135.05 O ANISOU 471 OE1 GLU A 57 19470 16040 15802 2919 1301 1172 ATOM 472 OE2 GLU A 57 -8.435 -30.819 -11.047 1.00149.45 O1- ANISOU 472 OE2 GLU A 57 21728 17243 17812 2938 1828 1296 ATOM 473 H GLU A 57 -13.624 -29.798 -12.132 1.00116.93 H ATOM 474 HA GLU A 57 -11.699 -27.649 -12.790 1.00123.75 H ATOM 475 HB3 GLU A 57 -11.115 -30.499 -11.934 1.00134.97 H ATOM 476 HB2 GLU A 57 -10.917 -29.081 -10.948 1.00134.97 H ATOM 477 HG3 GLU A 57 -9.283 -28.218 -12.818 1.00145.60 H ATOM 478 HG2 GLU A 57 -9.287 -29.866 -13.415 1.00145.60 H ATOM 479 N ASP A 58 -11.236 -28.555 -15.089 1.00118.51 N ANISOU 479 N ASP A 58 17454 13453 14120 1523 1415 416 ATOM 480 CA ASP A 58 -11.131 -28.772 -16.528 1.00114.29 C ANISOU 480 CA ASP A 58 16893 12876 13654 1343 1499 245 ATOM 481 C ASP A 58 -9.727 -28.257 -16.924 1.00117.69 C ANISOU 481 C ASP A 58 17184 13476 14056 1480 1352 261 ATOM 482 O ASP A 58 -9.530 -27.040 -16.947 1.00107.04 O ANISOU 482 O ASP A 58 15665 12358 12647 1431 1119 236 ATOM 483 CB ASP A 58 -12.288 -28.049 -17.254 1.00109.22 C ANISOU 483 CB ASP A 58 16156 12345 12999 1016 1422 71 ATOM 484 CG ASP A 58 -12.311 -28.080 -18.785 1.00116.45 C ANISOU 484 CG ASP A 58 17032 13263 13951 826 1521 -115 ATOM 485 OD1 ASP A 58 -11.381 -28.591 -19.445 1.00118.06 O ANISOU 485 OD1 ASP A 58 17254 13406 14199 952 1592 -108 ATOM 486 OD2 ASP A 58 -13.279 -27.497 -19.324 1.00110.03 O1- ANISOU 486 OD2 ASP A 58 16157 12539 13111 563 1532 -272 ATOM 487 H ASP A 58 -10.684 -27.784 -14.736 1.00118.51 H ATOM 488 HA ASP A 58 -11.249 -29.831 -16.752 1.00114.29 H ATOM 489 HB3 ASP A 58 -12.308 -27.011 -16.928 1.00109.22 H ATOM 490 HB2 ASP A 58 -13.229 -28.471 -16.904 1.00109.22 H ATOM 491 N PRO A 59 -8.736 -29.153 -17.134 1.00129.38 N ANISOU 491 N PRO A 59 18735 14837 15586 1666 1510 304 ATOM 492 CA PRO A 59 -7.347 -28.720 -17.373 1.00126.33 C ANISOU 492 CA PRO A 59 18203 14636 15161 1827 1372 323 ATOM 493 C PRO A 59 -7.106 -27.990 -18.709 1.00112.48 C ANISOU 493 C PRO A 59 16314 13000 13423 1588 1275 141 ATOM 494 O PRO A 59 -6.139 -27.223 -18.783 1.00112.59 O ANISOU 494 O PRO A 59 16184 13198 13397 1670 1129 136 ATOM 495 CB PRO A 59 -6.526 -30.014 -17.240 1.00119.36 C ANISOU 495 CB PRO A 59 17455 13567 14331 2112 1613 442 ATOM 496 CG PRO A 59 -7.501 -31.125 -17.599 1.00123.35 C ANISOU 496 CG PRO A 59 18173 13735 14959 1947 1927 371 ATOM 497 CD PRO A 59 -8.841 -30.609 -17.080 1.00124.99 C ANISOU 497 CD PRO A 59 18401 13960 15130 1749 1853 343 ATOM 498 HA PRO A 59 -7.047 -28.021 -16.588 1.00126.33 H ATOM 499 HB3 PRO A 59 -6.196 -30.130 -16.207 1.00119.36 H ATOM 500 HB2 PRO A 59 -5.634 -30.029 -17.870 1.00119.36 H ATOM 501 HG3 PRO A 59 -7.222 -32.095 -17.188 1.00123.35 H ATOM 502 HG2 PRO A 59 -7.544 -31.219 -18.685 1.00123.35 H ATOM 503 HD2 PRO A 59 -9.662 -30.993 -17.689 1.00124.99 H ATOM 504 HD3 PRO A 59 -8.993 -30.897 -16.038 1.00124.99 H ATOM 505 N GLU A 60 -7.979 -28.202 -19.707 1.00111.83 N ANISOU 505 N GLU A 60 16262 12853 13376 1302 1351 -5 ATOM 506 CA GLU A 60 -7.935 -27.566 -21.026 1.00109.63 C ANISOU 506 CA GLU A 60 15849 12729 13077 1076 1265 -162 ATOM 507 C GLU A 60 -8.721 -26.236 -21.065 1.00109.17 C ANISOU 507 C GLU A 60 15651 12893 12936 965 1034 -148 ATOM 508 O GLU A 60 -8.988 -25.715 -22.152 1.00107.30 O ANISOU 508 O GLU A 60 15304 12805 12659 798 968 -238 ATOM 509 CB GLU A 60 -8.404 -28.572 -22.102 1.00117.57 C ANISOU 509 CB GLU A 60 16922 13623 14125 830 1475 -341 ATOM 510 CG GLU A 60 -7.461 -29.789 -22.262 1.00124.45 C ANISOU 510 CG GLU A 60 17908 14274 15103 897 1738 -401 ATOM 511 CD GLU A 60 -6.091 -29.439 -22.848 1.00130.04 C ANISOU 511 CD GLU A 60 18513 15087 15810 1008 1655 -405 ATOM 512 OE1 GLU A 60 -6.024 -28.620 -23.790 1.00119.66 O ANISOU 512 OE1 GLU A 60 17073 13944 14449 816 1576 -541 ATOM 513 OE2 GLU A 60 -5.067 -29.862 -22.273 1.00128.15 O1- ANISOU 513 OE2 GLU A 60 18299 14799 15594 1297 1655 -263 ATOM 514 H GLU A 60 -8.794 -28.789 -19.552 1.00111.83 H ATOM 515 HA GLU A 60 -6.902 -27.301 -21.247 1.00109.63 H ATOM 516 HB3 GLU A 60 -8.510 -28.077 -23.070 1.00117.57 H ATOM 517 HB2 GLU A 60 -9.398 -28.936 -21.844 1.00117.57 H ATOM 518 HG3 GLU A 60 -7.918 -30.514 -22.931 1.00124.45 H ATOM 519 HG2 GLU A 60 -7.328 -30.294 -21.304 1.00124.45 H ATOM 520 N ARG A 61 -9.053 -25.695 -19.887 1.00112.50 N ANISOU 520 N ARG A 61 16076 13341 13328 1063 934 -31 ATOM 521 CA ARG A 61 -9.709 -24.411 -19.708 1.00100.40 C ANISOU 521 CA ARG A 61 14444 11960 11742 959 771 -10 ATOM 522 C ARG A 61 -8.809 -23.495 -18.868 1.00 98.91 C ANISOU 522 C ARG A 61 14171 11883 11530 1117 629 75 ATOM 523 O ARG A 61 -8.129 -23.984 -17.966 1.00100.76 O ANISOU 523 O ARG A 61 14453 12076 11757 1311 655 147 ATOM 524 CB ARG A 61 -11.041 -24.670 -18.993 1.00 96.86 C ANISOU 524 CB ARG A 61 14084 11428 11290 872 830 5 ATOM 525 CG ARG A 61 -12.012 -23.478 -18.917 1.00 99.98 C ANISOU 525 CG ARG A 61 14387 11961 11640 793 686 44 ATOM 526 CD ARG A 61 -13.348 -23.855 -18.254 1.00101.53 C ANISOU 526 CD ARG A 61 14663 12083 11832 725 741 57 ATOM 527 NE ARG A 61 -13.205 -24.285 -16.847 1.00106.83 N ANISOU 527 NE ARG A 61 15456 12612 12523 889 795 151 ATOM 528 CZ ARG A 61 -14.088 -24.995 -16.127 1.00108.32 C ANISOU 528 CZ ARG A 61 15776 12652 12728 858 929 157 ATOM 529 NH1 ARG A 61 -15.263 -25.388 -16.618 1.00100.32 N ANISOU 529 NH1 ARG A 61 14772 11627 11718 642 1017 38 ATOM 530 NH2 ARG A 61 -13.792 -25.329 -14.877 1.00108.65 N1+ ANISOU 530 NH2 ARG A 61 15929 12584 12769 1046 983 276 ATOM 531 H ARG A 61 -8.837 -26.190 -19.030 1.00112.50 H ATOM 532 HA ARG A 61 -9.915 -23.972 -20.678 1.00100.40 H ATOM 533 HB3 ARG A 61 -10.842 -25.059 -17.995 1.00 96.86 H ATOM 534 HB2 ARG A 61 -11.557 -25.462 -19.532 1.00 96.86 H ATOM 535 HG3 ARG A 61 -12.224 -23.163 -19.941 1.00 99.98 H ATOM 536 HG2 ARG A 61 -11.576 -22.607 -18.429 1.00 99.98 H ATOM 537 HD3 ARG A 61 -13.848 -24.613 -18.857 1.00101.53 H ATOM 538 HD2 ARG A 61 -14.004 -22.988 -18.244 1.00101.53 H ATOM 539 HH22 ARG A 61 -14.478 -25.808 -14.299 1.00108.65 H ATOM 540 HH21 ARG A 61 -12.850 -25.255 -14.500 1.00108.65 H ATOM 541 HH12 ARG A 61 -15.928 -25.881 -16.016 1.00100.32 H ATOM 542 HH11 ARG A 61 -15.508 -25.271 -17.586 1.00100.32 H ATOM 543 HE ARG A 61 -12.378 -23.902 -16.387 1.00106.83 H ATOM 544 N TYR A 62 -8.855 -22.181 -19.119 1.00 93.42 N ANISOU 544 N TYR A 62 13348 11331 10816 1041 510 62 ATOM 545 CA TYR A 62 -8.411 -21.167 -18.159 1.00105.02 C ANISOU 545 CA TYR A 62 14726 12908 12270 1119 407 95 ATOM 546 C TYR A 62 -9.622 -20.263 -17.828 1.00100.95 C ANISOU 546 C TYR A 62 14202 12401 11753 1011 368 133 ATOM 547 O TYR A 62 -10.226 -19.734 -18.767 1.00101.59 O ANISOU 547 O TYR A 62 14249 12511 11839 885 371 127 ATOM 548 CB TYR A 62 -7.222 -20.351 -18.711 1.00107.15 C ANISOU 548 CB TYR A 62 14861 13302 12550 1113 364 26 ATOM 549 CG TYR A 62 -6.652 -19.330 -17.732 1.00110.24 C ANISOU 549 CG TYR A 62 15139 13819 12927 1165 299 -1 ATOM 550 CD1 TYR A 62 -5.517 -19.646 -16.955 1.00101.40 C ANISOU 550 CD1 TYR A 62 13941 12826 11762 1320 271 -43 ATOM 551 CD2 TYR A 62 -7.269 -18.070 -17.569 1.00116.67 C ANISOU 551 CD2 TYR A 62 15909 14651 13767 1062 283 1 ATOM 552 CE1 TYR A 62 -5.009 -18.719 -16.022 1.00101.56 C ANISOU 552 CE1 TYR A 62 13821 13023 11746 1338 221 -118 ATOM 553 CE2 TYR A 62 -6.776 -17.154 -16.623 1.00111.07 C ANISOU 553 CE2 TYR A 62 15092 14059 13053 1074 259 -67 ATOM 554 CZ TYR A 62 -5.644 -17.474 -15.856 1.00106.43 C ANISOU 554 CZ TYR A 62 14404 13632 12402 1197 224 -145 ATOM 555 OH TYR A 62 -5.181 -16.565 -14.954 1.00111.51 O ANISOU 555 OH TYR A 62 14905 14449 13017 1181 208 -260 ATOM 556 H TYR A 62 -9.403 -21.853 -19.918 1.00 93.42 H ATOM 557 HA TYR A 62 -8.024 -21.660 -17.276 1.00105.02 H ATOM 558 HB3 TYR A 62 -7.506 -19.830 -19.618 1.00107.15 H ATOM 559 HB2 TYR A 62 -6.426 -21.036 -19.003 1.00107.15 H ATOM 560 HD1 TYR A 62 -5.039 -20.606 -17.065 1.00101.40 H ATOM 561 HD2 TYR A 62 -8.138 -17.803 -18.152 1.00116.67 H ATOM 562 HE1 TYR A 62 -4.147 -18.980 -15.428 1.00101.56 H ATOM 563 HE2 TYR A 62 -7.270 -16.201 -16.487 1.00111.07 H ATOM 564 HH TYR A 62 -4.349 -16.772 -14.523 1.00111.51 H ATOM 565 N PRO A 63 -9.943 -20.060 -16.526 1.00105.66 N ANISOU 565 N PRO A 63 14817 12996 12333 1071 337 181 ATOM 566 CA PRO A 63 -9.378 -20.764 -15.358 1.00103.11 C ANISOU 566 CA PRO A 63 14527 12683 11965 1252 338 219 ATOM 567 C PRO A 63 -9.800 -22.243 -15.342 1.00103.11 C ANISOU 567 C PRO A 63 14694 12514 11971 1309 455 272 ATOM 568 O PRO A 63 -10.926 -22.571 -15.726 1.00 97.95 O ANISOU 568 O PRO A 63 14118 11752 11345 1171 519 259 ATOM 569 CB PRO A 63 -9.925 -19.982 -14.154 1.00103.55 C ANISOU 569 CB PRO A 63 14544 12809 11993 1255 279 242 ATOM 570 CG PRO A 63 -11.232 -19.395 -14.642 1.00111.42 C ANISOU 570 CG PRO A 63 15568 13730 13036 1083 290 253 ATOM 571 CD PRO A 63 -10.978 -19.108 -16.121 1.00114.54 C ANISOU 571 CD PRO A 63 15912 14138 13468 985 303 210 ATOM 572 HA PRO A 63 -8.290 -20.683 -15.345 1.00103.11 H ATOM 573 HB3 PRO A 63 -9.236 -19.175 -13.892 1.00103.55 H ATOM 574 HB2 PRO A 63 -10.068 -20.596 -13.263 1.00103.55 H ATOM 575 HG3 PRO A 63 -11.549 -18.519 -14.074 1.00111.42 H ATOM 576 HG2 PRO A 63 -12.011 -20.154 -14.545 1.00111.42 H ATOM 577 HD2 PRO A 63 -11.886 -19.215 -16.715 1.00114.54 H ATOM 578 HD3 PRO A 63 -10.604 -18.093 -16.267 1.00114.54 H ATOM 579 N SER A 64 -8.877 -23.120 -14.946 1.00 99.47 N ANISOU 579 N SER A 64 14272 12041 11480 1514 506 324 ATOM 580 CA SER A 64 -9.110 -24.557 -14.910 1.00103.86 C ANISOU 580 CA SER A 64 15009 12388 12067 1596 685 385 ATOM 581 C SER A 64 -10.117 -24.938 -13.816 1.00 97.97 C ANISOU 581 C SER A 64 14378 11554 11292 1637 738 482 ATOM 582 O SER A 64 -11.008 -25.742 -14.074 1.00105.69 O ANISOU 582 O SER A 64 15515 12317 12324 1572 910 486 ATOM 583 CB SER A 64 -7.756 -25.278 -14.774 1.00 97.01 C ANISOU 583 CB SER A 64 14155 11519 11186 1838 760 440 ATOM 584 OG SER A 64 -6.994 -24.726 -13.704 1.00102.44 O ANISOU 584 OG SER A 64 14737 12421 11765 2062 656 519 ATOM 585 H SER A 64 -7.964 -22.848 -14.608 1.00 99.47 H ATOM 586 HA SER A 64 -9.547 -24.844 -15.867 1.00103.86 H ATOM 587 HB3 SER A 64 -7.188 -25.196 -15.703 1.00 97.01 H ATOM 588 HB2 SER A 64 -7.910 -26.346 -14.603 1.00 97.01 H ATOM 589 HG SER A 64 -6.501 -25.446 -13.290 1.00102.44 H ATOM 590 N VAL A 65 -10.008 -24.301 -12.647 1.00 98.06 N ANISOU 590 N VAL A 65 14305 11730 11224 1713 612 531 ATOM 591 CA VAL A 65 -10.896 -24.494 -11.516 1.00112.69 C ANISOU 591 CA VAL A 65 16260 13525 13033 1766 656 630 ATOM 592 C VAL A 65 -11.998 -23.412 -11.548 1.00106.20 C ANISOU 592 C VAL A 65 15383 12733 12234 1538 565 558 ATOM 593 O VAL A 65 -11.664 -22.229 -11.638 1.00104.05 O ANISOU 593 O VAL A 65 14951 12647 11937 1497 423 503 ATOM 594 CB VAL A 65 -10.089 -24.331 -10.199 1.00124.01 C ANISOU 594 CB VAL A 65 17622 15168 14329 2030 588 736 ATOM 595 CG1 VAL A 65 -10.939 -24.624 -8.955 1.00126.07 C ANISOU 595 CG1 VAL A 65 18008 15362 14531 2107 659 859 ATOM 596 CG2 VAL A 65 -8.844 -25.243 -10.176 1.00137.57 C ANISOU 596 CG2 VAL A 65 19335 16937 16000 2298 649 816 ATOM 597 H VAL A 65 -9.252 -23.649 -12.513 1.00 98.06 H ATOM 598 HA VAL A 65 -11.337 -25.494 -11.547 1.00112.69 H ATOM 599 HB VAL A 65 -9.741 -23.299 -10.125 1.00124.01 H ATOM 600 HG11 VAL A 65 -10.365 -24.506 -8.035 1.00126.07 H ATOM 601 HG12 VAL A 65 -11.818 -23.982 -8.875 1.00126.07 H ATOM 602 HG13 VAL A 65 -11.277 -25.655 -9.013 1.00126.07 H ATOM 603 HG21 VAL A 65 -8.318 -25.190 -9.222 1.00137.57 H ATOM 604 HG22 VAL A 65 -9.123 -26.286 -10.337 1.00137.57 H ATOM 605 HG23 VAL A 65 -8.120 -24.981 -10.949 1.00137.57 H ATOM 606 N ILE A 66 -13.272 -23.819 -11.455 1.00 98.38 N ANISOU 606 N ILE A 66 14517 11573 11290 1406 667 554 ATOM 607 CA ILE A 66 -14.424 -22.934 -11.275 1.00104.84 C ANISOU 607 CA ILE A 66 15286 12428 12120 1224 596 509 ATOM 608 C ILE A 66 -15.235 -23.454 -10.072 1.00 94.58 C ANISOU 608 C ILE A 66 14118 11027 10792 1263 684 585 ATOM 609 O ILE A 66 -15.453 -24.666 -9.956 1.00 93.50 O ANISOU 609 O ILE A 66 14147 10695 10686 1270 867 609 ATOM 610 CB ILE A 66 -15.323 -22.851 -12.553 1.00108.25 C ANISOU 610 CB ILE A 66 15693 12823 12613 999 622 403 ATOM 611 CG1 ILE A 66 -14.560 -22.142 -13.700 1.00100.55 C ANISOU 611 CG1 ILE A 66 14583 11970 11652 969 532 348 ATOM 612 CG2 ILE A 66 -16.696 -22.154 -12.337 1.00112.70 C ANISOU 612 CG2 ILE A 66 16220 13420 13179 854 585 382 ATOM 613 CD1 ILE A 66 -15.345 -22.077 -15.018 1.00101.89 C ANISOU 613 CD1 ILE A 66 14721 12152 11840 792 569 261 ATOM 614 H ILE A 66 -13.495 -24.808 -11.396 1.00 98.38 H ATOM 615 HA ILE A 66 -14.082 -21.928 -11.042 1.00104.84 H ATOM 616 HB ILE A 66 -15.532 -23.872 -12.877 1.00108.25 H ATOM 617 HG13 ILE A 66 -13.607 -22.637 -13.886 1.00100.55 H ATOM 618 HG12 ILE A 66 -14.300 -21.132 -13.381 1.00100.55 H ATOM 619 HG21 ILE A 66 -17.292 -22.115 -13.252 1.00112.70 H ATOM 620 HG22 ILE A 66 -17.327 -22.674 -11.616 1.00112.70 H ATOM 621 HG23 ILE A 66 -16.569 -21.125 -11.997 1.00112.70 H ATOM 622 HD11 ILE A 66 -14.685 -22.075 -15.882 1.00101.89 H ATOM 623 HD12 ILE A 66 -16.021 -22.925 -15.123 1.00101.89 H ATOM 624 HD13 ILE A 66 -15.953 -21.172 -15.063 1.00101.89 H ATOM 625 N TRP A 67 -15.645 -22.528 -9.197 1.00113.11 N ANISOU 625 N TRP A 67 16395 13490 13092 1265 583 606 ATOM 626 CA TRP A 67 -16.439 -22.795 -7.999 1.00108.47 C ANISOU 626 CA TRP A 67 15915 12833 12467 1286 652 673 ATOM 627 C TRP A 67 -17.889 -22.319 -8.189 1.00106.70 C ANISOU 627 C TRP A 67 15675 12562 12305 1054 651 589 ATOM 628 O TRP A 67 -18.163 -21.125 -8.049 1.00109.74 O ANISOU 628 O TRP A 67 15916 13072 12708 970 529 538 ATOM 629 CB TRP A 67 -15.806 -22.094 -6.788 1.00121.07 C ANISOU 629 CB TRP A 67 17412 14633 13956 1422 539 722 ATOM 630 CG TRP A 67 -14.498 -22.640 -6.332 1.00121.91 C ANISOU 630 CG TRP A 67 17505 14857 13958 1683 537 813 ATOM 631 CD1 TRP A 67 -13.275 -22.211 -6.720 1.00115.31 C ANISOU 631 CD1 TRP A 67 16514 14207 13091 1756 435 761 ATOM 632 CD2 TRP A 67 -14.267 -23.737 -5.398 1.00119.02 C ANISOU 632 CD2 TRP A 67 17276 14454 13491 1929 657 983 ATOM 633 NE1 TRP A 67 -12.310 -22.927 -6.041 1.00118.41 N ANISOU 633 NE1 TRP A 67 16912 14722 13357 2037 461 879 ATOM 634 CE2 TRP A 67 -12.860 -23.869 -5.197 1.00117.96 C ANISOU 634 CE2 TRP A 67 17039 14529 13251 2167 600 1037 ATOM 635 CE3 TRP A 67 -15.106 -24.613 -4.674 1.00138.34 C ANISOU 635 CE3 TRP A 67 19921 16720 15922 1983 823 1103 ATOM 636 CZ2 TRP A 67 -12.321 -24.791 -4.287 1.00128.46 C ANISOU 636 CZ2 TRP A 67 18452 15911 14447 2490 699 1234 ATOM 637 CZ3 TRP A 67 -14.579 -25.526 -3.734 1.00138.39 C ANISOU 637 CZ3 TRP A 67 20034 16739 15809 2293 942 1303 ATOM 638 CH2 TRP A 67 -13.189 -25.613 -3.539 1.00138.19 C ANISOU 638 CH2 TRP A 67 19897 16943 15666 2560 877 1382 ATOM 639 H TRP A 67 -15.422 -21.554 -9.375 1.00113.11 H ATOM 640 HA TRP A 67 -16.445 -23.861 -7.778 1.00108.47 H ATOM 641 HB3 TRP A 67 -16.482 -22.163 -5.934 1.00121.07 H ATOM 642 HB2 TRP A 67 -15.691 -21.028 -6.982 1.00121.07 H ATOM 643 HD1 TRP A 67 -13.111 -21.398 -7.419 1.00115.31 H ATOM 644 HE1 TRP A 67 -11.327 -22.705 -6.110 1.00118.41 H ATOM 645 HE3 TRP A 67 -16.170 -24.574 -4.834 1.00138.34 H ATOM 646 HZ2 TRP A 67 -11.254 -24.848 -4.137 1.00128.46 H ATOM 647 HZ3 TRP A 67 -15.249 -26.164 -3.172 1.00138.39 H ATOM 648 HH2 TRP A 67 -12.786 -26.308 -2.817 1.00138.19 H ATOM 649 N GLU A 68 -18.785 -23.267 -8.470 1.00106.17 N ANISOU 649 N GLU A 68 15749 12321 12268 967 809 576 ATOM 650 CA GLU A 68 -20.223 -23.048 -8.619 1.00108.51 C ANISOU 650 CA GLU A 68 16029 12595 12607 747 840 478 ATOM 651 C GLU A 68 -20.962 -23.186 -7.286 1.00113.10 C ANISOU 651 C GLU A 68 16695 13120 13157 756 893 530 ATOM 652 O GLU A 68 -20.629 -24.076 -6.508 1.00129.90 O ANISOU 652 O GLU A 68 18984 15116 15255 882 1029 622 ATOM 653 CB GLU A 68 -20.778 -24.105 -9.576 1.00113.58 C ANISOU 653 CB GLU A 68 16759 13099 13298 605 1022 372 ATOM 654 CG GLU A 68 -20.176 -23.983 -10.987 1.00131.77 C ANISOU 654 CG GLU A 68 18971 15474 15622 558 986 294 ATOM 655 CD GLU A 68 -21.234 -24.202 -12.063 1.00139.63 C ANISOU 655 CD GLU A 68 19875 16557 16623 319 1023 126 ATOM 656 OE1 GLU A 68 -21.099 -25.222 -12.768 1.00151.72 O ANISOU 656 OE1 GLU A 68 21417 18060 18171 244 1125 23 ATOM 657 OE2 GLU A 68 -22.158 -23.356 -12.118 1.00106.76 O1- ANISOU 657 OE2 GLU A 68 15609 12520 12435 212 952 92 ATOM 658 H GLU A 68 -18.485 -24.237 -8.507 1.00106.17 H ATOM 659 HA GLU A 68 -20.412 -22.054 -9.033 1.00108.51 H ATOM 660 HB3 GLU A 68 -21.867 -24.036 -9.605 1.00113.58 H ATOM 661 HB2 GLU A 68 -20.570 -25.105 -9.190 1.00113.58 H ATOM 662 HG3 GLU A 68 -19.346 -24.681 -11.102 1.00131.77 H ATOM 663 HG2 GLU A 68 -19.754 -22.990 -11.142 1.00131.77 H ATOM 664 N ALA A 69 -21.997 -22.373 -7.082 1.00 98.86 N ANISOU 664 N ALA A 69 14796 11403 11364 631 816 481 ATOM 665 CA ALA A 69 -22.942 -22.494 -5.984 1.00 93.79 C ANISOU 665 CA ALA A 69 14229 10700 10707 579 887 491 ATOM 666 C ALA A 69 -24.052 -23.494 -6.342 1.00 97.20 C ANISOU 666 C ALA A 69 14780 10973 11178 418 1092 396 ATOM 667 O ALA A 69 -24.613 -23.409 -7.431 1.00 98.78 O ANISOU 667 O ALA A 69 14918 11201 11412 275 1123 273 ATOM 668 CB ALA A 69 -23.549 -21.108 -5.717 1.00 97.88 C ANISOU 668 CB ALA A 69 14589 11363 11239 499 751 456 ATOM 669 H ALA A 69 -22.237 -21.711 -7.820 1.00 98.86 H ATOM 670 HA ALA A 69 -22.424 -22.828 -5.084 1.00 93.79 H ATOM 671 HB1 ALA A 69 -24.290 -21.132 -4.917 1.00 97.88 H ATOM 672 HB2 ALA A 69 -22.774 -20.397 -5.424 1.00 97.88 H ATOM 673 HB3 ALA A 69 -24.045 -20.712 -6.603 1.00 97.88 H ATOM 674 N LYS A 70 -24.400 -24.380 -5.404 1.00106.34 N ANISOU 674 N LYS A 70 16104 11979 12321 439 1250 442 ATOM 675 CA LYS A 70 -25.670 -25.104 -5.409 1.00111.35 C ANISOU 675 CA LYS A 70 16843 12464 12999 243 1472 321 ATOM 676 C LYS A 70 -26.436 -24.652 -4.168 1.00108.99 C ANISOU 676 C LYS A 70 16584 12159 12670 230 1482 361 ATOM 677 O LYS A 70 -25.840 -24.664 -3.087 1.00 92.55 O ANISOU 677 O LYS A 70 14600 10042 10524 425 1483 526 ATOM 678 CB LYS A 70 -25.458 -26.623 -5.244 1.00126.67 C ANISOU 678 CB LYS A 70 19024 14126 14978 282 1773 342 ATOM 679 CG LYS A 70 -24.612 -27.331 -6.309 1.00140.55 C ANISOU 679 CG LYS A 70 20829 15819 16757 421 1812 397 ATOM 680 CD LYS A 70 -24.389 -28.804 -5.906 1.00145.21 C ANISOU 680 CD LYS A 70 21700 16079 17395 514 2171 473 ATOM 681 CE LYS A 70 -22.961 -29.026 -5.400 1.00139.35 C ANISOU 681 CE LYS A 70 21040 15292 16615 840 2176 691 ATOM 682 NZ LYS A 70 -22.802 -30.229 -4.563 1.00132.78 N1+ ANISOU 682 NZ LYS A 70 20463 14227 15761 1068 2445 901 ATOM 683 H LYS A 70 -23.880 -24.402 -4.532 1.00106.34 H ATOM 684 HA LYS A 70 -26.257 -24.897 -6.307 1.00111.35 H ATOM 685 HB3 LYS A 70 -26.441 -27.099 -5.226 1.00126.67 H ATOM 686 HB2 LYS A 70 -25.022 -26.816 -4.264 1.00126.67 H ATOM 687 HG3 LYS A 70 -23.661 -26.809 -6.430 1.00140.55 H ATOM 688 HG2 LYS A 70 -25.108 -27.263 -7.278 1.00140.55 H ATOM 689 HD3 LYS A 70 -24.591 -29.446 -6.764 1.00145.21 H ATOM 690 HD2 LYS A 70 -25.116 -29.090 -5.144 1.00145.21 H ATOM 691 HE3 LYS A 70 -22.635 -28.173 -4.802 1.00139.35 H ATOM 692 HE2 LYS A 70 -22.317 -29.109 -6.272 1.00139.35 H ATOM 693 HZ1 LYS A 70 -22.910 -31.073 -5.105 1.00132.78 H ATOM 694 HZ2 LYS A 70 -21.869 -30.179 -4.151 1.00132.78 H ATOM 695 HZ3 LYS A 70 -23.470 -30.208 -3.810 1.00132.78 H ATOM 696 N CYS A 71 -27.732 -24.355 -4.305 1.00 97.44 N ANISOU 696 N CYS A 71 15030 10760 11233 13 1494 211 ATOM 697 CA CYS A 71 -28.615 -24.076 -3.167 1.00 97.15 C ANISOU 697 CA CYS A 71 15011 10719 11181 -51 1521 205 ATOM 698 C CYS A 71 -28.790 -25.358 -2.329 1.00109.91 C ANISOU 698 C CYS A 71 16896 12069 12795 -13 1801 266 ATOM 699 O CYS A 71 -28.843 -26.445 -2.907 1.00115.72 O ANISOU 699 O CYS A 71 17758 12626 13583 -88 2030 193 ATOM 700 CB CYS A 71 -29.976 -23.529 -3.656 1.00104.87 C ANISOU 700 CB CYS A 71 15818 11842 12185 -287 1498 14 ATOM 701 SG CYS A 71 -29.930 -22.311 -5.014 1.00105.76 S ANISOU 701 SG CYS A 71 15625 12266 12294 -282 1218 -7 ATOM 702 H CYS A 71 -28.170 -24.386 -5.213 1.00 97.44 H ATOM 703 HA CYS A 71 -28.144 -23.310 -2.549 1.00 97.15 H ATOM 704 HB3 CYS A 71 -30.485 -23.071 -2.811 1.00104.87 H ATOM 705 HB2 CYS A 71 -30.625 -24.345 -3.978 1.00104.87 H ATOM 706 N ARG A 72 -28.825 -25.241 -0.995 1.00111.81 N ANISOU 706 N ARG A 72 17225 12286 12972 116 1801 408 ATOM 707 CA ARG A 72 -28.985 -26.403 -0.112 1.00111.24 C ANISOU 707 CA ARG A 72 17421 11968 12874 204 2081 523 ATOM 708 C ARG A 72 -30.402 -26.990 -0.125 1.00105.04 C ANISOU 708 C ARG A 72 16716 11028 12168 -71 2331 334 ATOM 709 O ARG A 72 -30.556 -28.181 0.147 1.00108.23 O ANISOU 709 O ARG A 72 17352 11155 12614 -81 2658 349 ATOM 710 CB ARG A 72 -28.634 -26.045 1.339 1.00108.05 C ANISOU 710 CB ARG A 72 17046 11663 12347 405 1988 711 ATOM 711 CG ARG A 72 -27.208 -25.540 1.530 1.00109.24 C ANISOU 711 CG ARG A 72 17175 11942 12389 707 1850 906 ATOM 712 CD ARG A 72 -26.915 -25.279 3.008 1.00106.02 C ANISOU 712 CD ARG A 72 16830 11637 11815 932 1843 1100 ATOM 713 NE ARG A 72 -25.586 -24.682 3.195 1.00101.79 N ANISOU 713 NE ARG A 72 16113 11393 11171 1116 1586 1166 ATOM 714 CZ ARG A 72 -25.130 -24.022 4.266 1.00109.77 C ANISOU 714 CZ ARG A 72 17008 12665 12035 1212 1436 1212 ATOM 715 NH1 ARG A 72 -25.877 -23.831 5.358 1.00108.32 N ANISOU 715 NH1 ARG A 72 16880 12482 11795 1156 1503 1221 ATOM 716 NH2 ARG A 72 -23.895 -23.546 4.228 1.00106.09 N1+ ANISOU 716 NH2 ARG A 72 16354 12474 11481 1336 1229 1216 ATOM 717 H ARG A 72 -28.817 -24.317 -0.569 1.00111.81 H ATOM 718 HA ARG A 72 -28.309 -27.191 -0.452 1.00111.24 H ATOM 719 HB3 ARG A 72 -28.778 -26.932 1.962 1.00108.05 H ATOM 720 HB2 ARG A 72 -29.340 -25.305 1.716 1.00108.05 H ATOM 721 HG3 ARG A 72 -26.989 -24.674 0.908 1.00109.24 H ATOM 722 HG2 ARG A 72 -26.563 -26.339 1.180 1.00109.24 H ATOM 723 HD3 ARG A 72 -26.886 -26.235 3.533 1.00106.02 H ATOM 724 HD2 ARG A 72 -27.718 -24.705 3.465 1.00106.02 H ATOM 725 HH22 ARG A 72 -23.517 -23.036 5.040 1.00106.09 H ATOM 726 HH21 ARG A 72 -23.325 -23.583 3.393 1.00106.09 H ATOM 727 HH12 ARG A 72 -25.543 -23.306 6.155 1.00108.32 H ATOM 728 HH11 ARG A 72 -26.850 -24.130 5.399 1.00108.32 H ATOM 729 HE ARG A 72 -24.909 -24.900 2.464 1.00101.79 H ATOM 730 N HIS A 73 -31.403 -26.135 -0.344 1.00 99.41 N ANISOU 730 N HIS A 73 15804 10492 11474 -279 2198 159 ATOM 731 CA HIS A 73 -32.809 -26.466 -0.217 1.00 96.03 C ANISOU 731 CA HIS A 73 15393 10004 11090 -542 2385 -35 ATOM 732 C HIS A 73 -33.540 -25.980 -1.470 1.00 96.67 C ANISOU 732 C HIS A 73 15211 10316 11204 -776 2273 -284 ATOM 733 O HIS A 73 -33.009 -25.157 -2.216 1.00106.06 O ANISOU 733 O HIS A 73 16207 11717 12373 -704 2019 -257 ATOM 734 CB HIS A 73 -33.353 -25.790 1.065 1.00 91.82 C ANISOU 734 CB HIS A 73 14860 9523 10504 -509 2320 40 ATOM 735 CG HIS A 73 -32.483 -25.941 2.294 1.00100.63 C ANISOU 735 CG HIS A 73 16130 10579 11527 -228 2303 308 ATOM 736 ND1 HIS A 73 -32.149 -27.165 2.852 1.00104.00 N ANISOU 736 ND1 HIS A 73 16838 10749 11929 -102 2589 454 ATOM 737 CD2 HIS A 73 -31.825 -24.998 3.050 1.00104.56 C ANISOU 737 CD2 HIS A 73 16524 11270 11933 -54 2058 444 ATOM 738 CE1 HIS A 73 -31.344 -26.924 3.889 1.00103.64 C ANISOU 738 CE1 HIS A 73 16842 10782 11752 166 2495 690 ATOM 739 NE2 HIS A 73 -31.083 -25.629 4.059 1.00108.85 N ANISOU 739 NE2 HIS A 73 17261 11729 12369 182 2167 665 ATOM 740 H HIS A 73 -31.223 -25.150 -0.532 1.00 99.41 H ATOM 741 HA HIS A 73 -32.944 -27.545 -0.143 1.00 96.03 H ATOM 742 HB3 HIS A 73 -34.348 -26.163 1.305 1.00 91.82 H ATOM 743 HB2 HIS A 73 -33.473 -24.720 0.888 1.00 91.82 H ATOM 744 HD1 HIS A 73 -32.415 -28.079 2.513 1.00104.00 H ATOM 745 HD2 HIS A 73 -31.815 -23.926 2.924 1.00104.56 H ATOM 746 HE1 HIS A 73 -30.928 -27.702 4.515 1.00103.64 H ATOM 747 N LEU A 74 -34.751 -26.511 -1.675 1.00106.70 N ANISOU 747 N LEU A 74 16471 11562 12511 -1045 2481 -521 ATOM 748 CA LEU A 74 -35.703 -26.021 -2.679 1.00103.01 C ANISOU 748 CA LEU A 74 15711 11397 12030 -1266 2380 -772 ATOM 749 C LEU A 74 -36.553 -24.889 -2.079 1.00 88.93 C ANISOU 749 C LEU A 74 13762 9814 10214 -1253 2186 -744 ATOM 750 O LEU A 74 -36.914 -23.960 -2.796 1.00110.81 O ANISOU 750 O LEU A 74 16268 12881 12952 -1262 1976 -792 ATOM 751 CB LEU A 74 -36.613 -27.188 -3.136 1.00113.43 C ANISOU 751 CB LEU A 74 17071 12636 13390 -1581 2717 -1081 ATOM 752 CG LEU A 74 -36.012 -28.228 -4.122 1.00133.33 C ANISOU 752 CG LEU A 74 19661 15046 15951 -1673 2914 -1210 ATOM 753 CD1 LEU A 74 -34.473 -28.313 -4.191 1.00131.36 C ANISOU 753 CD1 LEU A 74 19527 14674 15710 -1383 2793 -944 ATOM 754 CD2 LEU A 74 -36.620 -29.620 -3.892 1.00131.69 C ANISOU 754 CD2 LEU A 74 19708 14494 15836 -1888 3392 -1387 ATOM 755 H LEU A 74 -35.074 -27.261 -1.087 1.00106.70 H ATOM 756 HA LEU A 74 -35.186 -25.597 -3.545 1.00103.01 H ATOM 757 HB3 LEU A 74 -37.511 -26.778 -3.608 1.00113.43 H ATOM 758 HB2 LEU A 74 -36.989 -27.692 -2.245 1.00113.43 H ATOM 759 HG LEU A 74 -36.328 -27.908 -5.117 1.00133.33 H ATOM 760 HD11 LEU A 74 -34.166 -29.026 -4.957 1.00131.36 H ATOM 761 HD12 LEU A 74 -34.027 -27.356 -4.466 1.00131.36 H ATOM 762 HD13 LEU A 74 -34.031 -28.639 -3.247 1.00131.36 H ATOM 763 HD21 LEU A 74 -36.390 -30.288 -4.723 1.00131.69 H ATOM 764 HD22 LEU A 74 -36.226 -30.079 -2.983 1.00131.69 H ATOM 765 HD23 LEU A 74 -37.706 -29.576 -3.801 1.00131.69 H ATOM 766 N GLY A 75 -36.830 -24.978 -0.770 1.00 95.22 N ANISOU 766 N GLY A 75 14716 10449 11016 -1216 2273 -653 ATOM 767 CA GLY A 75 -37.508 -23.941 0.002 1.00 96.68 C ANISOU 767 CA GLY A 75 14767 10785 11181 -1194 2111 -618 ATOM 768 C GLY A 75 -36.492 -22.902 0.497 1.00 94.14 C ANISOU 768 C GLY A 75 14439 10494 10834 -931 1875 -370 ATOM 769 O GLY A 75 -35.322 -22.933 0.112 1.00 88.73 O ANISOU 769 O GLY A 75 13801 9772 10139 -775 1800 -247 ATOM 770 H GLY A 75 -36.424 -25.727 -0.240 1.00 95.22 H ATOM 771 HA3 GLY A 75 -38.006 -24.406 0.851 1.00 96.68 H ATOM 772 HA2 GLY A 75 -38.275 -23.461 -0.597 1.00 96.68 H ATOM 773 N CYS A 76 -36.919 -21.997 1.378 1.00 84.97 N ANISOU 773 N CYS A 76 13218 9400 9665 -900 1784 -323 ATOM 774 CA CYS A 76 -36.048 -21.028 2.060 1.00 90.82 C ANISOU 774 CA CYS A 76 13915 10206 10387 -704 1586 -151 ATOM 775 C CYS A 76 -36.095 -21.284 3.572 1.00 96.64 C ANISOU 775 C CYS A 76 14823 10824 11071 -662 1681 -68 ATOM 776 O CYS A 76 -37.069 -21.847 4.060 1.00 94.78 O ANISOU 776 O CYS A 76 14666 10504 10843 -810 1856 -164 ATOM 777 CB CYS A 76 -36.510 -19.589 1.769 1.00 84.01 C ANISOU 777 CB CYS A 76 12784 9564 9571 -718 1411 -197 ATOM 778 SG CYS A 76 -36.434 -19.102 0.027 1.00 87.77 S ANISOU 778 SG CYS A 76 13054 10227 10067 -697 1285 -230 ATOM 779 H CYS A 76 -37.868 -22.080 1.745 1.00 84.97 H ATOM 780 HA CYS A 76 -35.012 -21.133 1.735 1.00 90.82 H ATOM 781 HB3 CYS A 76 -35.893 -18.883 2.328 1.00 84.01 H ATOM 782 HB2 CYS A 76 -37.531 -19.434 2.124 1.00 84.01 H ATOM 783 N ILE A 77 -35.049 -20.870 4.289 1.00 90.71 N ANISOU 783 N ILE A 77 14113 10097 10255 -476 1580 88 ATOM 784 CA ILE A 77 -34.975 -20.943 5.741 1.00 92.99 C ANISOU 784 CA ILE A 77 14542 10340 10449 -410 1658 180 ATOM 785 C ILE A 77 -35.765 -19.764 6.336 1.00 89.74 C ANISOU 785 C ILE A 77 13974 10054 10071 -503 1575 94 ATOM 786 O ILE A 77 -35.543 -18.620 5.927 1.00 92.61 O ANISOU 786 O ILE A 77 14141 10557 10490 -477 1405 69 ATOM 787 CB ILE A 77 -33.503 -20.921 6.248 1.00100.85 C ANISOU 787 CB ILE A 77 15603 11393 11321 -169 1581 362 ATOM 788 CG1 ILE A 77 -32.667 -22.071 5.635 1.00104.29 C ANISOU 788 CG1 ILE A 77 16201 11693 11732 -46 1684 470 ATOM 789 CG2 ILE A 77 -33.368 -20.932 7.786 1.00 98.21 C ANISOU 789 CG2 ILE A 77 15365 11098 10851 -96 1643 450 ATOM 790 CD1 ILE A 77 -33.245 -23.474 5.878 1.00108.35 C ANISOU 790 CD1 ILE A 77 16919 11957 12291 -161 1968 430 ATOM 791 H ILE A 77 -34.312 -20.338 3.826 1.00 90.71 H ATOM 792 HA ILE A 77 -35.431 -21.876 6.055 1.00 92.99 H ATOM 793 HB ILE A 77 -33.052 -19.989 5.912 1.00100.85 H ATOM 794 HG13 ILE A 77 -31.643 -22.019 6.006 1.00104.29 H ATOM 795 HG12 ILE A 77 -32.582 -21.914 4.559 1.00104.29 H ATOM 796 HG21 ILE A 77 -32.332 -21.063 8.104 1.00 98.21 H ATOM 797 HG22 ILE A 77 -33.714 -20.003 8.238 1.00 98.21 H ATOM 798 HG23 ILE A 77 -33.951 -21.744 8.219 1.00 98.21 H ATOM 799 HD11 ILE A 77 -32.462 -24.229 5.930 1.00108.35 H ATOM 800 HD12 ILE A 77 -33.818 -23.543 6.803 1.00108.35 H ATOM 801 HD13 ILE A 77 -33.916 -23.742 5.065 1.00108.35 H ATOM 802 N ASN A 78 -36.713 -20.068 7.227 1.00 84.07 N ANISOU 802 N ASN A 78 13347 9265 9330 -608 1722 48 ATOM 803 CA ASN A 78 -37.521 -19.082 7.946 1.00 81.51 C ANISOU 803 CA ASN A 78 12882 9040 9049 -714 1678 -51 ATOM 804 C ASN A 78 -36.847 -18.675 9.276 1.00 85.56 C ANISOU 804 C ASN A 78 13439 9626 9445 -606 1644 41 ATOM 805 O ASN A 78 -35.735 -19.119 9.565 1.00 81.93 O ANISOU 805 O ASN A 78 13107 9164 8857 -444 1655 185 ATOM 806 CB ASN A 78 -38.985 -19.581 8.083 1.00 94.02 C ANISOU 806 CB ASN A 78 14501 10544 10677 -914 1850 -190 ATOM 807 CG ASN A 78 -39.240 -20.791 8.988 1.00101.80 C ANISOU 807 CG ASN A 78 15755 11346 11579 -934 2087 -137 ATOM 808 OD1 ASN A 78 -38.370 -21.249 9.725 1.00116.06 O ANISOU 808 OD1 ASN A 78 17714 13122 13262 -770 2114 33 ATOM 809 ND2 ASN A 78 -40.464 -21.303 8.948 1.00 93.12 N ANISOU 809 ND2 ASN A 78 14702 10140 10537 -1132 2279 -287 ATOM 810 H ASN A 78 -36.842 -21.040 7.511 1.00 84.07 H ATOM 811 HA ASN A 78 -37.574 -18.160 7.364 1.00 81.51 H ATOM 812 HB3 ASN A 78 -39.371 -19.810 7.089 1.00 94.02 H ATOM 813 HB2 ASN A 78 -39.612 -18.771 8.459 1.00 94.02 H ATOM 814 HD22 ASN A 78 -40.740 -21.964 9.661 1.00 93.12 H ATOM 815 HD21 ASN A 78 -41.159 -20.951 8.297 1.00 93.12 H ATOM 816 N ALA A 79 -37.522 -17.833 10.071 1.00 89.36 N ANISOU 816 N ALA A 79 13802 10194 9956 -691 1616 -47 ATOM 817 CA ALA A 79 -37.021 -17.305 11.347 1.00 96.70 C ANISOU 817 CA ALA A 79 14719 11252 10768 -626 1579 -13 ATOM 818 C ALA A 79 -36.810 -18.385 12.423 1.00101.21 C ANISOU 818 C ALA A 79 15518 11791 11147 -538 1713 118 ATOM 819 O ALA A 79 -35.948 -18.215 13.283 1.00108.10 O ANISOU 819 O ALA A 79 16370 12841 11863 -416 1650 186 ATOM 820 CB ALA A 79 -37.999 -16.234 11.853 1.00 93.80 C ANISOU 820 CB ALA A 79 14199 10942 10498 -767 1578 -158 ATOM 821 H ALA A 79 -38.472 -17.587 9.840 1.00 89.36 H ATOM 822 HA ALA A 79 -36.048 -16.838 11.174 1.00 96.70 H ATOM 823 HB1 ALA A 79 -37.657 -15.802 12.794 1.00 93.80 H ATOM 824 HB2 ALA A 79 -38.104 -15.419 11.136 1.00 93.80 H ATOM 825 HB3 ALA A 79 -38.986 -16.659 12.035 1.00 93.80 H ATOM 826 N ASP A 80 -37.573 -19.478 12.322 1.00103.26 N ANISOU 826 N ASP A 80 15976 11851 11409 -589 1906 151 ATOM 827 CA ASP A 80 -37.522 -20.639 13.217 1.00108.48 C ANISOU 827 CA ASP A 80 16886 12437 11896 -484 2095 309 ATOM 828 C ASP A 80 -36.322 -21.550 12.893 1.00108.35 C ANISOU 828 C ASP A 80 17017 12365 11785 -254 2129 511 ATOM 829 O ASP A 80 -36.028 -22.471 13.653 1.00108.09 O ANISOU 829 O ASP A 80 17206 12262 11599 -102 2311 697 ATOM 830 CB ASP A 80 -38.830 -21.475 13.182 1.00106.25 C ANISOU 830 CB ASP A 80 16780 11918 11674 -652 2360 249 ATOM 831 CG ASP A 80 -40.132 -20.683 13.333 1.00111.17 C ANISOU 831 CG ASP A 80 17264 12558 12419 -901 2367 29 ATOM 832 OD1 ASP A 80 -41.117 -21.085 12.676 1.00112.11 O ANISOU 832 OD1 ASP A 80 17378 12546 12673 -1085 2480 -119 ATOM 833 OD2 ASP A 80 -40.169 -19.749 14.166 1.00 99.41 O1- ANISOU 833 OD2 ASP A 80 15659 11231 10882 -916 2274 -9 ATOM 834 H ASP A 80 -38.294 -19.526 11.616 1.00103.26 H ATOM 835 HA ASP A 80 -37.392 -20.272 14.238 1.00108.48 H ATOM 836 HB3 ASP A 80 -38.816 -22.195 13.999 1.00106.25 H ATOM 837 HB2 ASP A 80 -38.880 -22.051 12.255 1.00106.25 H ATOM 838 N GLY A 81 -35.648 -21.301 11.757 1.00107.48 N ANISOU 838 N GLY A 81 16802 12268 11766 -218 1993 489 ATOM 839 CA GLY A 81 -34.508 -22.073 11.269 1.00103.83 C ANISOU 839 CA GLY A 81 16467 11739 11245 -10 2029 660 ATOM 840 C GLY A 81 -34.951 -23.281 10.426 1.00100.00 C ANISOU 840 C GLY A 81 16158 10953 10884 -100 2255 637 ATOM 841 O GLY A 81 -34.112 -24.110 10.070 1.00102.54 O ANISOU 841 O GLY A 81 16615 11170 11174 69 2340 781 ATOM 842 H GLY A 81 -35.951 -20.516 11.193 1.00107.48 H ATOM 843 HA3 GLY A 81 -33.884 -22.410 12.099 1.00103.83 H ATOM 844 HA2 GLY A 81 -33.891 -21.420 10.653 1.00103.83 H ATOM 845 N ASN A 82 -36.243 -23.406 10.100 1.00100.93 N ANISOU 845 N ASN A 82 16259 10950 11141 -363 2363 442 ATOM 846 CA ASN A 82 -36.796 -24.515 9.319 1.00102.10 C ANISOU 846 CA ASN A 82 16557 10833 11402 -500 2619 358 ATOM 847 C ASN A 82 -36.873 -24.135 7.841 1.00104.12 C ANISOU 847 C ASN A 82 16612 11159 11792 -628 2476 184 ATOM 848 O ASN A 82 -36.982 -22.953 7.522 1.00109.23 O ANISOU 848 O ASN A 82 17006 12024 12471 -662 2219 104 ATOM 849 CB ASN A 82 -38.207 -24.870 9.841 1.00102.29 C ANISOU 849 CB ASN A 82 16684 10708 11474 -727 2871 221 ATOM 850 CG ASN A 82 -38.255 -25.469 11.249 1.00108.08 C ANISOU 850 CG ASN A 82 17626 11377 12061 -589 3030 412 ATOM 851 OD1 ASN A 82 -39.251 -25.318 11.944 1.00 96.56 O ANISOU 851 OD1 ASN A 82 16405 9770 10514 -372 3213 640 ATOM 852 ND2 ASN A 82 -37.231 -26.188 11.693 1.00 99.75 N ANISOU 852 ND2 ASN A 82 16475 10455 10972 -687 2959 337 ATOM 853 H ASN A 82 -36.884 -22.649 10.326 1.00100.93 H ATOM 854 HA ASN A 82 -36.149 -25.388 9.414 1.00102.10 H ATOM 855 HB3 ASN A 82 -38.679 -25.599 9.179 1.00102.29 H ATOM 856 HB2 ASN A 82 -38.847 -23.986 9.815 1.00102.29 H ATOM 857 HD22 ASN A 82 -37.277 -26.517 12.646 1.00 99.75 H ATOM 858 HD21 ASN A 82 -36.373 -26.261 11.170 1.00 99.75 H ATOM 859 N VAL A 83 -36.841 -25.147 6.960 1.00109.09 N ANISOU 859 N VAL A 83 17352 11603 12492 -698 2668 126 ATOM 860 CA VAL A 83 -37.086 -24.960 5.533 1.00104.06 C ANISOU 860 CA VAL A 83 16531 11045 11963 -864 2593 -77 ATOM 861 C VAL A 83 -38.603 -24.760 5.328 1.00106.23 C ANISOU 861 C VAL A 83 16655 11406 12302 -1149 2639 -337 ATOM 862 O VAL A 83 -39.379 -25.667 5.631 1.00121.74 O ANISOU 862 O VAL A 83 18768 13197 14290 -1311 2924 -440 ATOM 863 CB VAL A 83 -36.633 -26.180 4.673 1.00102.43 C ANISOU 863 CB VAL A 83 16488 10624 11807 -879 2823 -95 ATOM 864 CG1 VAL A 83 -36.849 -25.961 3.158 1.00117.81 C ANISOU 864 CG1 VAL A 83 18213 12720 13828 -1051 2723 -316 ATOM 865 CG2 VAL A 83 -35.158 -26.556 4.912 1.00105.33 C ANISOU 865 CG2 VAL A 83 17000 10915 12104 -569 2793 176 ATOM 866 H VAL A 83 -36.860 -26.098 7.293 1.00109.09 H ATOM 867 HA VAL A 83 -36.546 -24.074 5.195 1.00104.06 H ATOM 868 HB VAL A 83 -37.234 -27.045 4.964 1.00102.43 H ATOM 869 HG11 VAL A 83 -36.475 -26.806 2.580 1.00117.81 H ATOM 870 HG12 VAL A 83 -37.906 -25.850 2.904 1.00117.81 H ATOM 871 HG13 VAL A 83 -36.332 -25.063 2.814 1.00117.81 H ATOM 872 HG21 VAL A 83 -34.897 -27.468 4.377 1.00105.33 H ATOM 873 HG22 VAL A 83 -34.494 -25.774 4.554 1.00105.33 H ATOM 874 HG23 VAL A 83 -34.938 -26.724 5.967 1.00105.33 H ATOM 875 N ASP A 84 -38.966 -23.578 4.836 1.00106.29 N ANISOU 875 N ASP A 84 16373 11679 12334 -1187 2379 -425 ATOM 876 CA ASP A 84 -40.313 -23.169 4.471 1.00101.31 C ANISOU 876 CA ASP A 84 15525 11223 11747 -1406 2365 -654 ATOM 877 C ASP A 84 -40.413 -23.289 2.944 1.00106.95 C ANISOU 877 C ASP A 84 16038 12111 12488 -1510 2309 -819 ATOM 878 O ASP A 84 -39.498 -22.861 2.237 1.00109.71 O ANISOU 878 O ASP A 84 16239 12614 12832 -1367 2080 -730 ATOM 879 CB ASP A 84 -40.596 -21.729 4.948 1.00106.59 C ANISOU 879 CB ASP A 84 16030 12060 12409 -1322 2149 -588 ATOM 880 CG ASP A 84 -42.071 -21.323 4.975 1.00105.58 C ANISOU 880 CG ASP A 84 15677 12118 12320 -1500 2141 -789 ATOM 881 OD1 ASP A 84 -42.861 -21.838 4.147 1.00111.64 O ANISOU 881 OD1 ASP A 84 16269 13048 13101 -1599 2124 -936 ATOM 882 OD2 ASP A 84 -42.378 -20.407 5.760 1.00110.94 O1- ANISOU 882 OD2 ASP A 84 16344 12804 13002 -1527 2152 -794 ATOM 883 H ASP A 84 -38.239 -22.901 4.598 1.00106.29 H ATOM 884 HA ASP A 84 -41.034 -23.842 4.941 1.00101.31 H ATOM 885 HB3 ASP A 84 -40.051 -21.014 4.329 1.00106.59 H ATOM 886 HB2 ASP A 84 -40.188 -21.608 5.950 1.00106.59 H ATOM 887 N TYR A 85 -41.506 -23.886 2.462 1.00112.71 N ANISOU 887 N TYR A 85 16766 12822 13237 -1762 2541 -1068 ATOM 888 CA TYR A 85 -41.711 -24.209 1.053 1.00113.52 C ANISOU 888 CA TYR A 85 16679 13118 13335 -1909 2547 -1280 ATOM 889 C TYR A 85 -42.719 -23.277 0.369 1.00106.89 C ANISOU 889 C TYR A 85 15468 12689 12457 -1970 2352 -1416 ATOM 890 O TYR A 85 -42.926 -23.444 -0.833 1.00 99.45 O ANISOU 890 O TYR A 85 14317 11999 11471 -2049 2306 -1566 ATOM 891 CB TYR A 85 -42.100 -25.694 0.919 1.00123.10 C ANISOU 891 CB TYR A 85 18062 14125 14584 -2167 2929 -1511 ATOM 892 CG TYR A 85 -40.973 -26.658 1.248 1.00129.81 C ANISOU 892 CG TYR A 85 19258 14592 15473 -2038 3119 -1329 ATOM 893 CD1 TYR A 85 -39.997 -26.950 0.273 1.00134.70 C ANISOU 893 CD1 TYR A 85 19890 15196 16096 -1925 3053 -1256 ATOM 894 CD2 TYR A 85 -40.886 -27.259 2.521 1.00128.48 C ANISOU 894 CD2 TYR A 85 19400 14090 15327 -1997 3366 -1204 ATOM 895 CE1 TYR A 85 -38.962 -27.860 0.555 1.00132.56 C ANISOU 895 CE1 TYR A 85 19925 14584 15859 -1775 3237 -1072 ATOM 896 CE2 TYR A 85 -39.844 -28.161 2.808 1.00123.76 C ANISOU 896 CE2 TYR A 85 19113 13163 14748 -1824 3555 -996 ATOM 897 CZ TYR A 85 -38.893 -28.474 1.819 1.00132.37 C ANISOU 897 CZ TYR A 85 20205 14240 15850 -1709 3491 -930 ATOM 898 OH TYR A 85 -37.909 -29.379 2.084 1.00139.84 O ANISOU 898 OH TYR A 85 21451 14868 16812 -1510 3692 -708 ATOM 899 H TYR A 85 -42.280 -24.023 3.101 1.00112.71 H ATOM 900 HA TYR A 85 -40.782 -24.062 0.497 1.00113.52 H ATOM 901 HB3 TYR A 85 -42.407 -25.900 -0.108 1.00123.10 H ATOM 902 HB2 TYR A 85 -42.973 -25.912 1.533 1.00123.10 H ATOM 903 HD1 TYR A 85 -40.048 -26.482 -0.698 1.00134.70 H ATOM 904 HD2 TYR A 85 -41.613 -27.031 3.286 1.00128.48 H ATOM 905 HE1 TYR A 85 -38.232 -28.085 -0.206 1.00132.56 H ATOM 906 HE2 TYR A 85 -39.790 -28.619 3.785 1.00123.76 H ATOM 907 HH TYR A 85 -37.559 -29.794 1.296 1.00139.84 H ATOM 908 N HIS A 86 -43.275 -22.282 1.081 1.00 96.57 N ANISOU 908 N HIS A 86 14066 11470 11155 -1911 2240 -1353 ATOM 909 CA HIS A 86 -44.034 -21.193 0.449 1.00110.08 C ANISOU 909 CA HIS A 86 15423 13567 12834 -1868 2033 -1394 ATOM 910 C HIS A 86 -43.147 -20.241 -0.374 1.00110.84 C ANISOU 910 C HIS A 86 15390 13806 12917 -1628 1783 -1199 ATOM 911 O HIS A 86 -43.678 -19.490 -1.186 1.00113.53 O ANISOU 911 O HIS A 86 15433 14491 13213 -1575 1648 -1225 ATOM 912 CB HIS A 86 -44.813 -20.372 1.493 1.00110.25 C ANISOU 912 CB HIS A 86 15397 13603 12889 -1835 1995 -1349 ATOM 913 CG HIS A 86 -45.840 -21.128 2.294 1.00128.38 C ANISOU 913 CG HIS A 86 17735 15858 15186 -2093 2229 -1584 ATOM 914 ND1 HIS A 86 -45.606 -21.547 3.587 1.00134.19 N ANISOU 914 ND1 HIS A 86 18737 16290 15959 -2133 2385 -1533 ATOM 915 CD2 HIS A 86 -47.133 -21.504 2.013 1.00126.93 C ANISOU 915 CD2 HIS A 86 17360 15909 14958 -2336 2355 -1887 ATOM 916 CE1 HIS A 86 -46.714 -22.143 4.021 1.00122.56 C ANISOU 916 CE1 HIS A 86 17251 14831 14484 -2390 2605 -1784 ATOM 917 NE2 HIS A 86 -47.688 -22.164 3.114 1.00132.22 N ANISOU 917 NE2 HIS A 86 18189 16388 15661 -2530 2592 -2021 ATOM 918 H HIS A 86 -43.104 -22.195 2.085 1.00 96.57 H ATOM 919 HA HIS A 86 -44.749 -21.637 -0.243 1.00110.08 H ATOM 920 HB3 HIS A 86 -45.339 -19.556 0.996 1.00110.25 H ATOM 921 HB2 HIS A 86 -44.118 -19.889 2.182 1.00110.25 H ATOM 922 HD1 HIS A 86 -44.707 -21.476 4.085 1.00134.19 H ATOM 923 HD2 HIS A 86 -47.703 -21.349 1.112 1.00126.93 H ATOM 924 HE1 HIS A 86 -46.800 -22.571 5.011 1.00122.56 H ATOM 925 N MET A 87 -41.832 -20.285 -0.143 1.00106.18 N ANISOU 925 N MET A 87 15005 12983 12354 -1478 1739 -1008 ATOM 926 CA MET A 87 -40.804 -19.534 -0.851 1.00 96.74 C ANISOU 926 CA MET A 87 13724 11874 11160 -1257 1528 -821 ATOM 927 C MET A 87 -39.846 -20.524 -1.525 1.00 99.24 C ANISOU 927 C MET A 87 14195 12052 11461 -1261 1587 -815 ATOM 928 O MET A 87 -39.796 -21.684 -1.114 1.00 94.92 O ANISOU 928 O MET A 87 13858 11285 10923 -1392 1798 -903 ATOM 929 CB MET A 87 -40.063 -18.648 0.163 1.00 90.51 C ANISOU 929 CB MET A 87 13012 10951 10427 -1061 1413 -601 ATOM 930 CG MET A 87 -40.960 -17.654 0.916 1.00 91.03 C ANISOU 930 CG MET A 87 12962 11093 10533 -1060 1394 -606 ATOM 931 SD MET A 87 -41.847 -16.490 -0.156 1.00106.65 S ANISOU 931 SD MET A 87 14589 13417 12516 -941 1254 -573 ATOM 932 CE MET A 87 -40.499 -15.335 -0.497 1.00108.88 C ANISOU 932 CE MET A 87 14899 13602 12869 -693 1118 -329 ATOM 933 H MET A 87 -41.492 -20.996 0.486 1.00106.18 H ATOM 934 HA MET A 87 -41.235 -18.903 -1.624 1.00 96.74 H ATOM 935 HB3 MET A 87 -39.300 -18.097 -0.377 1.00 90.51 H ATOM 936 HB2 MET A 87 -39.534 -19.268 0.885 1.00 90.51 H ATOM 937 HG3 MET A 87 -40.366 -17.084 1.631 1.00 91.03 H ATOM 938 HG2 MET A 87 -41.698 -18.190 1.513 1.00 91.03 H ATOM 939 HE1 MET A 87 -40.843 -14.511 -1.121 1.00108.88 H ATOM 940 HE2 MET A 87 -40.135 -14.931 0.446 1.00108.88 H ATOM 941 HE3 MET A 87 -39.676 -15.837 -1.006 1.00108.88 H ATOM 942 N ASN A 88 -39.098 -20.080 -2.541 1.00 97.29 N ANISOU 942 N ASN A 88 13840 11930 11194 -1132 1438 -726 ATOM 943 CA ASN A 88 -38.139 -20.933 -3.251 1.00101.41 C ANISOU 943 CA ASN A 88 14476 12353 11703 -1132 1483 -731 ATOM 944 C ASN A 88 -36.734 -20.335 -3.190 1.00 97.57 C ANISOU 944 C ASN A 88 14061 11768 11244 -892 1326 -493 ATOM 945 O ASN A 88 -36.566 -19.160 -3.516 1.00 92.48 O ANISOU 945 O ASN A 88 13261 11266 10612 -753 1158 -377 ATOM 946 CB ASN A 88 -38.517 -21.115 -4.740 1.00109.89 C ANISOU 946 CB ASN A 88 15328 13723 12702 -1243 1473 -903 ATOM 947 CG ASN A 88 -39.853 -21.805 -5.018 1.00116.68 C ANISOU 947 CG ASN A 88 16082 14738 13514 -1519 1649 -1203 ATOM 948 OD1 ASN A 88 -40.475 -21.538 -6.041 1.00126.18 O ANISOU 948 OD1 ASN A 88 16990 16330 14622 -1580 1581 -1334 ATOM 949 ND2 ASN A 88 -40.318 -22.698 -4.152 1.00103.93 N ANISOU 949 ND2 ASN A 88 14687 12849 11951 -1681 1888 -1314 ATOM 950 H ASN A 88 -39.165 -19.110 -2.850 1.00 97.29 H ATOM 951 HA ASN A 88 -38.103 -21.912 -2.786 1.00101.41 H ATOM 952 HB3 ASN A 88 -37.746 -21.712 -5.234 1.00109.89 H ATOM 953 HB2 ASN A 88 -38.518 -20.147 -5.241 1.00109.89 H ATOM 954 HD22 ASN A 88 -41.211 -23.132 -4.326 1.00103.93 H ATOM 955 HD21 ASN A 88 -39.872 -22.847 -3.258 1.00103.93 H ATOM 956 N SER A 89 -35.741 -21.176 -2.875 1.00 84.24 N ANISOU 956 N SER A 89 12598 9841 9568 -844 1407 -428 ATOM 957 CA SER A 89 -34.336 -20.890 -3.147 1.00 80.02 C ANISOU 957 CA SER A 89 12114 9249 9040 -648 1283 -256 ATOM 958 C SER A 89 -34.092 -21.111 -4.643 1.00 88.63 C ANISOU 958 C SER A 89 13085 10485 10107 -682 1247 -328 ATOM 959 O SER A 89 -34.331 -22.221 -5.119 1.00 92.46 O ANISOU 959 O SER A 89 13621 10931 10578 -844 1415 -491 ATOM 960 CB SER A 89 -33.431 -21.873 -2.380 1.00 82.53 C ANISOU 960 CB SER A 89 12695 9304 9357 -565 1399 -160 ATOM 961 OG SER A 89 -33.302 -21.567 -1.005 1.00 98.12 O ANISOU 961 OG SER A 89 14745 11212 11322 -485 1381 -58 ATOM 962 H SER A 89 -35.968 -22.151 -2.704 1.00 84.24 H ATOM 963 HA SER A 89 -34.094 -19.863 -2.876 1.00 80.02 H ATOM 964 HB3 SER A 89 -32.428 -21.866 -2.807 1.00 82.53 H ATOM 965 HB2 SER A 89 -33.810 -22.885 -2.501 1.00 82.53 H ATOM 966 HG SER A 89 -34.130 -21.869 -0.582 1.00 98.12 H ATOM 967 N VAL A 90 -33.610 -20.091 -5.356 1.00 99.48 N ANISOU 967 N VAL A 90 14314 12008 11478 -544 1066 -220 ATOM 968 CA VAL A 90 -33.244 -20.214 -6.764 1.00 92.59 C ANISOU 968 CA VAL A 90 13321 11297 10563 -552 1020 -266 ATOM 969 C VAL A 90 -31.805 -19.690 -6.970 1.00 91.04 C ANISOU 969 C VAL A 90 13166 11032 10394 -364 902 -98 ATOM 970 O VAL A 90 -31.419 -18.723 -6.298 1.00 79.53 O ANISOU 970 O VAL A 90 11709 9530 8977 -232 812 36 ATOM 971 CB VAL A 90 -34.223 -19.418 -7.667 1.00 97.29 C ANISOU 971 CB VAL A 90 13635 12237 11093 -583 937 -322 ATOM 972 CG1 VAL A 90 -35.618 -20.069 -7.686 1.00 98.21 C ANISOU 972 CG1 VAL A 90 13670 12487 11159 -798 1061 -542 ATOM 973 CG2 VAL A 90 -34.315 -17.913 -7.352 1.00 97.03 C ANISOU 973 CG2 VAL A 90 13499 12264 11103 -412 810 -146 ATOM 974 H VAL A 90 -33.444 -19.185 -4.920 1.00 99.48 H ATOM 975 HA VAL A 90 -33.289 -21.263 -7.051 1.00 92.59 H ATOM 976 HB VAL A 90 -33.847 -19.497 -8.687 1.00 97.29 H ATOM 977 HG11 VAL A 90 -36.289 -19.563 -8.377 1.00 98.21 H ATOM 978 HG12 VAL A 90 -35.563 -21.111 -8.003 1.00 98.21 H ATOM 979 HG13 VAL A 90 -36.083 -20.055 -6.700 1.00 98.21 H ATOM 980 HG21 VAL A 90 -35.077 -17.434 -7.963 1.00 97.03 H ATOM 981 HG22 VAL A 90 -34.576 -17.737 -6.309 1.00 97.03 H ATOM 982 HG23 VAL A 90 -33.382 -17.394 -7.566 1.00 97.03 H ATOM 983 N PRO A 91 -31.018 -20.355 -7.848 1.00 91.33 N ANISOU 983 N PRO A 91 13226 11066 10409 -368 919 -129 ATOM 984 CA PRO A 91 -29.660 -19.902 -8.166 1.00 95.18 C ANISOU 984 CA PRO A 91 13741 11505 10918 -205 819 5 ATOM 985 C PRO A 91 -29.663 -18.585 -8.956 1.00 92.56 C ANISOU 985 C PRO A 91 13203 11390 10576 -119 680 85 ATOM 986 O PRO A 91 -30.484 -18.399 -9.857 1.00103.30 O ANISOU 986 O PRO A 91 14394 12981 11873 -185 671 19 ATOM 987 CB PRO A 91 -29.077 -21.055 -8.996 1.00 98.11 C ANISOU 987 CB PRO A 91 14182 11826 11268 -267 910 -85 ATOM 988 CG PRO A 91 -30.280 -21.692 -9.672 1.00 96.24 C ANISOU 988 CG PRO A 91 13855 11732 10980 -485 1025 -295 ATOM 989 CD PRO A 91 -31.373 -21.553 -8.619 1.00 92.54 C ANISOU 989 CD PRO A 91 13371 11272 10519 -551 1057 -324 ATOM 990 HA PRO A 91 -29.081 -19.774 -7.251 1.00 95.18 H ATOM 991 HB3 PRO A 91 -28.590 -21.772 -8.332 1.00 98.11 H ATOM 992 HB2 PRO A 91 -28.335 -20.716 -9.719 1.00 98.11 H ATOM 993 HG3 PRO A 91 -30.111 -22.721 -9.994 1.00 96.24 H ATOM 994 HG2 PRO A 91 -30.544 -21.106 -10.554 1.00 96.24 H ATOM 995 HD2 PRO A 91 -32.354 -21.479 -9.088 1.00 92.54 H ATOM 996 HD3 PRO A 91 -31.372 -22.415 -7.949 1.00 92.54 H ATOM 997 N ILE A 92 -28.724 -17.707 -8.610 1.00 89.56 N ANISOU 997 N ILE A 92 12839 10942 10249 27 600 218 ATOM 998 CA ILE A 92 -28.383 -16.535 -9.398 1.00104.69 C ANISOU 998 CA ILE A 92 14608 12986 12184 135 518 321 ATOM 999 C ILE A 92 -27.345 -17.007 -10.429 1.00103.82 C ANISOU 999 C ILE A 92 14500 12908 12041 162 494 319 ATOM 1000 O ILE A 92 -26.214 -17.356 -10.068 1.00 93.80 O ANISOU 1000 O ILE A 92 13357 11486 10799 203 495 327 ATOM 1001 CB ILE A 92 -27.792 -15.402 -8.518 1.00 98.70 C ANISOU 1001 CB ILE A 92 13871 12114 11515 234 496 414 ATOM 1002 CG1 ILE A 92 -28.807 -14.957 -7.439 1.00 88.70 C ANISOU 1002 CG1 ILE A 92 12600 10820 10282 194 533 400 ATOM 1003 CG2 ILE A 92 -27.311 -14.175 -9.330 1.00105.87 C ANISOU 1003 CG2 ILE A 92 14663 13095 12468 340 475 517 ATOM 1004 CD1 ILE A 92 -28.135 -14.331 -6.219 1.00 95.10 C ANISOU 1004 CD1 ILE A 92 13480 11501 11152 231 539 417 ATOM 1005 H ILE A 92 -28.062 -17.945 -7.874 1.00 89.56 H ATOM 1006 HA ILE A 92 -29.272 -16.153 -9.909 1.00104.69 H ATOM 1007 HB ILE A 92 -26.920 -15.813 -8.002 1.00 98.70 H ATOM 1008 HG13 ILE A 92 -29.391 -15.806 -7.077 1.00 88.70 H ATOM 1009 HG12 ILE A 92 -29.535 -14.270 -7.870 1.00 88.70 H ATOM 1010 HG21 ILE A 92 -26.846 -13.423 -8.694 1.00105.87 H ATOM 1011 HG22 ILE A 92 -26.565 -14.441 -10.078 1.00105.87 H ATOM 1012 HG23 ILE A 92 -28.129 -13.685 -9.859 1.00105.87 H ATOM 1013 HD11 ILE A 92 -28.809 -13.678 -5.667 1.00 95.10 H ATOM 1014 HD12 ILE A 92 -27.807 -15.122 -5.544 1.00 95.10 H ATOM 1015 HD13 ILE A 92 -27.265 -13.732 -6.489 1.00 95.10 H ATOM 1016 N GLN A 93 -27.812 -17.081 -11.674 1.00 99.57 N ANISOU 1016 N GLN A 93 13819 12589 11426 139 478 299 ATOM 1017 CA GLN A 93 -27.046 -17.510 -12.834 1.00109.29 C ANISOU 1017 CA GLN A 93 15036 13882 12606 136 466 270 ATOM 1018 C GLN A 93 -26.451 -16.273 -13.519 1.00108.00 C ANISOU 1018 C GLN A 93 14779 13795 12462 285 407 423 ATOM 1019 O GLN A 93 -27.143 -15.267 -13.666 1.00111.60 O ANISOU 1019 O GLN A 93 15110 14383 12912 365 400 528 ATOM 1020 CB GLN A 93 -27.994 -18.270 -13.783 1.00121.98 C ANISOU 1020 CB GLN A 93 16530 15726 14091 -6 505 119 ATOM 1021 CG GLN A 93 -28.656 -19.508 -13.130 1.00125.82 C ANISOU 1021 CG GLN A 93 17093 16139 14573 -181 614 -54 ATOM 1022 CD GLN A 93 -28.320 -20.792 -13.867 1.00135.70 C ANISOU 1022 CD GLN A 93 18456 17287 15817 -317 734 -219 ATOM 1023 OE1 GLN A 93 -29.143 -21.309 -14.618 1.00138.92 O ANISOU 1023 OE1 GLN A 93 19037 17447 16299 -253 767 -171 ATOM 1024 NE2 GLN A 93 -27.113 -21.316 -13.690 1.00135.75 N ANISOU 1024 NE2 GLN A 93 18348 17499 15730 -509 822 -428 ATOM 1025 H GLN A 93 -28.756 -16.789 -11.864 1.00 99.57 H ATOM 1026 HA GLN A 93 -26.246 -18.185 -12.529 1.00109.29 H ATOM 1027 HB3 GLN A 93 -27.444 -18.548 -14.684 1.00121.98 H ATOM 1028 HB2 GLN A 93 -28.775 -17.593 -14.132 1.00121.98 H ATOM 1029 HG3 GLN A 93 -29.740 -19.385 -13.126 1.00125.82 H ATOM 1030 HG2 GLN A 93 -28.368 -19.637 -12.087 1.00125.82 H ATOM 1031 HE22 GLN A 93 -26.866 -22.148 -14.206 1.00135.75 H ATOM 1032 HE21 GLN A 93 -26.475 -20.986 -12.978 1.00135.75 H ATOM 1033 N GLN A 94 -25.188 -16.379 -13.936 1.00 95.80 N ANISOU 1033 N GLN A 94 13301 12146 10951 335 392 446 ATOM 1034 CA AGLN A 94 -24.438 -15.334 -14.624 0.50100.20 C ANISOU 1034 CA AGLN A 94 13791 12743 11536 457 374 572 ATOM 1035 CA BGLN A 94 -24.298 -15.178 -14.590 0.50 97.01 C ANISOU 1035 CA BGLN A 94 13389 12336 11134 458 374 573 ATOM 1036 C GLN A 94 -23.669 -15.959 -15.795 1.00 92.54 C ANISOU 1036 C GLN A 94 12798 11869 10492 437 359 530 ATOM 1037 O GLN A 94 -22.997 -16.974 -15.606 1.00 93.64 O ANISOU 1037 O GLN A 94 13041 11904 10634 370 369 422 ATOM 1038 CB AGLN A 94 -23.548 -14.626 -13.584 0.50 97.04 C ANISOU 1038 CB AGLN A 94 13481 12130 11262 514 385 608 ATOM 1039 CB BGLN A 94 -23.338 -14.513 -13.594 0.50 89.61 C ANISOU 1039 CB BGLN A 94 12538 11187 10323 519 385 611 ATOM 1040 CG AGLN A 94 -22.464 -13.647 -14.103 0.50 99.82 C ANISOU 1040 CG AGLN A 94 13791 12458 11679 608 415 699 ATOM 1041 CG BGLN A 94 -22.252 -13.642 -14.220 0.50 88.46 C ANISOU 1041 CG BGLN A 94 12362 11018 10229 603 406 684 ATOM 1042 CD AGLN A 94 -21.153 -13.775 -13.324 0.50107.72 C ANISOU 1042 CD AGLN A 94 14880 13321 12728 601 399 622 ATOM 1043 CD BGLN A 94 -22.630 -12.255 -14.705 0.50 92.34 C ANISOU 1043 CD BGLN A 94 12760 11558 10767 701 481 831 ATOM 1044 OE1AGLN A 94 -20.637 -12.799 -12.795 0.50113.79 O ANISOU 1044 OE1AGLN A 94 15711 14082 13442 571 360 550 ATOM 1045 OE1BGLN A 94 -23.370 -11.478 -14.081 0.50 99.51 O ANISOU 1045 OE1BGLN A 94 13643 12427 11738 732 538 889 ATOM 1046 NE2AGLN A 94 -20.614 -14.982 -13.218 0.50113.95 N ANISOU 1046 NE2AGLN A 94 15666 14016 13614 627 446 623 ATOM 1047 NE2BGLN A 94 -22.066 -11.913 -15.848 0.50 86.82 N ANISOU 1047 NE2BGLN A 94 12016 10929 10042 763 507 904 ATOM 1048 H GLN A 94 -24.671 -17.232 -13.723 1.00 95.80 H ATOM 1049 HA AGLN A 94 -25.128 -14.595 -15.036 0.50100.20 H ATOM 1050 HA BGLN A 94 -25.013 -14.426 -14.925 0.50 97.01 H ATOM 1051 HB3AGLN A 94 -23.106 -15.390 -12.947 0.50 97.04 H ATOM 1052 HB3BGLN A 94 -22.873 -15.280 -12.975 0.50 89.61 H ATOM 1053 HB2AGLN A 94 -24.206 -14.070 -12.919 0.50 97.04 H ATOM 1054 HB2BGLN A 94 -23.911 -13.918 -12.883 0.50 89.61 H ATOM 1055 HG3AGLN A 94 -22.838 -12.626 -14.022 0.50 99.82 H ATOM 1056 HG3BGLN A 94 -21.783 -14.190 -15.037 0.50 88.46 H ATOM 1057 HG2AGLN A 94 -22.238 -13.793 -15.157 0.50 99.82 H ATOM 1058 HG2BGLN A 94 -21.415 -13.561 -13.526 0.50 88.46 H ATOM 1059 HE22AGLN A 94 -19.797 -15.102 -12.627 0.50113.95 H ATOM 1060 HE22BGLN A 94 -22.256 -11.008 -16.254 0.50 86.82 H ATOM 1061 HE21AGLN A 94 -21.059 -15.789 -13.623 0.50113.95 H ATOM 1062 HE21BGLN A 94 -21.445 -12.557 -16.317 0.50 86.82 H ATOM 1063 N GLU A 95 -23.779 -15.340 -16.975 1.00 99.86 N ANISOU 1063 N GLU A 95 13592 13007 11342 502 353 617 ATOM 1064 CA GLU A 95 -22.975 -15.677 -18.147 1.00 93.72 C ANISOU 1064 CA GLU A 95 12785 12333 10493 493 343 588 ATOM 1065 C GLU A 95 -21.523 -15.210 -17.942 1.00 91.06 C ANISOU 1065 C GLU A 95 12541 11784 10273 565 353 639 ATOM 1066 O GLU A 95 -21.302 -14.009 -17.777 1.00 94.00 O ANISOU 1066 O GLU A 95 12916 12060 10739 656 388 750 ATOM 1067 CB GLU A 95 -23.574 -15.025 -19.411 1.00102.44 C ANISOU 1067 CB GLU A 95 13708 13763 11451 564 338 688 ATOM 1068 CG GLU A 95 -24.402 -15.976 -20.311 1.00126.86 C ANISOU 1068 CG GLU A 95 16691 17142 14367 427 323 521 ATOM 1069 CD GLU A 95 -24.877 -15.326 -21.619 1.00141.51 C ANISOU 1069 CD GLU A 95 18323 19423 16022 515 304 618 ATOM 1070 OE1 GLU A 95 -24.830 -14.078 -21.721 1.00141.90 O ANISOU 1070 OE1 GLU A 95 18295 19556 16064 689 314 825 ATOM 1071 OE2 GLU A 95 -25.158 -16.054 -22.586 1.00138.70 O1- ANISOU 1071 OE2 GLU A 95 17864 19328 15508 422 296 493 ATOM 1072 H GLU A 95 -24.342 -14.506 -17.046 1.00 99.86 H ATOM 1073 HA GLU A 95 -23.000 -16.757 -18.274 1.00 93.72 H ATOM 1074 HB3 GLU A 95 -22.799 -14.535 -19.996 1.00102.44 H ATOM 1075 HB2 GLU A 95 -24.224 -14.205 -19.119 1.00102.44 H ATOM 1076 HG3 GLU A 95 -25.293 -16.288 -19.760 1.00126.86 H ATOM 1077 HG2 GLU A 95 -23.816 -16.868 -20.557 1.00126.86 H ATOM 1078 N ILE A 96 -20.563 -16.133 -18.008 1.00 85.82 N ANISOU 1078 N ILE A 96 11951 11043 9613 515 344 537 ATOM 1079 CA ILE A 96 -19.138 -15.850 -17.868 1.00 84.75 C ANISOU 1079 CA ILE A 96 11887 10738 9576 573 348 545 ATOM 1080 C ILE A 96 -18.423 -16.376 -19.126 1.00 82.42 C ANISOU 1080 C ILE A 96 11577 10512 9226 552 348 492 ATOM 1081 O ILE A 96 -18.919 -17.302 -19.775 1.00 86.00 O ANISOU 1081 O ILE A 96 12012 11078 9586 461 354 397 ATOM 1082 CB ILE A 96 -18.587 -16.480 -16.541 1.00 96.40 C ANISOU 1082 CB ILE A 96 13480 12030 11117 561 338 475 ATOM 1083 CG1 ILE A 96 -18.038 -15.384 -15.600 1.00102.15 C ANISOU 1083 CG1 ILE A 96 14209 12661 11942 624 347 522 ATOM 1084 CG2 ILE A 96 -17.565 -17.635 -16.668 1.00 90.28 C ANISOU 1084 CG2 ILE A 96 12793 11170 10338 557 342 385 ATOM 1085 CD1 ILE A 96 -17.741 -15.887 -14.177 1.00101.68 C ANISOU 1085 CD1 ILE A 96 14233 12496 11906 641 326 458 ATOM 1086 H ILE A 96 -20.801 -17.101 -18.238 1.00 85.82 H ATOM 1087 HA ILE A 96 -18.973 -14.771 -17.853 1.00 84.75 H ATOM 1088 HB ILE A 96 -19.442 -16.918 -16.024 1.00 96.40 H ATOM 1089 HG13 ILE A 96 -18.747 -14.553 -15.544 1.00102.15 H ATOM 1090 HG12 ILE A 96 -17.122 -14.968 -16.022 1.00102.15 H ATOM 1091 HG21 ILE A 96 -17.342 -18.075 -15.696 1.00 90.28 H ATOM 1092 HG22 ILE A 96 -17.945 -18.438 -17.293 1.00 90.28 H ATOM 1093 HG23 ILE A 96 -16.624 -17.298 -17.097 1.00 90.28 H ATOM 1094 HD11 ILE A 96 -17.707 -15.078 -13.447 1.00101.68 H ATOM 1095 HD12 ILE A 96 -18.486 -16.607 -13.833 1.00101.68 H ATOM 1096 HD13 ILE A 96 -16.775 -16.382 -14.141 1.00101.68 H ATOM 1097 N LEU A 97 -17.289 -15.763 -19.476 1.00 90.56 N ANISOU 1097 N LEU A 97 12608 11491 10310 611 362 525 ATOM 1098 CA LEU A 97 -16.434 -16.202 -20.570 1.00 98.04 C ANISOU 1098 CA LEU A 97 13545 12494 11211 588 366 463 ATOM 1099 C LEU A 97 -15.245 -16.959 -19.966 1.00 97.06 C ANISOU 1099 C LEU A 97 13514 12209 11156 598 358 366 ATOM 1100 O LEU A 97 -14.733 -16.550 -18.925 1.00109.25 O ANISOU 1100 O LEU A 97 15089 13646 12775 649 347 376 ATOM 1101 CB LEU A 97 -15.948 -14.981 -21.386 1.00 97.09 C ANISOU 1101 CB LEU A 97 13355 12447 11087 651 406 568 ATOM 1102 CG LEU A 97 -17.057 -14.112 -22.017 1.00105.47 C ANISOU 1102 CG LEU A 97 14324 13668 12081 714 440 728 ATOM 1103 CD1 LEU A 97 -16.496 -12.747 -22.446 1.00110.48 C ANISOU 1103 CD1 LEU A 97 14944 14248 12784 813 542 867 ATOM 1104 CD2 LEU A 97 -17.737 -14.824 -23.195 1.00104.28 C ANISOU 1104 CD2 LEU A 97 14074 13798 11749 673 412 711 ATOM 1105 H LEU A 97 -16.883 -15.035 -18.885 1.00 90.56 H ATOM 1106 HA LEU A 97 -16.978 -16.882 -21.216 1.00 98.04 H ATOM 1107 HB3 LEU A 97 -15.258 -15.320 -22.159 1.00 97.09 H ATOM 1108 HB2 LEU A 97 -15.360 -14.344 -20.734 1.00 97.09 H ATOM 1109 HG LEU A 97 -17.817 -13.902 -21.264 1.00105.47 H ATOM 1110 HD11 LEU A 97 -17.239 -12.153 -22.981 1.00110.48 H ATOM 1111 HD12 LEU A 97 -16.182 -12.161 -21.582 1.00110.48 H ATOM 1112 HD13 LEU A 97 -15.632 -12.871 -23.096 1.00110.48 H ATOM 1113 HD21 LEU A 97 -17.990 -14.146 -24.009 1.00104.28 H ATOM 1114 HD22 LEU A 97 -17.095 -15.594 -23.618 1.00104.28 H ATOM 1115 HD23 LEU A 97 -18.648 -15.313 -22.857 1.00104.28 H ATOM 1116 N VAL A 98 -14.801 -18.027 -20.625 1.00 95.72 N ANISOU 1116 N VAL A 98 13372 12048 10949 555 375 271 ATOM 1117 CA VAL A 98 -13.628 -18.813 -20.242 1.00 89.49 C ANISOU 1117 CA VAL A 98 12656 11135 10212 603 388 200 ATOM 1118 C VAL A 98 -12.763 -19.003 -21.497 1.00100.92 C ANISOU 1118 C VAL A 98 14059 12650 11635 583 410 150 ATOM 1119 O VAL A 98 -13.277 -18.894 -22.610 1.00 96.25 O ANISOU 1119 O VAL A 98 13397 12212 10963 509 424 148 ATOM 1120 CB VAL A 98 -14.026 -20.212 -19.675 1.00 92.22 C ANISOU 1120 CB VAL A 98 13113 11367 10559 581 442 136 ATOM 1121 CG1 VAL A 98 -14.833 -20.101 -18.370 1.00 92.33 C ANISOU 1121 CG1 VAL A 98 13172 11319 10589 601 425 190 ATOM 1122 CG2 VAL A 98 -14.747 -21.144 -20.668 1.00 92.87 C ANISOU 1122 CG2 VAL A 98 13191 11516 10579 439 518 34 ATOM 1123 H VAL A 98 -15.209 -18.273 -21.523 1.00 95.72 H ATOM 1124 HA VAL A 98 -13.021 -18.280 -19.506 1.00 89.49 H ATOM 1125 HB VAL A 98 -13.098 -20.723 -19.409 1.00 92.22 H ATOM 1126 HG11 VAL A 98 -15.205 -21.068 -18.036 1.00 92.33 H ATOM 1127 HG12 VAL A 98 -14.212 -19.701 -17.574 1.00 92.33 H ATOM 1128 HG13 VAL A 98 -15.703 -19.452 -18.477 1.00 92.33 H ATOM 1129 HG21 VAL A 98 -15.063 -22.080 -20.209 1.00 92.87 H ATOM 1130 HG22 VAL A 98 -15.643 -20.677 -21.080 1.00 92.87 H ATOM 1131 HG23 VAL A 98 -14.094 -21.428 -21.495 1.00 92.87 H ATOM 1132 N LEU A 99 -11.470 -19.276 -21.313 1.00 95.59 N ANISOU 1132 N LEU A 99 13412 11900 11010 654 416 106 ATOM 1133 CA LEU A 99 -10.562 -19.604 -22.406 1.00 92.42 C ANISOU 1133 CA LEU A 99 12978 11541 10597 636 448 40 ATOM 1134 C LEU A 99 -10.529 -21.128 -22.550 1.00 93.10 C ANISOU 1134 C LEU A 99 13150 11539 10686 615 526 -55 ATOM 1135 O LEU A 99 -10.177 -21.797 -21.579 1.00101.61 O ANISOU 1135 O LEU A 99 14318 12481 11807 703 555 -47 ATOM 1136 CB LEU A 99 -9.138 -19.091 -22.108 1.00 87.24 C ANISOU 1136 CB LEU A 99 12279 10869 9998 727 425 31 ATOM 1137 CG LEU A 99 -9.019 -17.621 -21.680 1.00 88.06 C ANISOU 1137 CG LEU A 99 12320 11002 10138 737 406 92 ATOM 1138 CD1 LEU A 99 -7.546 -17.242 -21.453 1.00 93.10 C ANISOU 1138 CD1 LEU A 99 12896 11651 10827 787 411 19 ATOM 1139 CD2 LEU A 99 -9.679 -16.679 -22.695 1.00 88.41 C ANISOU 1139 CD2 LEU A 99 12318 11129 10147 674 443 172 ATOM 1140 H LEU A 99 -11.097 -19.394 -20.375 1.00 95.59 H ATOM 1141 HA LEU A 99 -10.900 -19.146 -23.336 1.00 92.42 H ATOM 1142 HB3 LEU A 99 -8.536 -19.238 -22.998 1.00 87.24 H ATOM 1143 HB2 LEU A 99 -8.685 -19.721 -21.349 1.00 87.24 H ATOM 1144 HG LEU A 99 -9.536 -17.520 -20.726 1.00 88.06 H ATOM 1145 HD11 LEU A 99 -7.440 -16.191 -21.182 1.00 93.10 H ATOM 1146 HD12 LEU A 99 -7.105 -17.825 -20.647 1.00 93.10 H ATOM 1147 HD13 LEU A 99 -6.952 -17.421 -22.352 1.00 93.10 H ATOM 1148 HD21 LEU A 99 -9.382 -15.640 -22.542 1.00 88.41 H ATOM 1149 HD22 LEU A 99 -9.426 -16.958 -23.720 1.00 88.41 H ATOM 1150 HD23 LEU A 99 -10.762 -16.726 -22.592 1.00 88.41 H ATOM 1151 N ARG A 100 -10.853 -21.630 -23.738 1.00 93.16 N ANISOU 1151 N ARG A 100 13129 11627 10640 498 583 -140 ATOM 1152 CA ARG A 100 -10.691 -23.019 -24.160 1.00102.98 C ANISOU 1152 CA ARG A 100 14447 12778 11902 437 712 -271 ATOM 1153 C ARG A 100 -9.403 -23.106 -24.971 1.00103.23 C ANISOU 1153 C ARG A 100 14438 12837 11946 457 733 -328 ATOM 1154 O ARG A 100 -9.179 -22.223 -25.792 1.00100.82 O ANISOU 1154 O ARG A 100 14026 12713 11566 387 690 -332 ATOM 1155 CB ARG A 100 -11.874 -23.366 -25.078 1.00108.49 C ANISOU 1155 CB ARG A 100 15107 13605 12511 245 771 -372 ATOM 1156 CG ARG A 100 -11.861 -24.754 -25.774 1.00112.04 C ANISOU 1156 CG ARG A 100 15602 13999 12969 104 949 -567 ATOM 1157 CD ARG A 100 -11.788 -25.962 -24.826 1.00115.60 C ANISOU 1157 CD ARG A 100 16219 14178 13524 117 1112 -609 ATOM 1158 NE ARG A 100 -12.930 -25.954 -23.901 1.00105.61 N ANISOU 1158 NE ARG A 100 14987 12891 12249 110 1080 -546 ATOM 1159 CZ ARG A 100 -13.048 -26.477 -22.679 1.00107.53 C ANISOU 1159 CZ ARG A 100 15384 12895 12579 185 1186 -504 ATOM 1160 NH1 ARG A 100 -12.102 -27.263 -22.163 1.00107.26 N ANISOU 1160 NH1 ARG A 100 15491 12617 12648 305 1340 -494 ATOM 1161 NH2 ARG A 100 -14.120 -26.166 -21.960 1.00111.48 N1+ ANISOU 1161 NH2 ARG A 100 15896 13406 13057 160 1147 -456 ATOM 1162 H ARG A 100 -11.076 -20.985 -24.501 1.00 93.16 H ATOM 1163 HA ARG A 100 -10.651 -23.697 -23.305 1.00102.98 H ATOM 1164 HB3 ARG A 100 -11.951 -22.607 -25.857 1.00108.49 H ATOM 1165 HB2 ARG A 100 -12.774 -23.260 -24.483 1.00108.49 H ATOM 1166 HG3 ARG A 100 -11.010 -24.805 -26.453 1.00112.04 H ATOM 1167 HG2 ARG A 100 -12.727 -24.851 -26.435 1.00112.04 H ATOM 1168 HD3 ARG A 100 -10.839 -25.970 -24.291 1.00115.60 H ATOM 1169 HD2 ARG A 100 -11.819 -26.885 -25.407 1.00115.60 H ATOM 1170 HH22 ARG A 100 -14.194 -26.534 -21.010 1.00111.48 H ATOM 1171 HH21 ARG A 100 -14.791 -25.459 -22.306 1.00111.48 H ATOM 1172 HH12 ARG A 100 -12.182 -27.660 -21.208 1.00107.26 H ATOM 1173 HH11 ARG A 100 -11.256 -27.461 -22.665 1.00107.26 H ATOM 1174 HE ARG A 100 -13.762 -25.470 -24.300 1.00105.61 H ATOM 1175 N ARG A 101 -8.595 -24.148 -24.763 1.00101.41 N ANISOU 1175 N ARG A 101 14285 12447 11799 570 806 -355 ATOM 1176 CA ARG A 101 -7.421 -24.424 -25.597 1.00108.44 C ANISOU 1176 CA ARG A 101 15147 13341 12714 583 861 -439 ATOM 1177 C ARG A 101 -7.813 -24.748 -27.038 1.00109.47 C ANISOU 1177 C ARG A 101 15232 13585 12778 374 943 -581 ATOM 1178 O ARG A 101 -8.667 -25.608 -27.252 1.00120.86 O ANISOU 1178 O ARG A 101 16728 14983 14211 245 1062 -681 ATOM 1179 CB ARG A 101 -6.625 -25.587 -24.998 1.00109.84 C ANISOU 1179 CB ARG A 101 15437 13311 12986 726 993 -454 ATOM 1180 CG ARG A 101 -6.044 -25.182 -23.634 1.00116.94 C ANISOU 1180 CG ARG A 101 16359 14161 13913 959 920 -316 ATOM 1181 CD ARG A 101 -4.526 -25.371 -23.515 1.00128.87 C ANISOU 1181 CD ARG A 101 17788 15738 15438 1117 875 -314 ATOM 1182 NE ARG A 101 -4.190 -26.512 -22.651 1.00130.44 N ANISOU 1182 NE ARG A 101 18072 15808 15683 1346 981 -252 ATOM 1183 CZ ARG A 101 -4.044 -26.536 -21.322 1.00123.91 C ANISOU 1183 CZ ARG A 101 17238 15018 14825 1562 920 -132 ATOM 1184 NH1 ARG A 101 -4.114 -25.414 -20.593 1.00119.15 N ANISOU 1184 NH1 ARG A 101 16549 14560 14163 1539 758 -95 ATOM 1185 NH2 ARG A 101 -3.842 -27.704 -20.721 1.00132.28 N1+ ANISOU 1185 NH2 ARG A 101 18374 15977 15908 1810 1042 -44 ATOM 1186 H ARG A 101 -8.844 -24.846 -24.071 1.00101.41 H ATOM 1187 HA ARG A 101 -6.787 -23.533 -25.614 1.00108.44 H ATOM 1188 HB3 ARG A 101 -5.844 -25.880 -25.704 1.00109.84 H ATOM 1189 HB2 ARG A 101 -7.269 -26.465 -24.899 1.00109.84 H ATOM 1190 HG3 ARG A 101 -6.565 -25.752 -22.869 1.00116.94 H ATOM 1191 HG2 ARG A 101 -6.292 -24.147 -23.413 1.00116.94 H ATOM 1192 HD3 ARG A 101 -4.043 -24.446 -23.209 1.00128.87 H ATOM 1193 HD2 ARG A 101 -4.111 -25.617 -24.488 1.00128.87 H ATOM 1194 HH22 ARG A 101 -3.871 -27.816 -19.720 1.00132.28 H ATOM 1195 HH21 ARG A 101 -4.065 -28.574 -21.246 1.00132.28 H ATOM 1196 HH12 ARG A 101 -4.284 -25.461 -19.597 1.00119.15 H ATOM 1197 HH11 ARG A 101 -4.226 -24.533 -21.064 1.00119.15 H ATOM 1198 HE ARG A 101 -4.428 -27.411 -23.106 1.00130.44 H ATOM 1199 N GLU A 102 -7.165 -24.058 -27.980 1.00113.81 N ANISOU 1199 N GLU A 102 15680 14289 13275 333 899 -608 ATOM 1200 CA GLU A 102 -7.407 -24.208 -29.401 1.00116.42 C ANISOU 1200 CA GLU A 102 15930 14802 13500 144 962 -743 ATOM 1201 C GLU A 102 -6.060 -23.949 -30.120 1.00119.55 C ANISOU 1201 C GLU A 102 16268 15255 13901 175 954 -767 ATOM 1202 O GLU A 102 -5.575 -22.813 -30.052 1.00122.77 O ANISOU 1202 O GLU A 102 16623 15722 14302 260 855 -652 ATOM 1203 CB GLU A 102 -8.524 -23.231 -29.825 1.00116.53 C ANISOU 1203 CB GLU A 102 15841 15073 13361 51 877 -684 ATOM 1204 CG GLU A 102 -8.865 -23.354 -31.325 1.00136.00 C ANISOU 1204 CG GLU A 102 18184 17825 15665 -117 917 -803 ATOM 1205 CD GLU A 102 -10.147 -22.630 -31.726 1.00145.24 C ANISOU 1205 CD GLU A 102 19233 19302 16650 -199 860 -767 ATOM 1206 OE1 GLU A 102 -11.223 -22.967 -31.198 1.00140.38 O ANISOU 1206 OE1 GLU A 102 18649 18636 16053 -186 833 -720 ATOM 1207 OE2 GLU A 102 -10.065 -21.720 -32.577 1.00144.12 O1- ANISOU 1207 OE2 GLU A 102 18956 19472 16333 -262 846 -779 ATOM 1208 H GLU A 102 -6.428 -23.402 -27.740 1.00113.81 H ATOM 1209 HA GLU A 102 -7.792 -25.209 -29.585 1.00116.42 H ATOM 1210 HB3 GLU A 102 -8.228 -22.206 -29.593 1.00116.53 H ATOM 1211 HB2 GLU A 102 -9.423 -23.418 -29.234 1.00116.53 H ATOM 1212 HG3 GLU A 102 -8.999 -24.406 -31.580 1.00136.00 H ATOM 1213 HG2 GLU A 102 -8.037 -22.985 -31.933 1.00136.00 H ATOM 1214 N PRO A 103 -5.462 -24.973 -30.775 1.00133.31 N ANISOU 1214 N PRO A 103 18027 16946 15678 108 1086 -927 ATOM 1215 CA PRO A 103 -5.869 -26.393 -30.739 1.00142.02 C ANISOU 1215 CA PRO A 103 19220 17903 16838 11 1271 -1084 ATOM 1216 C PRO A 103 -5.665 -27.044 -29.341 1.00149.37 C ANISOU 1216 C PRO A 103 20300 18529 17924 192 1346 -1013 ATOM 1217 O PRO A 103 -4.852 -26.537 -28.563 1.00154.10 O ANISOU 1217 O PRO A 103 20907 19062 18583 402 1259 -886 ATOM 1218 CB PRO A 103 -4.977 -27.041 -31.813 1.00134.22 C ANISOU 1218 CB PRO A 103 18204 16929 15866 -77 1401 -1255 ATOM 1219 CG PRO A 103 -3.729 -26.171 -31.882 1.00140.37 C ANISOU 1219 CG PRO A 103 18932 17732 16669 83 1280 -1144 ATOM 1220 CD PRO A 103 -4.265 -24.770 -31.595 1.00132.36 C ANISOU 1220 CD PRO A 103 17845 16887 15557 117 1094 -974 ATOM 1221 HA PRO A 103 -6.902 -26.462 -31.070 1.00142.02 H ATOM 1222 HB3 PRO A 103 -5.498 -27.014 -32.772 1.00134.22 H ATOM 1223 HB2 PRO A 103 -4.739 -28.086 -31.609 1.00134.22 H ATOM 1224 HG3 PRO A 103 -3.195 -26.245 -32.832 1.00140.37 H ATOM 1225 HG2 PRO A 103 -3.038 -26.462 -31.090 1.00140.37 H ATOM 1226 HD2 PRO A 103 -3.521 -24.148 -31.095 1.00132.36 H ATOM 1227 HD3 PRO A 103 -4.554 -24.266 -32.519 1.00132.36 H ATOM 1228 N PRO A 104 -6.388 -28.154 -29.052 1.00149.46 N ANISOU 1228 N PRO A 104 20425 18369 17994 118 1526 -1097 ATOM 1229 CA PRO A 104 -6.243 -28.906 -27.786 1.00142.29 C ANISOU 1229 CA PRO A 104 19675 17174 17214 316 1623 -988 ATOM 1230 C PRO A 104 -4.800 -29.297 -27.422 1.00148.74 C ANISOU 1230 C PRO A 104 20540 17836 18137 565 1680 -917 ATOM 1231 O PRO A 104 -4.044 -29.720 -28.298 1.00151.77 O ANISOU 1231 O PRO A 104 20886 18232 18548 523 1761 -1031 ATOM 1232 CB PRO A 104 -7.121 -30.149 -28.000 1.00134.87 C ANISOU 1232 CB PRO A 104 18852 16059 16332 141 1895 -1149 ATOM 1233 CG PRO A 104 -8.198 -29.681 -28.961 1.00143.25 C ANISOU 1233 CG PRO A 104 19769 17419 17242 -160 1842 -1319 ATOM 1234 CD PRO A 104 -7.444 -28.735 -29.888 1.00149.19 C ANISOU 1234 CD PRO A 104 20364 18430 17893 -163 1668 -1308 ATOM 1235 HA PRO A 104 -6.673 -28.284 -26.998 1.00142.29 H ATOM 1236 HB3 PRO A 104 -7.537 -30.526 -27.064 1.00134.87 H ATOM 1237 HB2 PRO A 104 -6.546 -30.956 -28.459 1.00134.87 H ATOM 1238 HG3 PRO A 104 -8.943 -29.110 -28.405 1.00143.25 H ATOM 1239 HG2 PRO A 104 -8.713 -30.489 -29.481 1.00143.25 H ATOM 1240 HD2 PRO A 104 -6.991 -29.275 -30.721 1.00149.19 H ATOM 1241 HD3 PRO A 104 -8.143 -27.999 -30.286 1.00149.19 H ATOM 1242 N HIS A 105 -4.453 -29.130 -26.141 1.00157.59 N ANISOU 1242 N HIS A 105 21717 18868 19293 826 1617 -728 ATOM 1243 CA HIS A 105 -3.156 -29.388 -25.510 1.00161.73 C ANISOU 1243 CA HIS A 105 22268 19298 19884 1136 1654 -614 ATOM 1244 C HIS A 105 -2.052 -28.367 -25.850 1.00167.51 C ANISOU 1244 C HIS A 105 22822 20269 20556 1205 1441 -604 ATOM 1245 O HIS A 105 -0.993 -28.423 -25.226 1.00175.44 O ANISOU 1245 O HIS A 105 23794 21292 21572 1474 1409 -504 ATOM 1246 CB HIS A 105 -2.691 -30.854 -25.665 1.00153.42 C ANISOU 1246 CB HIS A 105 21361 17967 18964 1188 1982 -681 ATOM 1247 CG HIS A 105 -3.685 -31.884 -25.181 1.00154.18 C ANISOU 1247 CG HIS A 105 21650 17797 19135 1181 2216 -649 ATOM 1248 ND1 HIS A 105 -4.632 -32.456 -26.009 1.00157.33 N ANISOU 1248 ND1 HIS A 105 22126 18070 19581 879 2441 -855 ATOM 1249 CD2 HIS A 105 -3.888 -32.449 -23.942 1.00142.99 C ANISOU 1249 CD2 HIS A 105 20351 16244 17736 1417 2262 -448 ATOM 1250 CE1 HIS A 105 -5.345 -33.304 -25.267 1.00147.45 C ANISOU 1250 CE1 HIS A 105 21047 16581 18398 922 2636 -790 ATOM 1251 NE2 HIS A 105 -4.939 -33.370 -24.008 1.00140.45 N ANISOU 1251 NE2 HIS A 105 20196 15676 17491 1262 2527 -523 ATOM 1252 H HIS A 105 -5.166 -28.861 -25.454 1.00157.59 H ATOM 1253 HA HIS A 105 -3.338 -29.244 -24.447 1.00161.73 H ATOM 1254 HB3 HIS A 105 -1.773 -31.002 -25.094 1.00153.42 H ATOM 1255 HB2 HIS A 105 -2.426 -31.066 -26.700 1.00153.42 H ATOM 1256 HD1 HIS A 105 -4.768 -32.240 -26.985 1.00157.33 H ATOM 1257 HD2 HIS A 105 -3.370 -32.256 -23.015 1.00142.99 H ATOM 1258 HE1 HIS A 105 -6.165 -33.890 -25.653 1.00147.45 H ATOM 1259 N CYS A 106 -2.302 -27.426 -26.775 1.00167.80 N ANISOU 1259 N CYS A 106 22740 20499 20518 992 1310 -692 ATOM 1260 CA CYS A 106 -1.369 -26.352 -27.130 1.00150.46 C ANISOU 1260 CA CYS A 106 20386 18509 18274 1021 1141 -692 ATOM 1261 C CYS A 106 -1.470 -25.236 -26.058 1.00137.72 C ANISOU 1261 C CYS A 106 18706 17014 16608 1096 956 -576 ATOM 1262 O CYS A 106 -2.480 -24.531 -26.028 1.00125.85 O ANISOU 1262 O CYS A 106 17188 15577 15052 959 876 -546 ATOM 1263 CB CYS A 106 -1.640 -25.850 -28.568 1.00151.42 C ANISOU 1263 CB CYS A 106 20429 18769 18337 785 1123 -807 ATOM 1264 SG CYS A 106 -0.359 -24.710 -29.161 1.00116.71 S ANISOU 1264 SG CYS A 106 15879 14579 13885 796 941 -760 ATOM 1265 H CYS A 106 -3.200 -27.437 -27.247 1.00167.80 H ATOM 1266 HA CYS A 106 -0.369 -26.782 -27.135 1.00150.46 H ATOM 1267 HB3 CYS A 106 -2.598 -25.337 -28.644 1.00151.42 H ATOM 1268 HB2 CYS A 106 -1.678 -26.700 -29.252 1.00151.42 H ATOM 1269 HG CYS A 106 -0.845 -23.594 -28.615 1.00116.71 H ATOM 1270 N PRO A 107 -0.483 -25.126 -25.138 1.00114.93 N ANISOU 1270 N PRO A 107 15751 14194 13722 1312 888 -521 ATOM 1271 CA PRO A 107 -0.705 -24.500 -23.815 1.00119.00 C ANISOU 1271 CA PRO A 107 16247 14771 14197 1417 778 -417 ATOM 1272 C PRO A 107 -0.887 -22.969 -23.769 1.00112.26 C ANISOU 1272 C PRO A 107 15286 14064 13303 1290 644 -429 ATOM 1273 O PRO A 107 -1.106 -22.436 -22.677 1.00103.25 O ANISOU 1273 O PRO A 107 14148 12947 12135 1329 576 -357 ATOM 1274 CB PRO A 107 0.540 -24.929 -23.021 1.00121.54 C ANISOU 1274 CB PRO A 107 16489 15186 14503 1695 768 -387 ATOM 1275 CG PRO A 107 1.630 -25.074 -24.075 1.00120.52 C ANISOU 1275 CG PRO A 107 16263 15130 14401 1676 799 -509 ATOM 1276 CD PRO A 107 0.868 -25.685 -25.241 1.00125.85 C ANISOU 1276 CD PRO A 107 17048 15642 15129 1467 916 -573 ATOM 1277 HA PRO A 107 -1.594 -24.934 -23.355 1.00119.00 H ATOM 1278 HB3 PRO A 107 0.347 -25.896 -22.551 1.00121.54 H ATOM 1279 HB2 PRO A 107 0.824 -24.241 -22.224 1.00121.54 H ATOM 1280 HG3 PRO A 107 2.476 -25.677 -23.745 1.00120.52 H ATOM 1281 HG2 PRO A 107 2.008 -24.094 -24.366 1.00120.52 H ATOM 1282 HD2 PRO A 107 1.346 -25.471 -26.199 1.00125.85 H ATOM 1283 HD3 PRO A 107 0.829 -26.766 -25.116 1.00125.85 H ATOM 1284 N AASN A 108 -0.726 -22.278 -24.902 0.50107.13 N ANISOU 1284 N AASN A 108 14560 13489 12655 1144 641 -514 ATOM 1285 N BASN A 108 -0.544 -22.259 -24.781 0.50106.18 N ANISOU 1285 N BASN A 108 14430 13380 12534 1153 633 -513 ATOM 1286 CA AASN A 108 -0.580 -20.826 -24.995 0.50 98.46 C ANISOU 1286 CA AASN A 108 13354 12511 11547 1049 581 -542 ATOM 1287 CA BASN A 108 -0.634 -20.778 -24.630 0.50 95.89 C ANISOU 1287 CA BASN A 108 13038 12179 11217 1056 566 -518 ATOM 1288 C AASN A 108 -1.538 -20.172 -26.005 0.50 96.76 C ANISOU 1288 C AASN A 108 13180 12273 11311 866 601 -496 ATOM 1289 C BASN A 108 -1.454 -20.209 -25.798 0.50 95.92 C ANISOU 1289 C BASN A 108 13075 12166 11205 868 599 -494 ATOM 1290 O AASN A 108 -1.481 -18.950 -26.143 0.50107.87 O ANISOU 1290 O AASN A 108 14526 13736 12723 788 606 -494 ATOM 1291 O BASN A 108 -1.249 -19.039 -26.173 0.50106.69 O ANISOU 1291 O BASN A 108 14374 13590 12574 787 610 -502 ATOM 1292 CB AASN A 108 0.900 -20.482 -25.321 0.50 99.77 C ANISOU 1292 CB AASN A 108 13389 12790 11728 1061 599 -668 ATOM 1293 CB BASN A 108 0.737 -20.099 -24.471 0.50 98.06 C ANISOU 1293 CB BASN A 108 13157 12601 11501 1094 550 -631 ATOM 1294 CG AASN A 108 1.405 -20.972 -26.690 0.50 91.94 C ANISOU 1294 CG AASN A 108 12414 11771 10749 982 676 -733 ATOM 1295 CG BASN A 108 1.546 -20.504 -23.248 0.50 92.97 C ANISOU 1295 CG BASN A 108 12424 12077 10822 1300 498 -655 ATOM 1296 OD1AASN A 108 0.798 -21.829 -27.326 0.50 87.80 O ANISOU 1296 OD1AASN A 108 11985 11165 10211 895 723 -703 ATOM 1297 OD1BASN A 108 1.571 -19.807 -22.232 0.50 89.05 O ANISOU 1297 OD1BASN A 108 11845 11695 10296 1323 442 -673 ATOM 1298 ND2AASN A 108 2.545 -20.470 -27.148 0.50 89.98 N ANISOU 1298 ND2AASN A 108 12052 11619 10517 996 698 -849 ATOM 1299 ND2BASN A 108 2.259 -21.608 -23.356 0.50 90.33 N ANISOU 1299 ND2BASN A 108 12090 11745 10484 1460 531 -661 ATOM 1300 H AASN A 108 -0.528 -22.766 -25.768 0.50107.13 H ATOM 1301 H BASN A 108 -0.163 -22.659 -25.626 0.50106.18 H ATOM 1302 HA AASN A 108 -0.838 -20.362 -24.043 0.50 98.46 H ATOM 1303 HA BASN A 108 -1.197 -20.582 -23.717 0.50 95.89 H ATOM 1304 HB3AASN A 108 1.544 -20.917 -24.555 0.50 99.77 H ATOM 1305 HB3BASN A 108 0.605 -19.017 -24.472 0.50 98.06 H ATOM 1306 HB2AASN A 108 1.037 -19.401 -25.258 0.50 99.77 H ATOM 1307 HB2BASN A 108 1.331 -20.273 -25.368 0.50 98.06 H ATOM 1308 HD22AASN A 108 2.893 -20.809 -28.034 0.50 89.98 H ATOM 1309 HD22BASN A 108 2.817 -21.927 -22.577 0.50 90.33 H ATOM 1310 HD21AASN A 108 3.040 -19.736 -26.665 0.50 89.98 H ATOM 1311 HD21BASN A 108 2.247 -22.134 -24.218 0.50 90.33 H ATOM 1312 N SER A 109 -2.373 -20.967 -26.682 1.00 87.46 N ANISOU 1312 N SER A 109 12094 11031 10105 805 633 -462 ATOM 1313 CA SER A 109 -3.311 -20.502 -27.700 1.00 85.37 C ANISOU 1313 CA SER A 109 11830 10831 9776 652 653 -430 ATOM 1314 C SER A 109 -4.711 -20.962 -27.287 1.00 93.68 C ANISOU 1314 C SER A 109 12953 11857 10785 602 646 -374 ATOM 1315 O SER A 109 -4.892 -22.144 -26.969 1.00 96.06 O ANISOU 1315 O SER A 109 13329 12065 11105 610 701 -427 ATOM 1316 CB SER A 109 -2.896 -21.078 -29.071 1.00 86.61 C ANISOU 1316 CB SER A 109 11964 11040 9905 573 723 -527 ATOM 1317 OG SER A 109 -3.669 -20.536 -30.127 1.00 95.60 O ANISOU 1317 OG SER A 109 13089 12296 10938 443 741 -497 ATOM 1318 H SER A 109 -2.473 -21.945 -26.445 1.00 87.46 H ATOM 1319 HA SER A 109 -3.300 -19.414 -27.762 1.00 85.37 H ATOM 1320 HB3 SER A 109 -3.015 -22.163 -29.079 1.00 86.61 H ATOM 1321 HB2 SER A 109 -1.845 -20.878 -29.275 1.00 86.61 H ATOM 1322 HG SER A 109 -4.478 -21.070 -30.214 1.00 95.60 H ATOM 1323 N PHE A 110 -5.666 -20.023 -27.270 1.00 93.74 N ANISOU 1323 N PHE A 110 12936 11943 10737 549 611 -275 ATOM 1324 CA PHE A 110 -7.017 -20.264 -26.779 1.00 91.02 C ANISOU 1324 CA PHE A 110 12635 11598 10351 513 591 -224 ATOM 1325 C PHE A 110 -8.085 -19.630 -27.683 1.00 90.80 C ANISOU 1325 C PHE A 110 12542 11753 10206 432 584 -149 ATOM 1326 O PHE A 110 -7.822 -18.640 -28.371 1.00106.52 O ANISOU 1326 O PHE A 110 14473 13832 12168 448 593 -70 ATOM 1327 CB PHE A 110 -7.174 -19.667 -25.363 1.00 91.62 C ANISOU 1327 CB PHE A 110 12736 11587 10488 605 533 -139 ATOM 1328 CG PHE A 110 -6.256 -20.176 -24.262 1.00 96.81 C ANISOU 1328 CG PHE A 110 13424 12138 11220 728 522 -179 ATOM 1329 CD1 PHE A 110 -6.660 -21.224 -23.409 1.00101.07 C ANISOU 1329 CD1 PHE A 110 14056 12568 11776 789 542 -178 ATOM 1330 CD2 PHE A 110 -4.950 -19.663 -24.137 1.00103.61 C ANISOU 1330 CD2 PHE A 110 14212 13032 12122 791 505 -212 ATOM 1331 CE1 PHE A 110 -5.809 -21.681 -22.413 1.00 97.13 C ANISOU 1331 CE1 PHE A 110 13574 12016 11314 952 535 -176 ATOM 1332 CE2 PHE A 110 -4.100 -20.163 -23.162 1.00 96.52 C ANISOU 1332 CE2 PHE A 110 13303 12117 11253 927 481 -248 ATOM 1333 CZ PHE A 110 -4.526 -21.161 -22.297 1.00 97.41 C ANISOU 1333 CZ PHE A 110 13505 12143 11361 1027 491 -211 ATOM 1334 H PHE A 110 -5.449 -19.061 -27.521 1.00 93.74 H ATOM 1335 HA PHE A 110 -7.197 -21.336 -26.760 1.00 91.02 H ATOM 1336 HB3 PHE A 110 -8.204 -19.832 -25.046 1.00 91.62 H ATOM 1337 HB2 PHE A 110 -7.052 -18.586 -25.420 1.00 91.62 H ATOM 1338 HD1 PHE A 110 -7.646 -21.652 -23.498 1.00101.07 H ATOM 1339 HD2 PHE A 110 -4.603 -18.890 -24.808 1.00103.61 H ATOM 1340 HE1 PHE A 110 -6.155 -22.454 -21.742 1.00 97.13 H ATOM 1341 HE2 PHE A 110 -3.098 -19.776 -23.091 1.00 96.52 H ATOM 1342 HZ PHE A 110 -3.849 -21.537 -21.545 1.00 97.41 H ATOM 1343 N ARG A 111 -9.312 -20.142 -27.555 1.00 95.38 N ANISOU 1343 N ARG A 111 13128 12393 10717 361 584 -166 ATOM 1344 CA ARG A 111 -10.544 -19.494 -27.976 1.00104.93 C ANISOU 1344 CA ARG A 111 14259 13809 11802 329 555 -67 ATOM 1345 C ARG A 111 -11.326 -19.068 -26.731 1.00108.73 C ANISOU 1345 C ARG A 111 14784 14194 12333 373 513 7 ATOM 1346 O ARG A 111 -11.337 -19.781 -25.730 1.00 96.49 O ANISOU 1346 O ARG A 111 13324 12482 10857 365 525 -66 ATOM 1347 CB ARG A 111 -11.394 -20.478 -28.793 1.00119.41 C ANISOU 1347 CB ARG A 111 16019 15865 13485 182 594 -196 ATOM 1348 CG ARG A 111 -12.578 -19.819 -29.523 1.00131.37 C ANISOU 1348 CG ARG A 111 17402 17694 14820 173 558 -97 ATOM 1349 CD ARG A 111 -13.646 -20.822 -29.979 1.00144.14 C ANISOU 1349 CD ARG A 111 18935 19537 16295 -8 600 -296 ATOM 1350 NE ARG A 111 -14.450 -20.241 -31.068 1.00153.65 N ANISOU 1350 NE ARG A 111 19951 21173 17257 -20 568 -240 ATOM 1351 CZ ARG A 111 -14.050 -20.175 -32.344 1.00162.75 C ANISOU 1351 CZ ARG A 111 20997 22585 18257 -8 575 -206 ATOM 1352 NH1 ARG A 111 -12.860 -20.624 -32.741 1.00152.06 N ANISOU 1352 NH1 ARG A 111 19711 21074 16988 -4 615 -239 ATOM 1353 NH2 ARG A 111 -14.887 -19.658 -33.242 1.00163.55 N1+ ANISOU 1353 NH2 ARG A 111 20909 23131 18103 15 545 -132 ATOM 1354 H ARG A 111 -9.433 -20.953 -26.946 1.00 95.38 H ATOM 1355 HA ARG A 111 -10.320 -18.615 -28.580 1.00104.93 H ATOM 1356 HB3 ARG A 111 -11.739 -21.303 -28.166 1.00119.41 H ATOM 1357 HB2 ARG A 111 -10.757 -20.930 -29.550 1.00119.41 H ATOM 1358 HG3 ARG A 111 -12.227 -19.175 -30.332 1.00131.37 H ATOM 1359 HG2 ARG A 111 -13.089 -19.155 -28.830 1.00131.37 H ATOM 1360 HD3 ARG A 111 -14.351 -20.962 -29.156 1.00144.14 H ATOM 1361 HD2 ARG A 111 -13.262 -21.818 -30.199 1.00144.14 H ATOM 1362 HH22 ARG A 111 -14.617 -19.667 -34.210 1.00163.55 H ATOM 1363 HH21 ARG A 111 -15.858 -19.549 -32.996 1.00163.55 H ATOM 1364 HH12 ARG A 111 -12.381 -20.429 -33.605 1.00152.06 H ATOM 1365 HH11 ARG A 111 -12.240 -21.195 -32.134 1.00152.06 H ATOM 1366 HE ARG A 111 -15.149 -19.587 -30.732 1.00153.65 H ATOM 1367 N LEU A 112 -12.029 -17.943 -26.840 1.00105.76 N ANISOU 1367 N LEU A 112 14354 13910 11921 435 487 166 ATOM 1368 CA LEU A 112 -13.038 -17.521 -25.885 1.00108.14 C ANISOU 1368 CA LEU A 112 14669 14169 12249 477 455 259 ATOM 1369 C LEU A 112 -14.315 -18.390 -26.009 1.00106.36 C ANISOU 1369 C LEU A 112 14407 14089 11916 374 447 176 ATOM 1370 O LEU A 112 -14.958 -18.374 -27.058 1.00107.07 O ANISOU 1370 O LEU A 112 14389 14442 11852 307 458 137 ATOM 1371 CB LEU A 112 -13.297 -16.019 -26.160 1.00111.51 C ANISOU 1371 CB LEU A 112 15030 14692 12647 575 479 454 ATOM 1372 CG LEU A 112 -13.861 -15.219 -24.973 1.00123.76 C ANISOU 1372 CG LEU A 112 16616 16102 14305 654 489 569 ATOM 1373 CD1 LEU A 112 -12.878 -15.252 -23.781 1.00122.38 C ANISOU 1373 CD1 LEU A 112 16520 15688 14292 665 498 494 ATOM 1374 CD2 LEU A 112 -14.191 -13.779 -25.412 1.00124.62 C ANISOU 1374 CD2 LEU A 112 16667 16301 14383 763 572 777 ATOM 1375 H LEU A 112 -11.945 -17.377 -27.679 1.00105.76 H ATOM 1376 HA LEU A 112 -12.623 -17.650 -24.885 1.00108.14 H ATOM 1377 HB3 LEU A 112 -13.945 -15.919 -27.034 1.00111.51 H ATOM 1378 HB2 LEU A 112 -12.358 -15.545 -26.450 1.00111.51 H ATOM 1379 HG LEU A 112 -14.793 -15.690 -24.659 1.00123.76 H ATOM 1380 HD11 LEU A 112 -12.802 -14.303 -23.255 1.00122.38 H ATOM 1381 HD12 LEU A 112 -13.179 -16.003 -23.049 1.00122.38 H ATOM 1382 HD13 LEU A 112 -11.871 -15.510 -24.111 1.00122.38 H ATOM 1383 HD21 LEU A 112 -13.784 -13.041 -24.727 1.00124.62 H ATOM 1384 HD22 LEU A 112 -13.788 -13.541 -26.398 1.00124.62 H ATOM 1385 HD23 LEU A 112 -15.267 -13.618 -25.453 1.00124.62 H ATOM 1386 N GLU A 113 -14.678 -19.118 -24.950 1.00112.00 N ANISOU 1386 N GLU A 113 15199 14659 12698 352 441 133 ATOM 1387 CA GLU A 113 -16.005 -19.716 -24.779 1.00107.10 C ANISOU 1387 CA GLU A 113 14544 14155 11993 237 459 39 ATOM 1388 C GLU A 113 -16.891 -18.824 -23.905 1.00102.41 C ANISOU 1388 C GLU A 113 13954 13526 11430 296 418 151 ATOM 1389 O GLU A 113 -16.380 -17.908 -23.264 1.00106.60 O ANISOU 1389 O GLU A 113 14562 13857 12082 397 395 246 ATOM 1390 CB GLU A 113 -15.915 -21.091 -24.114 1.00103.78 C ANISOU 1390 CB GLU A 113 14240 13555 11639 131 547 -144 ATOM 1391 CG GLU A 113 -15.439 -22.205 -25.048 1.00113.07 C ANISOU 1391 CG GLU A 113 15396 14793 12773 29 626 -301 ATOM 1392 CD GLU A 113 -15.442 -23.592 -24.399 1.00126.64 C ANISOU 1392 CD GLU A 113 17246 16293 14578 -71 777 -478 ATOM 1393 OE1 GLU A 113 -15.222 -24.555 -25.153 1.00131.24 O ANISOU 1393 OE1 GLU A 113 17805 16934 15127 -201 884 -653 ATOM 1394 OE2 GLU A 113 -15.554 -23.720 -23.156 1.00128.55 O1- ANISOU 1394 OE2 GLU A 113 17621 16297 14925 -12 811 -439 ATOM 1395 H GLU A 113 -14.095 -19.103 -24.113 1.00112.00 H ATOM 1396 HA GLU A 113 -16.472 -19.828 -25.751 1.00107.10 H ATOM 1397 HB3 GLU A 113 -16.873 -21.388 -23.684 1.00103.78 H ATOM 1398 HB2 GLU A 113 -15.216 -21.019 -23.289 1.00103.78 H ATOM 1399 HG3 GLU A 113 -14.433 -21.981 -25.396 1.00113.07 H ATOM 1400 HG2 GLU A 113 -16.073 -22.245 -25.933 1.00113.07 H ATOM 1401 N LYS A 114 -18.187 -19.149 -23.860 1.00101.29 N ANISOU 1401 N LYS A 114 13713 13602 11172 223 416 119 ATOM 1402 CA LYS A 114 -19.178 -18.532 -22.999 1.00108.27 C ANISOU 1402 CA LYS A 114 14577 14496 12065 264 387 206 ATOM 1403 C LYS A 114 -19.952 -19.665 -22.316 1.00106.39 C ANISOU 1403 C LYS A 114 14425 14135 11864 126 443 35 ATOM 1404 O LYS A 114 -20.339 -20.609 -23.007 1.00 99.58 O ANISOU 1404 O LYS A 114 13531 13375 10928 -33 516 -157 ATOM 1405 CB LYS A 114 -20.071 -17.614 -23.852 1.00121.57 C ANISOU 1405 CB LYS A 114 16064 16554 13572 303 357 297 ATOM 1406 CG LYS A 114 -21.232 -16.978 -23.071 1.00137.82 C ANISOU 1406 CG LYS A 114 18088 18629 15650 393 334 432 ATOM 1407 CD LYS A 114 -21.892 -15.808 -23.817 1.00145.26 C ANISOU 1407 CD LYS A 114 18870 19851 16471 562 324 652 ATOM 1408 CE LYS A 114 -21.624 -14.436 -23.173 1.00153.45 C ANISOU 1408 CE LYS A 114 19996 20642 17666 737 366 872 ATOM 1409 NZ LYS A 114 -22.693 -13.462 -23.475 1.00164.46 N1+ ANISOU 1409 NZ LYS A 114 21274 22224 18990 927 407 1113 ATOM 1410 H LYS A 114 -18.497 -20.033 -24.245 1.00101.29 H ATOM 1411 HA LYS A 114 -18.687 -17.930 -22.238 1.00108.27 H ATOM 1412 HB3 LYS A 114 -20.474 -18.184 -24.693 1.00121.57 H ATOM 1413 HB2 LYS A 114 -19.450 -16.829 -24.283 1.00121.57 H ATOM 1414 HG3 LYS A 114 -20.883 -16.669 -22.083 1.00137.82 H ATOM 1415 HG2 LYS A 114 -21.986 -17.747 -22.881 1.00137.82 H ATOM 1416 HD3 LYS A 114 -22.960 -16.000 -23.883 1.00145.26 H ATOM 1417 HD2 LYS A 114 -21.549 -15.815 -24.854 1.00145.26 H ATOM 1418 HE3 LYS A 114 -20.631 -14.080 -23.452 1.00153.45 H ATOM 1419 HE2 LYS A 114 -21.627 -14.531 -22.086 1.00153.45 H ATOM 1420 HZ1 LYS A 114 -23.530 -13.802 -22.972 1.00164.46 H ATOM 1421 HZ2 LYS A 114 -22.513 -12.562 -23.064 1.00164.46 H ATOM 1422 HZ3 LYS A 114 -22.971 -13.400 -24.438 1.00164.46 H ATOM 1423 N ILE A 115 -20.149 -19.555 -21.001 1.00103.24 N ANISOU 1423 N ILE A 115 14141 13504 11582 177 438 91 ATOM 1424 CA ILE A 115 -20.842 -20.529 -20.163 1.00103.20 C ANISOU 1424 CA ILE A 115 14230 13368 11611 65 516 -36 ATOM 1425 C ILE A 115 -21.716 -19.774 -19.145 1.00107.46 C ANISOU 1425 C ILE A 115 14760 13892 12177 115 472 62 ATOM 1426 O ILE A 115 -21.517 -18.576 -18.942 1.00101.26 O ANISOU 1426 O ILE A 115 13933 13117 11424 249 400 229 ATOM 1427 CB ILE A 115 -19.837 -21.448 -19.398 1.00103.15 C ANISOU 1427 CB ILE A 115 14418 13051 11725 90 593 -77 ATOM 1428 CG1 ILE A 115 -18.874 -20.691 -18.450 1.00102.49 C ANISOU 1428 CG1 ILE A 115 14405 12802 11734 269 516 78 ATOM 1429 CG2 ILE A 115 -19.055 -22.355 -20.370 1.00 98.91 C ANISOU 1429 CG2 ILE A 115 13884 12528 11168 23 667 -198 ATOM 1430 CD1 ILE A 115 -18.086 -21.607 -17.506 1.00 93.79 C ANISOU 1430 CD1 ILE A 115 13475 11450 10712 332 591 64 ATOM 1431 H ILE A 115 -19.854 -18.718 -20.498 1.00103.24 H ATOM 1432 HA ILE A 115 -21.514 -21.139 -20.769 1.00103.20 H ATOM 1433 HB ILE A 115 -20.433 -22.115 -18.770 1.00103.15 H ATOM 1434 HG13 ILE A 115 -19.431 -19.997 -17.824 1.00102.49 H ATOM 1435 HG12 ILE A 115 -18.185 -20.077 -19.033 1.00102.49 H ATOM 1436 HG21 ILE A 115 -18.522 -23.150 -19.846 1.00 98.91 H ATOM 1437 HG22 ILE A 115 -19.723 -22.839 -21.085 1.00 98.91 H ATOM 1438 HG23 ILE A 115 -18.318 -21.794 -20.946 1.00 98.91 H ATOM 1439 HD11 ILE A 115 -17.568 -21.020 -16.748 1.00 93.79 H ATOM 1440 HD12 ILE A 115 -18.753 -22.297 -16.990 1.00 93.79 H ATOM 1441 HD13 ILE A 115 -17.340 -22.191 -18.043 1.00 93.79 H ATOM 1442 N LEU A 116 -22.665 -20.479 -18.528 1.00103.38 N ANISOU 1442 N LEU A 116 14287 13335 11659 -4 546 -54 ATOM 1443 CA LEU A 116 -23.575 -19.971 -17.511 1.00101.03 C ANISOU 1443 CA LEU A 116 13993 13008 11387 12 527 2 ATOM 1444 C LEU A 116 -23.113 -20.577 -16.178 1.00101.88 C ANISOU 1444 C LEU A 116 14307 12789 11613 53 579 23 ATOM 1445 O LEU A 116 -23.000 -21.798 -16.117 1.00106.99 O ANISOU 1445 O LEU A 116 15082 13280 12289 -16 699 -80 ATOM 1446 CB LEU A 116 -24.992 -20.459 -17.893 1.00102.63 C ANISOU 1446 CB LEU A 116 14080 13433 11480 -168 592 -171 ATOM 1447 CG LEU A 116 -26.138 -19.719 -17.182 1.00108.42 C ANISOU 1447 CG LEU A 116 14702 14316 12176 -143 542 -108 ATOM 1448 CD1 LEU A 116 -26.315 -18.290 -17.730 1.00113.60 C ANISOU 1448 CD1 LEU A 116 15190 15207 12766 23 432 82 ATOM 1449 CD2 LEU A 116 -27.444 -20.516 -17.318 1.00116.52 C ANISOU 1449 CD2 LEU A 116 15618 15557 13096 -352 628 -333 ATOM 1450 H LEU A 116 -22.683 -21.482 -18.625 1.00103.38 H ATOM 1451 HA LEU A 116 -23.551 -18.882 -17.465 1.00101.03 H ATOM 1452 HB3 LEU A 116 -25.063 -21.529 -17.682 1.00102.63 H ATOM 1453 HB2 LEU A 116 -25.135 -20.378 -18.970 1.00102.63 H ATOM 1454 HG LEU A 116 -25.905 -19.661 -16.119 1.00108.42 H ATOM 1455 HD11 LEU A 116 -27.334 -17.923 -17.604 1.00113.60 H ATOM 1456 HD12 LEU A 116 -25.656 -17.589 -17.222 1.00113.60 H ATOM 1457 HD13 LEU A 116 -26.084 -18.240 -18.796 1.00113.60 H ATOM 1458 HD21 LEU A 116 -28.300 -19.966 -16.927 1.00116.52 H ATOM 1459 HD22 LEU A 116 -27.654 -20.762 -18.359 1.00116.52 H ATOM 1460 HD23 LEU A 116 -27.391 -21.455 -16.765 1.00116.52 H ATOM 1461 N VAL A 117 -22.821 -19.745 -15.172 1.00112.92 N ANISOU 1461 N VAL A 117 15734 14097 13073 175 510 158 ATOM 1462 CA VAL A 117 -22.321 -20.186 -13.867 1.00108.90 C ANISOU 1462 CA VAL A 117 15390 13351 12637 245 540 197 ATOM 1463 C VAL A 117 -23.300 -19.741 -12.768 1.00107.41 C ANISOU 1463 C VAL A 117 15203 13144 12464 236 531 233 ATOM 1464 O VAL A 117 -23.782 -18.604 -12.813 1.00108.50 O ANISOU 1464 O VAL A 117 15227 13387 12609 270 462 303 ATOM 1465 CB VAL A 117 -20.917 -19.559 -13.591 1.00103.35 C ANISOU 1465 CB VAL A 117 14697 12597 11974 390 469 286 ATOM 1466 CG1 VAL A 117 -20.414 -19.635 -12.130 1.00118.72 C ANISOU 1466 CG1 VAL A 117 16736 14418 13954 493 459 344 ATOM 1467 CG2 VAL A 117 -19.873 -20.208 -14.516 1.00113.63 C ANISOU 1467 CG2 VAL A 117 16038 13868 13267 395 511 233 ATOM 1468 H VAL A 117 -22.911 -18.738 -15.291 1.00112.92 H ATOM 1469 HA VAL A 117 -22.241 -21.274 -13.832 1.00108.90 H ATOM 1470 HB VAL A 117 -20.970 -18.502 -13.851 1.00103.35 H ATOM 1471 HG11 VAL A 117 -19.385 -19.286 -12.041 1.00118.72 H ATOM 1472 HG12 VAL A 117 -21.010 -19.020 -11.454 1.00118.72 H ATOM 1473 HG13 VAL A 117 -20.447 -20.661 -11.762 1.00118.72 H ATOM 1474 HG21 VAL A 117 -18.885 -19.762 -14.392 1.00113.63 H ATOM 1475 HG22 VAL A 117 -19.789 -21.275 -14.298 1.00113.63 H ATOM 1476 HG23 VAL A 117 -20.152 -20.111 -15.565 1.00113.63 H ATOM 1477 N SER A 118 -23.556 -20.626 -11.801 1.00111.20 N ANISOU 1477 N SER A 118 15822 13472 12957 201 624 196 ATOM 1478 CA SER A 118 -24.318 -20.319 -10.599 1.00 93.66 C ANISOU 1478 CA SER A 118 13640 11196 10752 201 630 229 ATOM 1479 C SER A 118 -23.402 -19.723 -9.521 1.00 94.72 C ANISOU 1479 C SER A 118 13817 11262 10911 352 563 335 ATOM 1480 O SER A 118 -22.510 -20.421 -9.040 1.00 89.72 O ANISOU 1480 O SER A 118 13290 10532 10266 447 595 366 ATOM 1481 CB SER A 118 -24.996 -21.602 -10.094 1.00 95.84 C ANISOU 1481 CB SER A 118 14056 11334 11023 105 785 150 ATOM 1482 OG SER A 118 -26.213 -21.788 -10.795 1.00115.74 O ANISOU 1482 OG SER A 118 16493 13971 13511 -77 856 0 ATOM 1483 H SER A 118 -23.117 -21.554 -11.848 1.00111.20 H ATOM 1484 HA SER A 118 -25.093 -19.588 -10.828 1.00 93.66 H ATOM 1485 HB3 SER A 118 -25.246 -21.510 -9.035 1.00 95.84 H ATOM 1486 HB2 SER A 118 -24.340 -22.471 -10.187 1.00 95.84 H ATOM 1487 HG SER A 118 -26.914 -21.819 -10.137 1.00115.74 H ATOM 1488 N VAL A 119 -23.625 -18.453 -9.161 1.00 92.64 N ANISOU 1488 N VAL A 119 13460 11065 10674 373 493 378 ATOM 1489 CA VAL A 119 -22.715 -17.689 -8.304 1.00103.77 C ANISOU 1489 CA VAL A 119 14854 12471 12103 477 436 427 ATOM 1490 C VAL A 119 -23.144 -17.710 -6.820 1.00 92.00 C ANISOU 1490 C VAL A 119 13421 10941 10596 480 458 435 ATOM 1491 O VAL A 119 -22.296 -17.689 -5.931 1.00107.67 O ANISOU 1491 O VAL A 119 15399 12955 12555 561 425 447 ATOM 1492 CB VAL A 119 -22.638 -16.219 -8.808 1.00106.85 C ANISOU 1492 CB VAL A 119 15100 12944 12554 485 393 449 ATOM 1493 CG1 VAL A 119 -21.706 -15.302 -7.993 1.00119.87 C ANISOU 1493 CG1 VAL A 119 16715 14601 14228 549 369 439 ATOM 1494 CG2 VAL A 119 -22.196 -16.179 -10.287 1.00101.95 C ANISOU 1494 CG2 VAL A 119 14425 12384 11926 484 380 456 ATOM 1495 H VAL A 119 -24.410 -17.951 -9.572 1.00 92.64 H ATOM 1496 HA VAL A 119 -21.709 -18.114 -8.356 1.00103.77 H ATOM 1497 HB VAL A 119 -23.638 -15.786 -8.755 1.00106.85 H ATOM 1498 HG11 VAL A 119 -21.730 -14.285 -8.387 1.00119.87 H ATOM 1499 HG12 VAL A 119 -21.990 -15.233 -6.945 1.00119.87 H ATOM 1500 HG13 VAL A 119 -20.675 -15.657 -8.034 1.00119.87 H ATOM 1501 HG21 VAL A 119 -21.976 -15.164 -10.617 1.00101.95 H ATOM 1502 HG22 VAL A 119 -21.286 -16.762 -10.443 1.00101.95 H ATOM 1503 HG23 VAL A 119 -22.961 -16.583 -10.951 1.00101.95 H ATOM 1504 N GLY A 120 -24.451 -17.797 -6.563 1.00 89.75 N ANISOU 1504 N GLY A 120 13182 10614 10306 390 519 410 ATOM 1505 CA GLY A 120 -25.029 -17.828 -5.225 1.00 84.63 C ANISOU 1505 CA GLY A 120 12575 9936 9647 369 548 412 ATOM 1506 C GLY A 120 -26.529 -18.060 -5.410 1.00 83.76 C ANISOU 1506 C GLY A 120 12464 9812 9548 237 615 357 ATOM 1507 O GLY A 120 -26.991 -18.273 -6.534 1.00 75.93 O ANISOU 1507 O GLY A 120 11429 8865 8557 174 630 313 ATOM 1508 H GLY A 120 -25.111 -17.894 -7.325 1.00 89.75 H ATOM 1509 HA3 GLY A 120 -24.863 -16.890 -4.696 1.00 84.63 H ATOM 1510 HA2 GLY A 120 -24.598 -18.635 -4.632 1.00 84.63 H ATOM 1511 N CYS A 121 -27.308 -18.018 -4.321 1.00 86.15 N ANISOU 1511 N CYS A 121 12810 10077 9844 191 662 344 ATOM 1512 CA CYS A 121 -28.759 -18.237 -4.366 1.00 82.45 C ANISOU 1512 CA CYS A 121 12321 9621 9386 52 732 268 ATOM 1513 C CYS A 121 -29.497 -17.086 -3.672 1.00 80.51 C ANISOU 1513 C CYS A 121 11969 9437 9184 35 698 273 ATOM 1514 O CYS A 121 -28.956 -16.438 -2.772 1.00 71.55 O ANISOU 1514 O CYS A 121 10839 8287 8061 101 665 312 ATOM 1515 CB CYS A 121 -29.125 -19.603 -3.745 1.00 93.61 C ANISOU 1515 CB CYS A 121 13920 10887 10759 -3 877 235 ATOM 1516 SG CYS A 121 -28.394 -21.031 -4.597 1.00103.62 S ANISOU 1516 SG CYS A 121 15317 12042 12011 0 987 212 ATOM 1517 H CYS A 121 -26.929 -17.761 -3.418 1.00 86.15 H ATOM 1518 HA CYS A 121 -29.103 -18.232 -5.400 1.00 82.45 H ATOM 1519 HB3 CYS A 121 -30.210 -19.726 -3.752 1.00 93.61 H ATOM 1520 HB2 CYS A 121 -28.813 -19.643 -2.705 1.00 93.61 H ATOM 1521 N THR A 122 -30.728 -16.854 -4.121 1.00 83.56 N ANISOU 1521 N THR A 122 12241 9920 9588 -50 714 221 ATOM 1522 CA THR A 122 -31.633 -15.848 -3.600 1.00 79.81 C ANISOU 1522 CA THR A 122 11669 9492 9162 -68 718 221 ATOM 1523 C THR A 122 -32.984 -16.550 -3.340 1.00 81.37 C ANISOU 1523 C THR A 122 11881 9713 9325 -210 804 114 ATOM 1524 O THR A 122 -33.224 -17.633 -3.890 1.00 82.74 O ANISOU 1524 O THR A 122 12123 9868 9447 -298 870 33 ATOM 1525 CB THR A 122 -31.739 -14.684 -4.627 1.00 78.67 C ANISOU 1525 CB THR A 122 11348 9468 9076 18 668 293 ATOM 1526 OG1 THR A 122 -32.269 -13.519 -4.046 1.00 73.34 O ANISOU 1526 OG1 THR A 122 10602 8785 8481 38 701 317 ATOM 1527 CG2 THR A 122 -32.544 -14.978 -5.903 1.00 82.44 C ANISOU 1527 CG2 THR A 122 11685 10139 9500 -4 659 272 ATOM 1528 H THR A 122 -31.144 -17.465 -4.821 1.00 83.56 H ATOM 1529 HA THR A 122 -31.277 -15.461 -2.645 1.00 79.81 H ATOM 1530 HB THR A 122 -30.728 -14.425 -4.937 1.00 78.67 H ATOM 1531 HG1 THR A 122 -31.523 -13.050 -3.633 1.00 73.34 H ATOM 1532 HG21 THR A 122 -32.586 -14.114 -6.560 1.00 82.44 H ATOM 1533 HG22 THR A 122 -32.100 -15.797 -6.465 1.00 82.44 H ATOM 1534 HG23 THR A 122 -33.574 -15.246 -5.680 1.00 82.44 H ATOM 1535 N CYS A 123 -33.810 -15.967 -2.464 1.00 75.03 N ANISOU 1535 N CYS A 123 11018 8934 8558 -243 828 96 ATOM 1536 CA CYS A 123 -35.099 -16.501 -2.049 1.00 81.46 C ANISOU 1536 CA CYS A 123 11832 9771 9347 -385 918 -19 ATOM 1537 C CYS A 123 -36.189 -15.697 -2.762 1.00 84.83 C ANISOU 1537 C CYS A 123 12023 10427 9782 -388 893 -44 ATOM 1538 O CYS A 123 -36.311 -14.499 -2.489 1.00 76.47 O ANISOU 1538 O CYS A 123 10862 9396 8797 -285 864 46 ATOM 1539 CB CYS A 123 -35.250 -16.399 -0.516 1.00 82.27 C ANISOU 1539 CB CYS A 123 12048 9742 9470 -410 972 -17 ATOM 1540 SG CYS A 123 -36.795 -17.109 0.091 1.00 84.97 S ANISOU 1540 SG CYS A 123 12430 10076 9781 -606 1117 -172 ATOM 1541 H CYS A 123 -33.605 -15.032 -2.106 1.00 75.03 H ATOM 1542 HA CYS A 123 -35.171 -17.550 -2.322 1.00 81.46 H ATOM 1543 HB3 CYS A 123 -35.209 -15.361 -0.191 1.00 82.27 H ATOM 1544 HB2 CYS A 123 -34.432 -16.906 -0.005 1.00 82.27 H ATOM 1545 N VAL A 124 -36.936 -16.358 -3.655 1.00 87.14 N ANISOU 1545 N VAL A 124 12222 10890 9998 -500 928 -170 ATOM 1546 CA VAL A 124 -38.024 -15.765 -4.423 1.00 91.14 C ANISOU 1546 CA VAL A 124 12459 11715 10456 -481 895 -199 ATOM 1547 C VAL A 124 -39.384 -16.333 -3.996 1.00 90.72 C ANISOU 1547 C VAL A 124 12335 11774 10360 -658 988 -385 ATOM 1548 O VAL A 124 -39.500 -17.521 -3.684 1.00 93.30 O ANISOU 1548 O VAL A 124 12812 11968 10670 -841 1102 -536 ATOM 1549 CB VAL A 124 -37.865 -16.024 -5.953 1.00 88.61 C ANISOU 1549 CB VAL A 124 12012 11617 10041 -456 841 -212 ATOM 1550 CG1 VAL A 124 -36.615 -15.331 -6.517 1.00 92.40 C ANISOU 1550 CG1 VAL A 124 12557 11978 10571 -283 761 -30 ATOM 1551 CG2 VAL A 124 -37.894 -17.507 -6.386 1.00 99.09 C ANISOU 1551 CG2 VAL A 124 13415 12940 11296 -668 933 -422 ATOM 1552 H VAL A 124 -36.831 -17.371 -3.726 1.00 87.14 H ATOM 1553 HA VAL A 124 -38.060 -14.694 -4.247 1.00 91.14 H ATOM 1554 HB VAL A 124 -38.718 -15.550 -6.441 1.00 88.61 H ATOM 1555 HG11 VAL A 124 -36.509 -15.499 -7.588 1.00 92.40 H ATOM 1556 HG12 VAL A 124 -36.647 -14.257 -6.361 1.00 92.40 H ATOM 1557 HG13 VAL A 124 -35.717 -15.707 -6.029 1.00 92.40 H ATOM 1558 HG21 VAL A 124 -37.694 -17.614 -7.451 1.00 99.09 H ATOM 1559 HG22 VAL A 124 -37.134 -18.084 -5.858 1.00 99.09 H ATOM 1560 HG23 VAL A 124 -38.859 -17.979 -6.196 1.00 99.09 H ATOM 1561 N THR A 125 -40.394 -15.467 -4.065 1.00106.30 N ANISOU 1561 N THR A 125 14096 13963 12329 -590 964 -360 ATOM 1562 CA THR A 125 -41.807 -15.813 -4.085 1.00114.16 C ANISOU 1562 CA THR A 125 14915 15214 13249 -736 1028 -551 ATOM 1563 C THR A 125 -42.151 -16.655 -5.349 1.00108.23 C ANISOU 1563 C THR A 125 14002 14774 12345 -859 1036 -732 ATOM 1564 O THR A 125 -41.668 -16.305 -6.436 1.00112.47 O ANISOU 1564 O THR A 125 14416 15506 12812 -728 942 -638 ATOM 1565 CB THR A 125 -42.628 -14.498 -4.170 1.00120.98 C ANISOU 1565 CB THR A 125 15547 16293 14129 -557 984 -432 ATOM 1566 OG1 THR A 125 -42.087 -13.547 -3.268 1.00139.77 O ANISOU 1566 OG1 THR A 125 18095 18346 16663 -465 1000 -286 ATOM 1567 CG2 THR A 125 -44.114 -14.677 -3.820 1.00129.11 C ANISOU 1567 CG2 THR A 125 16375 17601 15081 -685 1043 -622 ATOM 1568 H THR A 125 -40.224 -14.474 -4.184 1.00106.30 H ATOM 1569 HA THR A 125 -42.048 -16.320 -3.154 1.00114.16 H ATOM 1570 HB THR A 125 -42.538 -14.061 -5.167 1.00120.98 H ATOM 1571 HG1 THR A 125 -42.624 -12.740 -3.305 1.00139.77 H ATOM 1572 HG21 THR A 125 -44.653 -13.730 -3.854 1.00129.11 H ATOM 1573 HG22 THR A 125 -44.619 -15.358 -4.504 1.00129.11 H ATOM 1574 HG23 THR A 125 -44.227 -15.086 -2.815 1.00129.11 H ATOM 1575 N PRO A 126 -42.935 -17.750 -5.229 1.00129.74 N ANISOU 1575 N PRO A 126 16743 17535 15016 -1133 1172 -1012 ATOM 1576 CA PRO A 126 -43.491 -18.466 -6.398 1.00135.71 C ANISOU 1576 CA PRO A 126 17286 18662 15614 -1297 1208 -1255 ATOM 1577 C PRO A 126 -44.589 -17.660 -7.133 1.00137.08 C ANISOU 1577 C PRO A 126 17060 19382 15642 -1227 1131 -1304 ATOM 1578 O PRO A 126 -44.681 -16.441 -6.985 1.00112.93 O ANISOU 1578 O PRO A 126 13939 16328 12640 -1051 1076 -1136 ATOM 1579 CB PRO A 126 -44.036 -19.783 -5.799 1.00135.40 C ANISOU 1579 CB PRO A 126 17424 18420 15604 -1627 1439 -1549 ATOM 1580 CG PRO A 126 -43.414 -19.891 -4.420 1.00134.97 C ANISOU 1580 CG PRO A 126 17689 17888 15707 -1595 1506 -1410 ATOM 1581 CD PRO A 126 -43.294 -18.437 -3.998 1.00131.56 C ANISOU 1581 CD PRO A 126 17199 17456 15332 -1310 1326 -1122 ATOM 1582 HA PRO A 126 -42.670 -18.685 -7.082 1.00135.71 H ATOM 1583 HB3 PRO A 126 -43.811 -20.649 -6.422 1.00135.40 H ATOM 1584 HB2 PRO A 126 -45.118 -19.743 -5.675 1.00135.40 H ATOM 1585 HG3 PRO A 126 -42.418 -20.325 -4.499 1.00134.97 H ATOM 1586 HG2 PRO A 126 -43.988 -20.504 -3.727 1.00134.97 H ATOM 1587 HD2 PRO A 126 -44.244 -18.048 -3.627 1.00131.56 H ATOM 1588 HD3 PRO A 126 -42.550 -18.347 -3.214 1.00131.56 H ATOM 1589 N ILE A 127 -45.440 -18.356 -7.902 1.00159.82 N ANISOU 1589 N ILE A 127 19662 22732 18332 -1367 1148 -1548 ATOM 1590 CA ILE A 127 -46.652 -17.783 -8.514 1.00169.86 C ANISOU 1590 CA ILE A 127 20516 24597 19427 -1301 1086 -1621 ATOM 1591 C ILE A 127 -47.609 -18.936 -8.804 1.00166.67 C ANISOU 1591 C ILE A 127 19920 24519 18888 -1670 1239 -2079 ATOM 1592 O ILE A 127 -47.275 -20.124 -8.869 1.00173.86 O ANISOU 1592 O ILE A 127 20755 25619 19687 -1920 1331 -2374 ATOM 1593 CB ILE A 127 -46.344 -16.923 -9.789 1.00166.77 C ANISOU 1593 CB ILE A 127 19860 24628 18878 -992 913 -1391 ATOM 1594 CG1 ILE A 127 -47.543 -16.046 -10.234 1.00156.88 C ANISOU 1594 CG1 ILE A 127 18198 23954 17456 -803 841 -1346 ATOM 1595 CG2 ILE A 127 -45.805 -17.749 -10.982 1.00166.76 C ANISOU 1595 CG2 ILE A 127 19794 24837 18730 -1131 913 -1561 ATOM 1596 CD1 ILE A 127 -47.832 -14.879 -9.277 1.00142.11 C ANISOU 1596 CD1 ILE A 127 16391 21855 15748 -532 820 -1045 ATOM 1597 H ILE A 127 -45.366 -19.363 -7.975 1.00159.82 H ATOM 1598 HA ILE A 127 -47.143 -17.168 -7.759 1.00169.86 H ATOM 1599 HXT ILE A 127 -48.641 -18.632 -8.972 1.00166.67 H ATOM 1600 HB ILE A 127 -45.544 -16.229 -9.523 1.00166.77 H ATOM 1601 HG13 ILE A 127 -48.441 -16.650 -10.371 1.00156.88 H ATOM 1602 HG12 ILE A 127 -47.336 -15.618 -11.216 1.00156.88 H ATOM 1603 HG21 ILE A 127 -45.436 -17.104 -11.782 1.00166.76 H ATOM 1604 HG22 ILE A 127 -44.973 -18.382 -10.671 1.00166.76 H ATOM 1605 HG23 ILE A 127 -46.569 -18.400 -11.411 1.00166.76 H ATOM 1606 HD11 ILE A 127 -48.648 -14.256 -9.647 1.00142.11 H ATOM 1607 HD12 ILE A 127 -48.116 -15.220 -8.281 1.00142.11 H ATOM 1608 HD13 ILE A 127 -46.955 -14.240 -9.170 1.00142.11 H TER 1609 ILE A 127 ATOM 1610 N PRO B 19 4.975 -11.534 -17.195 1.00174.00 N ANISOU 1610 N PRO B 19 21713 23178 21220 -343 1224 -949 ATOM 1611 CA PRO B 19 5.784 -12.327 -18.148 1.00162.11 C ANISOU 1611 CA PRO B 19 20340 21498 19758 -314 1320 -887 ATOM 1612 C PRO B 19 5.194 -13.708 -18.579 1.00145.31 C ANISOU 1612 C PRO B 19 18400 19242 17567 -154 1235 -654 ATOM 1613 O PRO B 19 5.941 -14.587 -19.012 1.00135.74 O ANISOU 1613 O PRO B 19 17150 18089 16334 -48 1247 -606 ATOM 1614 CB PRO B 19 7.192 -12.464 -17.536 1.00168.20 C ANISOU 1614 CB PRO B 19 20846 22528 20535 -301 1367 -1037 ATOM 1615 CG PRO B 19 7.288 -11.205 -16.694 1.00169.23 C ANISOU 1615 CG PRO B 19 20727 22903 20668 -417 1366 -1255 ATOM 1616 CD PRO B 19 5.882 -11.119 -16.117 1.00170.63 C ANISOU 1616 CD PRO B 19 21007 23011 20814 -442 1277 -1189 ATOM 1617 H PRO B 19 4.680 -10.704 -17.706 1.00174.00 H ATOM 1618 HA PRO B 19 5.870 -11.776 -19.089 1.00162.11 H ATOM 1619 HB3 PRO B 19 7.980 -12.502 -18.291 1.00168.20 H ATOM 1620 HB2 PRO B 19 7.284 -13.354 -16.909 1.00168.20 H ATOM 1621 HG3 PRO B 19 7.524 -10.316 -17.281 1.00169.23 H ATOM 1622 HG2 PRO B 19 8.053 -11.278 -15.921 1.00169.23 H ATOM 1623 HD2 PRO B 19 5.794 -11.781 -15.253 1.00170.63 H ATOM 1624 HD3 PRO B 19 5.641 -10.109 -15.784 1.00170.63 H ATOM 1625 N ARG B 20 3.868 -13.894 -18.497 1.00129.90 N ANISOU 1625 N ARG B 20 16642 17126 15589 -141 1164 -521 ATOM 1626 CA ARG B 20 3.175 -15.088 -18.975 1.00122.05 C ANISOU 1626 CA ARG B 20 15823 16011 14538 -14 1094 -324 ATOM 1627 C ARG B 20 2.108 -14.679 -20.000 1.00115.95 C ANISOU 1627 C ARG B 20 15311 14960 13785 -74 1117 -245 ATOM 1628 O ARG B 20 0.919 -14.609 -19.677 1.00114.80 O ANISOU 1628 O ARG B 20 15233 14771 13616 -91 1038 -196 ATOM 1629 CB ARG B 20 2.679 -15.929 -17.773 1.00125.67 C ANISOU 1629 CB ARG B 20 16208 16627 14914 99 957 -240 ATOM 1630 CG ARG B 20 1.825 -17.149 -18.174 1.00131.24 C ANISOU 1630 CG ARG B 20 17078 17216 15570 221 917 -59 ATOM 1631 CD ARG B 20 1.741 -18.251 -17.101 1.00141.62 C ANISOU 1631 CD ARG B 20 18296 18710 16803 378 835 27 ATOM 1632 NE ARG B 20 0.610 -19.186 -17.304 1.00151.27 N ANISOU 1632 NE ARG B 20 19695 19789 17992 426 788 171 ATOM 1633 CZ ARG B 20 0.294 -19.947 -18.379 1.00150.14 C ANISOU 1633 CZ ARG B 20 19761 19423 17862 424 830 260 ATOM 1634 NH1 ARG B 20 1.047 -19.978 -19.491 1.00143.64 N ANISOU 1634 NH1 ARG B 20 19015 18481 17080 386 919 237 ATOM 1635 NH2 ARG B 20 -0.814 -20.701 -18.348 1.00139.98 N1+ ANISOU 1635 NH2 ARG B 20 18603 18037 16547 451 790 361 ATOM 1636 H ARG B 20 3.304 -13.121 -18.169 1.00129.90 H ATOM 1637 HA ARG B 20 3.869 -15.724 -19.527 1.00122.05 H ATOM 1638 HB3 ARG B 20 2.101 -15.296 -17.096 1.00125.67 H ATOM 1639 HB2 ARG B 20 3.552 -16.252 -17.202 1.00125.67 H ATOM 1640 HG3 ARG B 20 2.350 -17.566 -19.033 1.00131.24 H ATOM 1641 HG2 ARG B 20 0.839 -16.857 -18.541 1.00131.24 H ATOM 1642 HD3 ARG B 20 1.768 -17.839 -16.090 1.00141.62 H ATOM 1643 HD2 ARG B 20 2.627 -18.882 -17.190 1.00141.62 H ATOM 1644 HH22 ARG B 20 -1.065 -21.294 -19.132 1.00139.98 H ATOM 1645 HH21 ARG B 20 -1.417 -20.731 -17.536 1.00139.98 H ATOM 1646 HH12 ARG B 20 0.819 -20.541 -20.301 1.00143.64 H ATOM 1647 HH11 ARG B 20 1.877 -19.402 -19.559 1.00143.64 H ATOM 1648 HE ARG B 20 0.036 -19.260 -16.473 1.00151.27 H ATOM 1649 N THR B 21 2.574 -14.400 -21.219 1.00109.31 N ANISOU 1649 N THR B 21 14605 13950 12976 -93 1222 -230 ATOM 1650 CA THR B 21 1.765 -14.084 -22.383 1.00 98.10 C ANISOU 1650 CA THR B 21 13412 12292 11568 -154 1274 -187 ATOM 1651 C THR B 21 1.105 -15.331 -23.013 1.00 87.84 C ANISOU 1651 C THR B 21 12302 10863 10211 -79 1226 -45 ATOM 1652 O THR B 21 1.744 -16.381 -23.100 1.00107.97 O ANISOU 1652 O THR B 21 14850 13428 12747 -6 1243 -3 ATOM 1653 CB THR B 21 2.672 -13.406 -23.441 1.00 97.97 C ANISOU 1653 CB THR B 21 13420 12181 11623 -237 1445 -287 ATOM 1654 OG1 THR B 21 3.326 -12.301 -22.835 1.00 98.67 O ANISOU 1654 OG1 THR B 21 13339 12386 11767 -330 1489 -434 ATOM 1655 CG2 THR B 21 1.929 -12.897 -24.679 1.00 98.67 C ANISOU 1655 CG2 THR B 21 13752 12035 11702 -264 1507 -223 ATOM 1656 H THR B 21 3.569 -14.353 -21.382 1.00109.31 H ATOM 1657 HA THR B 21 0.986 -13.392 -22.075 1.00 98.10 H ATOM 1658 HB THR B 21 3.446 -14.103 -23.773 1.00 97.97 H ATOM 1659 HG1 THR B 21 2.743 -11.537 -22.850 1.00 98.67 H ATOM 1660 HG21 THR B 21 2.561 -12.242 -25.283 1.00 98.67 H ATOM 1661 HG22 THR B 21 1.622 -13.714 -25.335 1.00 98.67 H ATOM 1662 HG23 THR B 21 1.033 -12.346 -24.392 1.00 98.67 H ATOM 1663 N VAL B 22 -0.152 -15.195 -23.448 1.00 89.52 N ANISOU 1663 N VAL B 22 12661 10965 10387 -97 1169 20 ATOM 1664 CA VAL B 22 -0.891 -16.172 -24.242 1.00 92.96 C ANISOU 1664 CA VAL B 22 13268 11293 10759 -50 1114 131 ATOM 1665 C VAL B 22 -1.660 -15.436 -25.352 1.00 90.21 C ANISOU 1665 C VAL B 22 13089 10799 10387 -96 1138 147 ATOM 1666 O VAL B 22 -1.782 -14.209 -25.311 1.00 90.86 O ANISOU 1666 O VAL B 22 13152 10869 10501 -145 1180 96 ATOM 1667 CB VAL B 22 -1.894 -16.995 -23.380 1.00 97.79 C ANISOU 1667 CB VAL B 22 13845 11982 11330 -5 985 195 ATOM 1668 CG1 VAL B 22 -1.151 -17.802 -22.298 1.00105.65 C ANISOU 1668 CG1 VAL B 22 14656 13152 12335 61 964 183 ATOM 1669 CG2 VAL B 22 -3.077 -16.190 -22.792 1.00 95.14 C ANISOU 1669 CG2 VAL B 22 13506 11656 10985 -52 907 189 ATOM 1670 H VAL B 22 -0.653 -14.318 -23.283 1.00 89.52 H ATOM 1671 HA VAL B 22 -0.186 -16.845 -24.735 1.00 92.96 H ATOM 1672 HB VAL B 22 -2.348 -17.732 -24.044 1.00 97.79 H ATOM 1673 HG11 VAL B 22 -1.818 -18.471 -21.760 1.00105.65 H ATOM 1674 HG12 VAL B 22 -0.359 -18.407 -22.741 1.00105.65 H ATOM 1675 HG13 VAL B 22 -0.679 -17.143 -21.566 1.00105.65 H ATOM 1676 HG21 VAL B 22 -3.729 -16.824 -22.192 1.00 95.14 H ATOM 1677 HG22 VAL B 22 -2.735 -15.366 -22.166 1.00 95.14 H ATOM 1678 HG23 VAL B 22 -3.710 -15.762 -23.570 1.00 95.14 H ATOM 1679 N MET B 23 -2.155 -16.209 -26.319 1.00 91.22 N ANISOU 1679 N MET B 23 13377 10830 10453 -72 1116 214 ATOM 1680 CA MET B 23 -2.918 -15.734 -27.463 1.00 95.74 C ANISOU 1680 CA MET B 23 14123 11283 10969 -85 1135 242 ATOM 1681 C MET B 23 -4.368 -16.203 -27.298 1.00 96.46 C ANISOU 1681 C MET B 23 14259 11400 10992 -75 998 294 ATOM 1682 O MET B 23 -4.571 -17.361 -26.932 1.00 91.87 O ANISOU 1682 O MET B 23 13666 10848 10394 -59 942 319 ATOM 1683 CB MET B 23 -2.241 -16.319 -28.716 1.00105.86 C ANISOU 1683 CB MET B 23 15541 12460 12220 -68 1219 259 ATOM 1684 CG MET B 23 -2.780 -15.762 -30.034 1.00112.77 C ANISOU 1684 CG MET B 23 16578 13226 13045 -69 1286 272 ATOM 1685 SD MET B 23 -1.619 -15.916 -31.419 1.00120.41 S ANISOU 1685 SD MET B 23 17647 14080 14025 -63 1448 256 ATOM 1686 CE MET B 23 -1.466 -17.722 -31.530 1.00102.95 C ANISOU 1686 CE MET B 23 15452 11883 11782 -39 1394 287 ATOM 1687 H MET B 23 -2.045 -17.222 -26.265 1.00 91.22 H ATOM 1688 HA MET B 23 -2.888 -14.643 -27.518 1.00 95.74 H ATOM 1689 HB3 MET B 23 -2.362 -17.406 -28.723 1.00105.86 H ATOM 1690 HB2 MET B 23 -1.165 -16.136 -28.674 1.00105.86 H ATOM 1691 HG3 MET B 23 -3.005 -14.702 -29.919 1.00112.77 H ATOM 1692 HG2 MET B 23 -3.716 -16.258 -30.296 1.00112.77 H ATOM 1693 HE1 MET B 23 -0.842 -17.986 -32.385 1.00102.95 H ATOM 1694 HE2 MET B 23 -1.008 -18.140 -30.633 1.00102.95 H ATOM 1695 HE3 MET B 23 -2.445 -18.185 -31.661 1.00102.95 H ATOM 1696 N VAL B 24 -5.340 -15.313 -27.529 1.00 95.67 N ANISOU 1696 N VAL B 24 14206 11287 10857 -81 962 307 ATOM 1697 CA VAL B 24 -6.764 -15.600 -27.376 1.00 98.62 C ANISOU 1697 CA VAL B 24 14600 11704 11166 -75 830 344 ATOM 1698 C VAL B 24 -7.512 -15.111 -28.622 1.00 98.66 C ANISOU 1698 C VAL B 24 14754 11655 11075 -47 828 376 ATOM 1699 O VAL B 24 -7.404 -13.935 -28.977 1.00104.83 O ANISOU 1699 O VAL B 24 15579 12391 11861 -26 906 384 ATOM 1700 CB VAL B 24 -7.383 -14.885 -26.135 1.00 99.40 C ANISOU 1700 CB VAL B 24 14570 11888 11311 -88 766 334 ATOM 1701 CG1 VAL B 24 -8.902 -15.146 -25.967 1.00102.97 C ANISOU 1701 CG1 VAL B 24 15035 12385 11703 -83 639 367 ATOM 1702 CG2 VAL B 24 -6.653 -15.274 -24.834 1.00104.17 C ANISOU 1702 CG2 VAL B 24 15024 12573 11983 -97 761 305 ATOM 1703 H VAL B 24 -5.108 -14.369 -27.846 1.00 95.67 H ATOM 1704 HA VAL B 24 -6.920 -16.670 -27.259 1.00 98.62 H ATOM 1705 HB VAL B 24 -7.258 -13.809 -26.265 1.00 99.40 H ATOM 1706 HG11 VAL B 24 -9.295 -14.692 -25.054 1.00102.97 H ATOM 1707 HG12 VAL B 24 -9.491 -14.735 -26.787 1.00102.97 H ATOM 1708 HG13 VAL B 24 -9.120 -16.215 -25.927 1.00102.97 H ATOM 1709 HG21 VAL B 24 -7.110 -14.816 -23.955 1.00104.17 H ATOM 1710 HG22 VAL B 24 -6.664 -16.353 -24.685 1.00104.17 H ATOM 1711 HG23 VAL B 24 -5.609 -14.960 -24.851 1.00104.17 H ATOM 1712 N ASN B 25 -8.306 -15.996 -29.233 1.00 96.85 N ANISOU 1712 N ASN B 25 14596 11441 10761 -45 751 389 ATOM 1713 CA ASN B 25 -9.313 -15.635 -30.228 1.00104.86 C ANISOU 1713 CA ASN B 25 15721 12469 11653 -9 701 414 ATOM 1714 C ASN B 25 -10.558 -15.077 -29.515 1.00 98.60 C ANISOU 1714 C ASN B 25 14853 11766 10845 4 593 431 ATOM 1715 O ASN B 25 -11.207 -15.825 -28.781 1.00 99.21 O ANISOU 1715 O ASN B 25 14861 11911 10922 -34 494 410 ATOM 1716 CB ASN B 25 -9.659 -16.849 -31.128 1.00103.18 C ANISOU 1716 CB ASN B 25 15582 12265 11357 -36 657 389 ATOM 1717 CG ASN B 25 -10.658 -16.513 -32.237 1.00107.48 C ANISOU 1717 CG ASN B 25 16230 12856 11752 6 604 398 ATOM 1718 OD1 ASN B 25 -11.631 -17.224 -32.461 1.00113.24 O ANISOU 1718 OD1 ASN B 25 16986 13606 12434 77 603 443 ATOM 1719 ND2 ASN B 25 -10.470 -15.394 -32.917 1.00113.51 N ANISOU 1719 ND2 ASN B 25 17055 13637 12435 -31 575 354 ATOM 1720 H ASN B 25 -8.290 -16.963 -28.911 1.00 96.85 H ATOM 1721 HA ASN B 25 -8.889 -14.862 -30.863 1.00104.86 H ATOM 1722 HB3 ASN B 25 -10.079 -17.668 -30.549 1.00103.18 H ATOM 1723 HB2 ASN B 25 -8.756 -17.247 -31.594 1.00103.18 H ATOM 1724 HD22 ASN B 25 -11.070 -15.170 -33.694 1.00113.51 H ATOM 1725 HD21 ASN B 25 -9.639 -14.831 -32.795 1.00113.51 H ATOM 1726 N LEU B 26 -10.901 -13.801 -29.756 1.00 97.32 N ANISOU 1726 N LEU B 26 14716 11596 10665 61 624 468 ATOM 1727 CA LEU B 26 -12.090 -13.152 -29.174 1.00101.66 C ANISOU 1727 CA LEU B 26 15196 12226 11202 87 535 492 ATOM 1728 C LEU B 26 -13.370 -13.435 -29.991 1.00106.26 C ANISOU 1728 C LEU B 26 15811 12912 11650 123 409 503 ATOM 1729 O LEU B 26 -14.282 -12.602 -29.993 1.00118.50 O ANISOU 1729 O LEU B 26 17294 14545 13185 149 327 520 ATOM 1730 CB LEU B 26 -11.868 -11.620 -29.016 1.00 93.12 C ANISOU 1730 CB LEU B 26 14144 11084 10154 142 645 531 ATOM 1731 CG LEU B 26 -10.737 -11.184 -28.066 1.00 99.84 C ANISOU 1731 CG LEU B 26 14910 11877 11148 78 750 485 ATOM 1732 CD1 LEU B 26 -10.645 -9.648 -28.010 1.00106.14 C ANISOU 1732 CD1 LEU B 26 15736 12605 11987 111 880 504 ATOM 1733 CD2 LEU B 26 -10.912 -11.747 -26.645 1.00106.14 C ANISOU 1733 CD2 LEU B 26 15549 12760 12019 12 653 446 ATOM 1734 H LEU B 26 -10.365 -13.257 -30.427 1.00 97.32 H ATOM 1735 HA LEU B 26 -12.282 -13.580 -28.187 1.00101.66 H ATOM 1736 HB3 LEU B 26 -12.787 -11.168 -28.639 1.00 93.12 H ATOM 1737 HB2 LEU B 26 -11.708 -11.185 -30.002 1.00 93.12 H ATOM 1738 HG LEU B 26 -9.797 -11.559 -28.472 1.00 99.84 H ATOM 1739 HD11 LEU B 26 -9.856 -9.323 -27.333 1.00106.14 H ATOM 1740 HD12 LEU B 26 -10.427 -9.221 -28.989 1.00106.14 H ATOM 1741 HD13 LEU B 26 -11.569 -9.198 -27.646 1.00106.14 H ATOM 1742 HD21 LEU B 26 -10.202 -11.300 -25.946 1.00106.14 H ATOM 1743 HD22 LEU B 26 -11.917 -11.560 -26.263 1.00106.14 H ATOM 1744 HD23 LEU B 26 -10.746 -12.823 -26.620 1.00106.14 H ATOM 1745 N ASN B 27 -13.442 -14.569 -30.697 1.00114.89 N ANISOU 1745 N ASN B 27 16985 14017 12652 114 390 477 ATOM 1746 CA ASN B 27 -14.645 -14.964 -31.415 1.00117.41 C ANISOU 1746 CA ASN B 27 17304 14466 12841 119 261 448 ATOM 1747 C ASN B 27 -15.301 -16.060 -30.583 1.00125.58 C ANISOU 1747 C ASN B 27 18224 15554 13936 16 176 382 ATOM 1748 O ASN B 27 -14.750 -17.153 -30.490 1.00138.16 O ANISOU 1748 O ASN B 27 19827 17085 15581 -62 217 337 ATOM 1749 CB ASN B 27 -14.329 -15.456 -32.840 1.00125.22 C ANISOU 1749 CB ASN B 27 18413 15460 13703 127 276 420 ATOM 1750 CG ASN B 27 -15.478 -15.112 -33.772 1.00131.02 C ANISOU 1750 CG ASN B 27 19166 16354 14260 202 170 419 ATOM 1751 OD1 ASN B 27 -15.653 -13.944 -34.115 1.00130.16 O ANISOU 1751 OD1 ASN B 27 19075 16289 14092 323 166 496 ATOM 1752 ND2 ASN B 27 -16.299 -16.093 -34.124 1.00147.78 N ANISOU 1752 ND2 ASN B 27 21281 18574 16295 134 91 328 ATOM 1753 H ASN B 27 -12.755 -15.302 -30.537 1.00114.89 H ATOM 1754 HA ASN B 27 -15.382 -14.159 -31.470 1.00117.41 H ATOM 1755 HB3 ASN B 27 -14.065 -16.515 -32.880 1.00125.22 H ATOM 1756 HB2 ASN B 27 -13.465 -14.914 -33.223 1.00125.22 H ATOM 1757 HD22 ASN B 27 -17.106 -15.894 -34.698 1.00147.78 H ATOM 1758 HD21 ASN B 27 -16.160 -17.029 -33.775 1.00147.78 H ATOM 1759 N ILE B 28 -16.419 -15.714 -29.944 1.00120.65 N ANISOU 1759 N ILE B 28 17505 15038 13299 24 74 379 ATOM 1760 CA ILE B 28 -17.069 -16.557 -28.950 1.00131.08 C ANISOU 1760 CA ILE B 28 18710 16398 14698 -68 11 327 ATOM 1761 C ILE B 28 -17.673 -17.832 -29.564 1.00138.00 C ANISOU 1761 C ILE B 28 19595 17330 15509 -154 -35 230 ATOM 1762 O ILE B 28 -18.054 -17.827 -30.737 1.00125.57 O ANISOU 1762 O ILE B 28 18075 15839 13798 -128 -76 199 ATOM 1763 CB ILE B 28 -18.107 -15.728 -28.132 1.00134.35 C ANISOU 1763 CB ILE B 28 19023 16896 15129 -26 -62 359 ATOM 1764 CG1 ILE B 28 -17.358 -14.700 -27.247 1.00119.31 C ANISOU 1764 CG1 ILE B 28 17092 14902 13337 4 15 421 ATOM 1765 CG2 ILE B 28 -19.091 -16.548 -27.261 1.00137.83 C ANISOU 1765 CG2 ILE B 28 19354 17416 15600 -109 -147 294 ATOM 1766 CD1 ILE B 28 -18.114 -13.380 -27.059 1.00132.96 C ANISOU 1766 CD1 ILE B 28 18822 16656 15041 105 22 489 ATOM 1767 H ILE B 28 -16.835 -14.814 -30.097 1.00120.65 H ATOM 1768 HA ILE B 28 -16.283 -16.858 -28.266 1.00131.08 H ATOM 1769 HB ILE B 28 -18.721 -15.182 -28.853 1.00134.35 H ATOM 1770 HG13 ILE B 28 -16.386 -14.453 -27.682 1.00119.31 H ATOM 1771 HG12 ILE B 28 -17.118 -15.153 -26.282 1.00119.31 H ATOM 1772 HG21 ILE B 28 -19.742 -15.906 -26.669 1.00137.83 H ATOM 1773 HG22 ILE B 28 -19.747 -17.179 -27.864 1.00137.83 H ATOM 1774 HG23 ILE B 28 -18.557 -17.202 -26.569 1.00137.83 H ATOM 1775 HD11 ILE B 28 -17.734 -12.837 -26.192 1.00132.96 H ATOM 1776 HD12 ILE B 28 -17.987 -12.736 -27.930 1.00132.96 H ATOM 1777 HD13 ILE B 28 -19.184 -13.543 -26.913 1.00132.96 H ATOM 1778 N HIS B 29 -17.715 -18.892 -28.736 1.00149.59 N ANISOU 1778 N HIS B 29 21023 18745 17072 -250 -6 184 ATOM 1779 CA HIS B 29 -18.276 -20.261 -28.869 1.00167.11 C ANISOU 1779 CA HIS B 29 23215 21001 19277 -362 -28 78 ATOM 1780 C HIS B 29 -19.367 -20.368 -29.938 1.00163.11 C ANISOU 1780 C HIS B 29 22687 20660 18627 -370 -133 1 ATOM 1781 O HIS B 29 -19.404 -21.304 -30.733 1.00142.75 O ANISOU 1781 O HIS B 29 20181 18102 15956 -411 -118 -72 ATOM 1782 CB HIS B 29 -18.744 -20.720 -27.449 1.00165.30 C ANISOU 1782 CB HIS B 29 22887 20753 19168 -412 -26 76 ATOM 1783 CG HIS B 29 -20.203 -20.729 -27.078 1.00173.19 C ANISOU 1783 CG HIS B 29 23784 21875 20144 -463 -120 8 ATOM 1784 ND1 HIS B 29 -21.019 -19.594 -27.154 1.00170.23 N ANISOU 1784 ND1 HIS B 29 23340 21629 19712 -392 -226 36 ATOM 1785 CD2 HIS B 29 -20.940 -21.773 -26.560 1.00168.67 C ANISOU 1785 CD2 HIS B 29 23166 21317 19604 -575 -110 -88 ATOM 1786 CE1 HIS B 29 -22.195 -19.986 -26.680 1.00164.81 C ANISOU 1786 CE1 HIS B 29 22555 21046 19018 -458 -292 -44 ATOM 1787 NE2 HIS B 29 -22.204 -21.268 -26.311 1.00174.07 N ANISOU 1787 NE2 HIS B 29 23742 22149 20250 -580 -219 -129 ATOM 1788 H HIS B 29 -17.222 -18.735 -27.865 1.00149.59 H ATOM 1789 HA HIS B 29 -17.454 -20.910 -29.175 1.00167.11 H ATOM 1790 HXT HIS B 29 -20.095 -19.556 -29.945 1.00163.11 H ATOM 1791 HB3 HIS B 29 -18.302 -20.101 -26.675 1.00165.30 H ATOM 1792 HB2 HIS B 29 -18.371 -21.725 -27.254 1.00165.30 H ATOM 1793 HD2 HIS B 29 -20.658 -22.791 -26.329 1.00168.67 H ATOM 1794 HE1 HIS B 29 -23.049 -19.328 -26.583 1.00164.81 H ATOM 1795 HE2 HIS B 29 -22.982 -21.770 -25.906 1.00174.07 H ATOM 1796 N SER B 41 -33.663 -14.475 -16.098 1.00151.59 N ANISOU 1796 N SER B 41 19562 20081 17953 -339 -740 60 ATOM 1797 CA SER B 41 -34.918 -14.571 -15.301 1.00146.56 C ANISOU 1797 CA SER B 41 18787 19519 17378 -387 -754 1 ATOM 1798 C SER B 41 -35.231 -13.229 -14.555 1.00138.24 C ANISOU 1798 C SER B 41 17697 18477 16350 -263 -758 111 ATOM 1799 O SER B 41 -34.439 -12.282 -14.533 1.00124.95 O ANISOU 1799 O SER B 41 16102 16736 14639 -147 -736 225 ATOM 1800 CB SER B 41 -34.889 -15.783 -14.323 1.00142.89 C ANISOU 1800 CB SER B 41 18340 18928 17023 -533 -663 -62 ATOM 1801 OG SER B 41 -36.138 -16.030 -13.692 1.00138.62 O ANISOU 1801 OG SER B 41 17665 18474 16532 -614 -670 -163 ATOM 1802 H1 SER B 41 -33.698 -14.990 -16.965 1.00151.59 H ATOM 1803 H2 SER B 41 -33.500 -13.502 -16.354 1.00151.59 H ATOM 1804 HA SER B 41 -35.747 -14.710 -15.998 1.00146.56 H ATOM 1805 HB3 SER B 41 -34.130 -15.634 -13.552 1.00142.89 H ATOM 1806 HB2 SER B 41 -34.601 -16.687 -14.862 1.00142.89 H ATOM 1807 HG SER B 41 -36.741 -16.448 -14.315 1.00138.62 H ATOM 1808 N ASP B 42 -36.436 -13.174 -13.980 1.00125.44 N ANISOU 1808 N ASP B 42 15951 16925 14787 -289 -769 71 ATOM 1809 CA ASP B 42 -37.030 -12.075 -13.225 1.00122.62 C ANISOU 1809 CA ASP B 42 15553 16563 14473 -189 -751 164 ATOM 1810 C ASP B 42 -36.821 -12.275 -11.706 1.00124.09 C ANISOU 1810 C ASP B 42 15756 16607 14786 -277 -660 167 ATOM 1811 O ASP B 42 -37.462 -11.593 -10.905 1.00133.11 O ANISOU 1811 O ASP B 42 16831 17766 15981 -239 -644 199 ATOM 1812 CB ASP B 42 -38.531 -11.844 -13.550 1.00123.19 C ANISOU 1812 CB ASP B 42 15460 16839 14507 -126 -831 129 ATOM 1813 CG ASP B 42 -39.469 -12.999 -13.182 1.00132.21 C ANISOU 1813 CG ASP B 42 16474 18063 15696 -282 -848 -31 ATOM 1814 OD1 ASP B 42 -39.142 -14.164 -13.510 1.00123.66 O ANISOU 1814 OD1 ASP B 42 15450 16893 14641 -423 -806 -115 ATOM 1815 OD2 ASP B 42 -40.517 -12.738 -12.555 1.00130.23 O1- ANISOU 1815 OD2 ASP B 42 16070 17947 15465 -264 -883 -71 ATOM 1816 H ASP B 42 -37.023 -14.006 -13.990 1.00125.44 H ATOM 1817 HA ASP B 42 -36.512 -11.159 -13.495 1.00122.62 H ATOM 1818 HB3 ASP B 42 -38.649 -11.686 -14.625 1.00123.19 H ATOM 1819 HB2 ASP B 42 -38.873 -10.923 -13.081 1.00123.19 H ATOM 1820 N ATYR B 43 -35.880 -13.144 -11.300 0.50110.50 N ANISOU 1820 N ATYR B 43 14126 14757 13104 -375 -598 143 ATOM 1821 N BTYR B 43 -35.838 -13.110 -11.211 0.50109.59 N ANISOU 1821 N BTYR B 43 14014 14636 12989 -372 -596 147 ATOM 1822 CA ATYR B 43 -35.463 -13.344 -9.903 0.50111.97 C ANISOU 1822 CA ATYR B 43 14363 14803 13377 -424 -505 173 ATOM 1823 CA BTYR B 43 -35.532 -13.240 -9.762 0.50110.52 C ANISOU 1823 CA BTYR B 43 14169 14625 13198 -419 -506 176 ATOM 1824 C ATYR B 43 -35.024 -12.046 -9.197 0.50111.96 C ANISOU 1824 C ATYR B 43 14383 14763 13394 -326 -478 274 ATOM 1825 C BTYR B 43 -35.280 -11.859 -9.176 0.50109.30 C ANISOU 1825 C BTYR B 43 14035 14435 13058 -319 -482 276 ATOM 1826 O ATYR B 43 -35.181 -11.951 -7.984 0.50103.03 O ANISOU 1826 O ATYR B 43 13214 13601 12330 -338 -433 287 ATOM 1827 O BTYR B 43 -35.783 -11.523 -8.048 0.50 92.06 O ANISOU 1827 O BTYR B 43 11812 12224 10943 -327 -437 291 ATOM 1828 CB ATYR B 43 -34.335 -14.396 -9.805 0.50106.46 C ANISOU 1828 CB ATYR B 43 13780 13997 12673 -483 -453 164 ATOM 1829 CB BTYR B 43 -34.275 -14.020 -9.345 0.50105.51 C ANISOU 1829 CB BTYR B 43 13654 13859 12576 -469 -436 188 ATOM 1830 CG ATYR B 43 -34.622 -15.804 -10.306 0.50 94.60 C ANISOU 1830 CG ATYR B 43 12268 12497 11178 -598 -433 56 ATOM 1831 CG BTYR B 43 -33.105 -14.225 -10.275 0.50 93.45 C ANISOU 1831 CG BTYR B 43 12224 12301 10983 -448 -447 206 ATOM 1832 CD1ATYR B 43 -35.935 -16.321 -10.400 0.50 94.56 C ANISOU 1832 CD1ATYR B 43 12147 12578 11205 -674 -448 -46 ATOM 1833 CD1BTYR B 43 -32.601 -15.503 -10.418 0.50 92.42 C ANISOU 1833 CD1BTYR B 43 12153 12110 10854 -526 -403 158 ATOM 1834 CD2ATYR B 43 -33.535 -16.641 -10.635 0.50 86.36 C ANISOU 1834 CD2ATYR B 43 11329 11367 10116 -639 -384 46 ATOM 1835 CD2BTYR B 43 -32.445 -13.198 -10.933 0.50 92.87 C ANISOU 1835 CD2BTYR B 43 12195 12237 10853 -353 -474 272 ATOM 1836 CE1ATYR B 43 -36.148 -17.648 -10.821 0.50 89.50 C ANISOU 1836 CE1ATYR B 43 11496 11930 10579 -802 -404 -169 ATOM 1837 CE1BTYR B 43 -31.521 -15.770 -11.239 0.50 94.13 C ANISOU 1837 CE1BTYR B 43 12458 12291 11015 -510 -404 172 ATOM 1838 CE2ATYR B 43 -33.746 -17.968 -11.053 0.50 87.19 C ANISOU 1838 CE2ATYR B 43 11439 11454 10234 -751 -338 -59 ATOM 1839 CE2BTYR B 43 -31.335 -13.444 -11.729 0.50 82.29 C ANISOU 1839 CE2BTYR B 43 10948 10859 9462 -342 -470 284 ATOM 1840 CZ ATYR B 43 -35.057 -18.472 -11.144 0.50 92.94 C ANISOU 1840 CZ ATYR B 43 12054 12261 10998 -842 -341 -174 ATOM 1841 CZ BTYR B 43 -30.875 -14.735 -11.879 0.50 84.41 C ANISOU 1841 CZ BTYR B 43 11263 11080 9730 -420 -441 234 ATOM 1842 OH ATYR B 43 -35.277 -19.762 -11.529 0.50 89.50 O ANISOU 1842 OH ATYR B 43 11623 11797 10588 -975 -267 -300 ATOM 1843 OH BTYR B 43 -29.810 -15.065 -12.660 0.50 97.81 O ANISOU 1843 OH BTYR B 43 13048 12736 11380 -411 -431 242 ATOM 1844 H ATYR B 43 -35.465 -13.748 -12.000 0.50110.50 H ATOM 1845 H BTYR B 43 -35.337 -13.706 -11.855 0.50109.59 H ATOM 1846 HA ATYR B 43 -36.328 -13.701 -9.344 0.50111.97 H ATOM 1847 HA BTYR B 43 -36.396 -13.678 -9.262 0.50110.52 H ATOM 1848 HB3ATYR B 43 -34.046 -14.509 -8.759 0.50106.46 H ATOM 1849 HB3BTYR B 43 -34.580 -14.989 -8.949 0.50105.51 H ATOM 1850 HB2ATYR B 43 -33.446 -14.030 -10.321 0.50106.46 H ATOM 1851 HB2BTYR B 43 -33.906 -13.611 -8.404 0.50105.51 H ATOM 1852 HD1ATYR B 43 -36.796 -15.721 -10.157 0.50 94.56 H ATOM 1853 HD1BTYR B 43 -33.052 -16.324 -9.881 0.50 92.42 H ATOM 1854 HD2ATYR B 43 -32.521 -16.282 -10.549 0.50 86.36 H ATOM 1855 HD2BTYR B 43 -32.793 -12.181 -10.832 0.50 92.87 H ATOM 1856 HE1ATYR B 43 -37.148 -18.044 -10.907 0.50 89.50 H ATOM 1857 HE1BTYR B 43 -31.186 -16.787 -11.377 0.50 94.13 H ATOM 1858 HE2ATYR B 43 -32.893 -18.592 -11.281 0.50 87.19 H ATOM 1859 HE2BTYR B 43 -30.836 -12.626 -12.227 0.50 82.29 H ATOM 1860 HH ATYR B 43 -34.465 -20.226 -11.746 0.50 89.50 H ATOM 1861 HH BTYR B 43 -29.442 -14.270 -13.052 0.50 97.81 H ATOM 1862 N TYR B 44 -34.545 -11.050 -9.956 1.00109.36 N ANISOU 1862 N TYR B 44 14111 14434 13005 -231 -493 339 ATOM 1863 CA TYR B 44 -34.215 -9.719 -9.443 1.00113.96 C ANISOU 1863 CA TYR B 44 14731 14963 13606 -147 -438 423 ATOM 1864 C TYR B 44 -35.461 -8.963 -8.928 1.00117.87 C ANISOU 1864 C TYR B 44 15127 15515 14144 -104 -437 438 ATOM 1865 O TYR B 44 -35.312 -8.091 -8.075 1.00 88.56 O ANISOU 1865 O TYR B 44 11442 11735 10470 -62 -363 494 ATOM 1866 CB TYR B 44 -33.446 -8.918 -10.524 1.00117.62 C ANISOU 1866 CB TYR B 44 15272 15421 13997 -51 -437 480 ATOM 1867 CG TYR B 44 -34.272 -8.432 -11.701 1.00101.75 C ANISOU 1867 CG TYR B 44 13211 13534 11914 57 -501 506 ATOM 1868 CD1 TYR B 44 -34.426 -9.235 -12.846 1.00125.39 C ANISOU 1868 CD1 TYR B 44 16164 16644 14835 41 -594 447 ATOM 1869 CD2 TYR B 44 -34.908 -7.176 -11.637 1.00117.89 C ANISOU 1869 CD2 TYR B 44 15239 15595 13960 178 -464 583 ATOM 1870 CE1 TYR B 44 -35.245 -8.800 -13.905 1.00119.28 C ANISOU 1870 CE1 TYR B 44 15326 16024 13972 156 -665 465 ATOM 1871 CE2 TYR B 44 -35.737 -6.747 -12.687 1.00139.03 C ANISOU 1871 CE2 TYR B 44 17865 18407 16553 311 -522 622 ATOM 1872 CZ TYR B 44 -35.916 -7.565 -13.816 1.00127.42 C ANISOU 1872 CZ TYR B 44 16343 17077 14993 304 -632 563 ATOM 1873 OH TYR B 44 -36.762 -7.158 -14.805 1.00127.02 O ANISOU 1873 OH TYR B 44 16230 17188 14842 456 -692 605 ATOM 1874 H TYR B 44 -34.509 -11.170 -10.958 1.00109.36 H ATOM 1875 HA TYR B 44 -33.549 -9.848 -8.588 1.00113.96 H ATOM 1876 HB3 TYR B 44 -32.608 -9.502 -10.902 1.00117.62 H ATOM 1877 HB2 TYR B 44 -32.988 -8.047 -10.054 1.00117.62 H ATOM 1878 HD1 TYR B 44 -33.921 -10.186 -12.925 1.00125.39 H ATOM 1879 HD2 TYR B 44 -34.780 -6.560 -10.762 1.00117.89 H ATOM 1880 HE1 TYR B 44 -35.348 -9.430 -14.776 1.00119.28 H ATOM 1881 HE2 TYR B 44 -36.246 -5.797 -12.620 1.00139.03 H ATOM 1882 HH TYR B 44 -36.744 -7.706 -15.593 1.00127.02 H ATOM 1883 N ASN B 45 -36.652 -9.313 -9.446 1.00105.63 N ANISOU 1883 N ASN B 45 13464 14084 12587 -122 -505 381 ATOM 1884 CA ASN B 45 -37.946 -8.754 -9.059 1.00103.30 C ANISOU 1884 CA ASN B 45 13049 13886 12313 -58 -524 392 ATOM 1885 C ASN B 45 -38.550 -9.546 -7.908 1.00 94.76 C ANISOU 1885 C ASN B 45 11884 12799 11320 -171 -501 319 ATOM 1886 O ASN B 45 -38.826 -8.929 -6.888 1.00 90.35 O ANISOU 1886 O ASN B 45 11284 12225 10821 -141 -457 351 ATOM 1887 CB ASN B 45 -38.928 -8.702 -10.262 1.00112.10 C ANISOU 1887 CB ASN B 45 14067 15186 13339 20 -625 370 ATOM 1888 CG ASN B 45 -38.976 -7.333 -10.934 1.00115.70 C ANISOU 1888 CG ASN B 45 14532 15692 13737 209 -620 484 ATOM 1889 OD1 ASN B 45 -39.023 -6.309 -10.254 1.00105.18 O ANISOU 1889 OD1 ASN B 45 13201 14305 12460 273 -547 553 ATOM 1890 ND2 ASN B 45 -38.985 -7.277 -12.260 1.00129.92 N ANISOU 1890 ND2 ASN B 45 16347 17596 15421 303 -684 504 ATOM 1891 H ASN B 45 -36.687 -10.095 -10.092 1.00105.63 H ATOM 1892 HA ASN B 45 -37.728 -7.742 -8.713 1.00103.30 H ATOM 1893 HB3 ASN B 45 -39.952 -8.877 -9.929 1.00112.10 H ATOM 1894 HB2 ASN B 45 -38.740 -9.485 -10.991 1.00112.10 H ATOM 1895 HD22 ASN B 45 -39.019 -6.377 -12.721 1.00129.92 H ATOM 1896 HD21 ASN B 45 -38.931 -8.103 -12.842 1.00129.92 H ATOM 1897 N ARG B 46 -38.769 -10.860 -8.076 1.00 90.41 N ANISOU 1897 N ARG B 46 11322 12246 10784 -296 -511 223 ATOM 1898 CA ARG B 46 -39.517 -11.656 -7.090 1.00 96.60 C ANISOU 1898 CA ARG B 46 12039 13006 11657 -408 -461 149 ATOM 1899 C ARG B 46 -38.732 -12.039 -5.821 1.00 87.10 C ANISOU 1899 C ARG B 46 10944 11639 10511 -461 -359 183 ATOM 1900 O ARG B 46 -39.319 -12.642 -4.924 1.00 84.04 O ANISOU 1900 O ARG B 46 10522 11212 10195 -528 -297 149 ATOM 1901 CB ARG B 46 -40.123 -12.931 -7.707 1.00110.91 C ANISOU 1901 CB ARG B 46 13784 14900 13457 -515 -497 18 ATOM 1902 CG ARG B 46 -40.933 -12.762 -9.006 1.00116.28 C ANISOU 1902 CG ARG B 46 14309 15792 14079 -467 -601 -40 ATOM 1903 CD ARG B 46 -41.953 -13.900 -9.259 1.00128.72 C ANISOU 1903 CD ARG B 46 15767 17468 15674 -610 -613 -212 ATOM 1904 NE ARG B 46 -41.385 -15.255 -9.066 1.00133.89 N ANISOU 1904 NE ARG B 46 16517 17994 16363 -760 -531 -292 ATOM 1905 CZ ARG B 46 -40.553 -15.948 -9.853 1.00125.33 C ANISOU 1905 CZ ARG B 46 15548 16854 15217 -774 -536 -287 ATOM 1906 NH1 ARG B 46 -40.172 -15.477 -11.037 1.00131.22 N ANISOU 1906 NH1 ARG B 46 16341 17656 15862 -655 -620 -209 ATOM 1907 NH2 ARG B 46 -40.101 -17.131 -9.426 1.00114.36 N1+ ANISOU 1907 NH2 ARG B 46 14239 15343 13871 -903 -438 -357 ATOM 1908 H ARG B 46 -38.512 -11.298 -8.954 1.00 90.41 H ATOM 1909 HA ARG B 46 -40.350 -11.041 -6.739 1.00 96.60 H ATOM 1910 HB3 ARG B 46 -40.780 -13.374 -6.957 1.00110.91 H ATOM 1911 HB2 ARG B 46 -39.329 -13.659 -7.877 1.00110.91 H ATOM 1912 HG3 ARG B 46 -40.306 -12.561 -9.876 1.00116.28 H ATOM 1913 HG2 ARG B 46 -41.522 -11.854 -8.866 1.00116.28 H ATOM 1914 HD3 ARG B 46 -42.261 -13.867 -10.307 1.00128.72 H ATOM 1915 HD2 ARG B 46 -42.863 -13.753 -8.675 1.00128.72 H ATOM 1916 HH22 ARG B 46 -39.472 -17.703 -9.974 1.00114.36 H ATOM 1917 HH21 ARG B 46 -40.362 -17.484 -8.515 1.00114.36 H ATOM 1918 HH12 ARG B 46 -39.560 -15.912 -11.716 1.00131.22 H ATOM 1919 HH11 ARG B 46 -40.486 -14.567 -11.408 1.00131.22 H ATOM 1920 HE ARG B 46 -41.619 -15.638 -8.139 1.00133.89 H ATOM 1921 N SER B 47 -37.428 -11.738 -5.766 1.00 84.21 N ANISOU 1921 N SER B 47 10698 11193 10106 -427 -341 245 ATOM 1922 CA SER B 47 -36.601 -11.993 -4.596 1.00 80.37 C ANISOU 1922 CA SER B 47 10305 10591 9642 -451 -260 280 ATOM 1923 C SER B 47 -37.097 -11.211 -3.369 1.00 79.09 C ANISOU 1923 C SER B 47 10113 10407 9532 -428 -208 314 ATOM 1924 O SER B 47 -37.537 -10.072 -3.506 1.00 76.72 O ANISOU 1924 O SER B 47 9767 10146 9236 -359 -225 348 ATOM 1925 CB SER B 47 -35.117 -11.721 -4.930 1.00 82.18 C ANISOU 1925 CB SER B 47 10634 10779 9814 -404 -261 330 ATOM 1926 OG SER B 47 -34.277 -11.777 -3.795 1.00 79.95 O ANISOU 1926 OG SER B 47 10414 10427 9538 -421 -193 351 ATOM 1927 H SER B 47 -36.988 -11.238 -6.527 1.00 84.21 H ATOM 1928 HA SER B 47 -36.686 -13.048 -4.368 1.00 80.37 H ATOM 1929 HB3 SER B 47 -35.001 -10.752 -5.418 1.00 82.18 H ATOM 1930 HB2 SER B 47 -34.754 -12.484 -5.622 1.00 82.18 H ATOM 1931 HG SER B 47 -33.677 -12.546 -3.907 1.00 79.95 H ATOM 1932 N THR B 48 -36.961 -11.813 -2.185 1.00 74.56 N ANISOU 1932 N THR B 48 9575 9767 8989 -475 -135 310 ATOM 1933 CA THR B 48 -37.079 -11.112 -0.909 1.00 76.79 C ANISOU 1933 CA THR B 48 9847 10021 9309 -458 -75 340 ATOM 1934 C THR B 48 -35.970 -10.052 -0.731 1.00 78.03 C ANISOU 1934 C THR B 48 10066 10160 9420 -405 -66 384 ATOM 1935 O THR B 48 -36.163 -9.094 0.012 1.00 75.06 O ANISOU 1935 O THR B 48 9684 9769 9066 -387 -16 401 ATOM 1936 CB THR B 48 -37.023 -12.099 0.281 1.00 78.96 C ANISOU 1936 CB THR B 48 10154 10238 9610 -511 6 326 ATOM 1937 OG1 THR B 48 -35.769 -12.762 0.407 1.00 72.04 O ANISOU 1937 OG1 THR B 48 9373 9326 8672 -502 28 349 ATOM 1938 CG2 THR B 48 -38.125 -13.163 0.242 1.00 73.24 C ANISOU 1938 CG2 THR B 48 9382 9510 8938 -585 27 264 ATOM 1939 H THR B 48 -36.670 -12.791 -2.169 1.00 74.56 H ATOM 1940 HA THR B 48 -38.039 -10.593 -0.881 1.00 76.79 H ATOM 1941 HB THR B 48 -37.169 -11.516 1.195 1.00 78.96 H ATOM 1942 HG1 THR B 48 -35.415 -13.013 -0.464 1.00 72.04 H ATOM 1943 HG21 THR B 48 -38.135 -13.751 1.163 1.00 73.24 H ATOM 1944 HG22 THR B 48 -39.107 -12.692 0.153 1.00 73.24 H ATOM 1945 HG23 THR B 48 -38.013 -13.850 -0.599 1.00 73.24 H ATOM 1946 N SER B 49 -34.863 -10.171 -1.469 1.00 72.41 N ANISOU 1946 N SER B 49 9415 9448 8651 -391 -98 391 ATOM 1947 CA SER B 49 -33.783 -9.202 -1.512 1.00 72.78 C ANISOU 1947 CA SER B 49 9510 9483 8661 -351 -81 414 ATOM 1948 C SER B 49 -33.570 -8.731 -2.966 1.00 70.57 C ANISOU 1948 C SER B 49 9240 9220 8352 -306 -131 431 ATOM 1949 O SER B 49 -32.561 -9.124 -3.556 1.00 74.26 O ANISOU 1949 O SER B 49 9760 9682 8773 -307 -153 428 ATOM 1950 CB SER B 49 -32.540 -9.870 -0.882 1.00 73.99 C ANISOU 1950 CB SER B 49 9721 9627 8765 -367 -59 407 ATOM 1951 OG SER B 49 -32.212 -11.087 -1.547 1.00 68.62 O ANISOU 1951 OG SER B 49 9074 8943 8057 -381 -89 403 ATOM 1952 H SER B 49 -34.784 -10.926 -2.152 1.00 72.41 H ATOM 1953 HA SER B 49 -34.021 -8.319 -0.922 1.00 72.78 H ATOM 1954 HB3 SER B 49 -32.719 -10.057 0.175 1.00 73.99 H ATOM 1955 HB2 SER B 49 -31.688 -9.190 -0.927 1.00 73.99 H ATOM 1956 HG SER B 49 -32.141 -10.878 -2.491 1.00 68.62 H ATOM 1957 N PRO B 50 -34.521 -7.966 -3.552 1.00 70.76 N ANISOU 1957 N PRO B 50 9217 9274 8396 -253 -147 453 ATOM 1958 CA PRO B 50 -34.469 -7.640 -4.989 1.00 71.37 C ANISOU 1958 CA PRO B 50 9305 9386 8427 -187 -196 478 ATOM 1959 C PRO B 50 -33.328 -6.670 -5.348 1.00 71.35 C ANISOU 1959 C PRO B 50 9382 9327 8399 -138 -136 513 ATOM 1960 O PRO B 50 -32.796 -5.992 -4.461 1.00 79.26 O ANISOU 1960 O PRO B 50 10408 10277 9429 -157 -57 509 ATOM 1961 CB PRO B 50 -35.854 -7.042 -5.259 1.00 77.06 C ANISOU 1961 CB PRO B 50 9935 10173 9173 -127 -218 498 ATOM 1962 CG PRO B 50 -36.250 -6.381 -3.955 1.00 74.16 C ANISOU 1962 CG PRO B 50 9555 9753 8870 -137 -132 510 ATOM 1963 CD PRO B 50 -35.669 -7.321 -2.902 1.00 74.88 C ANISOU 1963 CD PRO B 50 9671 9806 8975 -237 -115 463 ATOM 1964 HA PRO B 50 -34.340 -8.553 -5.571 1.00 71.37 H ATOM 1965 HB3 PRO B 50 -36.552 -7.848 -5.493 1.00 77.06 H ATOM 1966 HB2 PRO B 50 -35.862 -6.357 -6.106 1.00 77.06 H ATOM 1967 HG3 PRO B 50 -37.326 -6.243 -3.873 1.00 74.16 H ATOM 1968 HG2 PRO B 50 -35.776 -5.404 -3.881 1.00 74.16 H ATOM 1969 HD2 PRO B 50 -35.400 -6.792 -1.988 1.00 74.88 H ATOM 1970 HD3 PRO B 50 -36.410 -8.073 -2.640 1.00 74.88 H ATOM 1971 N TRP B 51 -32.974 -6.599 -6.635 1.00 80.51 N ANISOU 1971 N TRP B 51 10583 10500 9505 -83 -166 538 ATOM 1972 CA TRP B 51 -31.894 -5.736 -7.101 1.00 81.02 C ANISOU 1972 CA TRP B 51 10738 10498 9549 -47 -92 563 ATOM 1973 C TRP B 51 -32.260 -5.055 -8.415 1.00 82.46 C ANISOU 1973 C TRP B 51 10952 10703 9678 67 -104 623 ATOM 1974 O TRP B 51 -33.163 -5.493 -9.130 1.00 84.99 O ANISOU 1974 O TRP B 51 11215 11118 9958 112 -196 634 ATOM 1975 CB TRP B 51 -30.553 -6.496 -7.176 1.00 81.50 C ANISOU 1975 CB TRP B 51 10847 10533 9585 -117 -97 519 ATOM 1976 CG TRP B 51 -30.433 -7.656 -8.111 1.00 80.62 C ANISOU 1976 CG TRP B 51 10746 10462 9422 -127 -186 508 ATOM 1977 CD1 TRP B 51 -29.973 -7.604 -9.386 1.00 82.86 C ANISOU 1977 CD1 TRP B 51 11089 10743 9650 -83 -201 527 ATOM 1978 CD2 TRP B 51 -30.784 -9.052 -7.864 1.00 82.36 C ANISOU 1978 CD2 TRP B 51 10930 10719 9643 -191 -248 469 ATOM 1979 NE1 TRP B 51 -29.972 -8.876 -9.925 1.00 75.39 N ANISOU 1979 NE1 TRP B 51 10142 9834 8668 -121 -276 497 ATOM 1980 CE2 TRP B 51 -30.449 -9.809 -9.030 1.00 79.08 C ANISOU 1980 CE2 TRP B 51 10552 10322 9172 -188 -300 459 ATOM 1981 CE3 TRP B 51 -31.328 -9.763 -6.768 1.00 73.29 C ANISOU 1981 CE3 TRP B 51 9731 9579 8538 -249 -249 441 ATOM 1982 CZ2 TRP B 51 -30.628 -11.197 -9.093 1.00 75.92 C ANISOU 1982 CZ2 TRP B 51 10138 9942 8765 -251 -342 414 ATOM 1983 CZ3 TRP B 51 -31.530 -11.159 -6.829 1.00 80.86 C ANISOU 1983 CZ3 TRP B 51 10683 10550 9491 -304 -282 404 ATOM 1984 CH2 TRP B 51 -31.176 -11.874 -7.987 1.00 90.65 C ANISOU 1984 CH2 TRP B 51 11960 11801 10681 -310 -324 387 ATOM 1985 H TRP B 51 -33.521 -7.069 -7.354 1.00 80.51 H ATOM 1986 HA TRP B 51 -31.765 -4.926 -6.386 1.00 81.02 H ATOM 1987 HB3 TRP B 51 -30.290 -6.853 -6.183 1.00 81.50 H ATOM 1988 HB2 TRP B 51 -29.758 -5.803 -7.445 1.00 81.50 H ATOM 1989 HD1 TRP B 51 -29.631 -6.705 -9.887 1.00 82.86 H ATOM 1990 HE1 TRP B 51 -29.619 -9.091 -10.879 1.00 75.39 H ATOM 1991 HE3 TRP B 51 -31.597 -9.239 -5.867 1.00 73.29 H ATOM 1992 HZ2 TRP B 51 -30.335 -11.738 -9.980 1.00 75.92 H ATOM 1993 HZ3 TRP B 51 -31.949 -11.678 -5.979 1.00 80.86 H ATOM 1994 HH2 TRP B 51 -31.321 -12.941 -8.031 1.00 90.65 H ATOM 1995 N ASN B 52 -31.539 -3.965 -8.680 1.00 82.33 N ANISOU 1995 N ASN B 52 11019 10602 9659 113 4 656 ATOM 1996 CA ASN B 52 -31.512 -3.237 -9.945 1.00 76.36 C ANISOU 1996 CA ASN B 52 10335 9830 8847 239 45 729 ATOM 1997 C ASN B 52 -30.086 -3.352 -10.497 1.00 79.29 C ANISOU 1997 C ASN B 52 10793 10141 9192 195 76 700 ATOM 1998 O ASN B 52 -29.164 -3.636 -9.728 1.00 81.99 O ANISOU 1998 O ASN B 52 11129 10453 9570 80 89 629 ATOM 1999 CB ASN B 52 -31.859 -1.752 -9.692 1.00 76.92 C ANISOU 1999 CB ASN B 52 10450 9819 8959 324 196 789 ATOM 2000 CG ASN B 52 -33.333 -1.487 -9.387 1.00 78.99 C ANISOU 2000 CG ASN B 52 10626 10149 9238 401 168 835 ATOM 2001 OD1 ASN B 52 -34.186 -2.368 -9.445 1.00 77.82 O ANISOU 2001 OD1 ASN B 52 10381 10123 9065 393 30 816 ATOM 2002 ND2 ASN B 52 -33.667 -0.248 -9.058 1.00 77.39 N ANISOU 2002 ND2 ASN B 52 10454 9866 9084 466 311 885 ATOM 2003 H ASN B 52 -30.810 -3.704 -8.019 1.00 82.33 H ATOM 2004 HA ASN B 52 -32.229 -3.681 -10.640 1.00 76.36 H ATOM 2005 HB3 ASN B 52 -31.641 -1.179 -10.594 1.00 76.92 H ATOM 2006 HB2 ASN B 52 -31.227 -1.335 -8.907 1.00 76.92 H ATOM 2007 HD22 ASN B 52 -34.646 -0.008 -8.961 1.00 77.39 H ATOM 2008 HD21 ASN B 52 -32.960 0.495 -9.061 1.00 77.39 H ATOM 2009 N LEU B 53 -29.918 -3.117 -11.803 1.00 82.44 N ANISOU 2009 N LEU B 53 11264 10538 9522 288 82 753 ATOM 2010 CA LEU B 53 -28.617 -3.193 -12.468 1.00 84.67 C ANISOU 2010 CA LEU B 53 11637 10751 9782 255 131 730 ATOM 2011 C LEU B 53 -28.108 -1.786 -12.818 1.00 84.59 C ANISOU 2011 C LEU B 53 11732 10620 9787 330 313 780 ATOM 2012 O LEU B 53 -28.843 -0.982 -13.396 1.00 92.01 O ANISOU 2012 O LEU B 53 12698 11561 10702 468 359 870 ATOM 2013 CB LEU B 53 -28.729 -4.059 -13.739 1.00 90.91 C ANISOU 2013 CB LEU B 53 12444 11620 10477 298 18 746 ATOM 2014 CG LEU B 53 -29.022 -5.551 -13.483 1.00 89.53 C ANISOU 2014 CG LEU B 53 12177 11555 10287 223 -137 689 ATOM 2015 CD1 LEU B 53 -29.230 -6.294 -14.809 1.00 86.70 C ANISOU 2015 CD1 LEU B 53 11835 11284 9824 278 -231 700 ATOM 2016 CD2 LEU B 53 -27.919 -6.234 -12.655 1.00 87.84 C ANISOU 2016 CD2 LEU B 53 11956 11297 10122 89 -135 615 ATOM 2017 H LEU B 53 -30.704 -2.814 -12.370 1.00 82.44 H ATOM 2018 HA LEU B 53 -27.881 -3.655 -11.810 1.00 84.67 H ATOM 2019 HB3 LEU B 53 -27.790 -3.997 -14.286 1.00 90.91 H ATOM 2020 HB2 LEU B 53 -29.489 -3.629 -14.397 1.00 90.91 H ATOM 2021 HG LEU B 53 -29.955 -5.626 -12.923 1.00 89.53 H ATOM 2022 HD11 LEU B 53 -29.652 -7.284 -14.636 1.00 86.70 H ATOM 2023 HD12 LEU B 53 -29.909 -5.760 -15.473 1.00 86.70 H ATOM 2024 HD13 LEU B 53 -28.282 -6.425 -15.330 1.00 86.70 H ATOM 2025 HD21 LEU B 53 -28.093 -7.304 -12.591 1.00 87.84 H ATOM 2026 HD22 LEU B 53 -26.926 -6.091 -13.085 1.00 87.84 H ATOM 2027 HD23 LEU B 53 -27.903 -5.871 -11.632 1.00 87.84 H ATOM 2028 N HIS B 54 -26.836 -1.545 -12.497 1.00 83.67 N ANISOU 2028 N HIS B 54 11671 10408 9711 247 421 721 ATOM 2029 CA HIS B 54 -26.097 -0.324 -12.784 1.00 88.14 C ANISOU 2029 CA HIS B 54 12349 10833 10309 281 632 738 ATOM 2030 C HIS B 54 -25.027 -0.611 -13.851 1.00 92.84 C ANISOU 2030 C HIS B 54 13024 11394 10856 281 646 731 ATOM 2031 O HIS B 54 -24.207 -1.502 -13.651 1.00 79.80 O ANISOU 2031 O HIS B 54 11326 9790 9207 171 559 651 ATOM 2032 CB HIS B 54 -25.472 0.168 -11.460 1.00 83.26 C ANISOU 2032 CB HIS B 54 11697 10148 9789 151 755 638 ATOM 2033 CG HIS B 54 -24.563 1.361 -11.595 1.00101.49 C ANISOU 2033 CG HIS B 54 14103 12313 12147 117 979 595 ATOM 2034 ND1 HIS B 54 -23.209 1.235 -11.851 1.00100.41 N ANISOU 2034 ND1 HIS B 54 14055 12045 12050 192 1186 647 ATOM 2035 CD2 HIS B 54 -24.813 2.714 -11.520 1.00109.32 C ANISOU 2035 CD2 HIS B 54 15112 13266 13159 12 1047 498 ATOM 2036 CE1 HIS B 54 -22.711 2.472 -11.930 1.00106.09 C ANISOU 2036 CE1 HIS B 54 14852 12638 12819 122 1387 575 ATOM 2037 NE2 HIS B 54 -23.618 3.412 -11.694 1.00105.52 N ANISOU 2037 NE2 HIS B 54 14728 12630 12736 6 1297 476 ATOM 2038 H HIS B 54 -26.307 -2.283 -12.024 1.00 83.67 H ATOM 2039 HA HIS B 54 -26.771 0.447 -13.153 1.00 88.14 H ATOM 2040 HB3 HIS B 54 -24.898 -0.640 -11.004 1.00 83.26 H ATOM 2041 HB2 HIS B 54 -26.263 0.420 -10.757 1.00 83.26 H ATOM 2042 HD1 HIS B 54 -22.697 0.374 -12.016 1.00100.41 H ATOM 2043 HD2 HIS B 54 -25.741 3.231 -11.353 1.00109.32 H ATOM 2044 HE1 HIS B 54 -21.673 2.685 -12.156 1.00106.09 H ATOM 2045 N ARG B 55 -25.016 0.170 -14.932 1.00 94.13 N ANISOU 2045 N ARG B 55 13311 11476 10978 410 767 818 ATOM 2046 CA ARG B 55 -24.079 0.046 -16.049 1.00 96.47 C ANISOU 2046 CA ARG B 55 13712 11719 11223 437 815 830 ATOM 2047 C ARG B 55 -22.787 0.835 -15.770 1.00 87.31 C ANISOU 2047 C ARG B 55 12600 10419 10155 317 1014 733 ATOM 2048 O ARG B 55 -22.874 2.021 -15.457 1.00 91.07 O ANISOU 2048 O ARG B 55 13104 10793 10703 302 1189 717 ATOM 2049 CB ARG B 55 -24.796 0.593 -17.301 1.00108.05 C ANISOU 2049 CB ARG B 55 15292 13169 12594 648 870 975 ATOM 2050 CG ARG B 55 -24.057 0.426 -18.636 1.00117.13 C ANISOU 2050 CG ARG B 55 16522 14343 13640 713 822 1012 ATOM 2051 CD ARG B 55 -24.868 1.042 -19.789 1.00124.22 C ANISOU 2051 CD ARG B 55 17511 15279 14409 950 839 1164 ATOM 2052 NE ARG B 55 -24.159 1.017 -21.082 1.00115.64 N ANISOU 2052 NE ARG B 55 16576 14109 13254 1030 949 1213 ATOM 2053 CZ ARG B 55 -23.259 1.887 -21.564 1.00119.89 C ANISOU 2053 CZ ARG B 55 17239 14449 13864 1009 1198 1207 ATOM 2054 NH1 ARG B 55 -22.790 2.923 -20.863 1.00126.09 N ANISOU 2054 NH1 ARG B 55 18009 15116 14784 912 1353 1148 ATOM 2055 NH2 ARG B 55 -22.795 1.711 -22.795 1.00120.70 N1+ ANISOU 2055 NH2 ARG B 55 17481 14469 13909 1072 1304 1245 ATOM 2056 H ARG B 55 -25.670 0.952 -14.975 1.00 94.13 H ATOM 2057 HA ARG B 55 -23.841 -1.007 -16.209 1.00 96.47 H ATOM 2058 HB3 ARG B 55 -25.036 1.647 -17.151 1.00108.05 H ATOM 2059 HB2 ARG B 55 -25.753 0.088 -17.393 1.00108.05 H ATOM 2060 HG3 ARG B 55 -23.987 -0.652 -18.785 1.00117.13 H ATOM 2061 HG2 ARG B 55 -23.031 0.801 -18.614 1.00117.13 H ATOM 2062 HD3 ARG B 55 -25.252 2.033 -19.547 1.00124.22 H ATOM 2063 HD2 ARG B 55 -25.746 0.413 -19.951 1.00124.22 H ATOM 2064 HH22 ARG B 55 -21.949 2.246 -23.090 1.00120.70 H ATOM 2065 HH21 ARG B 55 -23.123 1.048 -23.476 1.00120.70 H ATOM 2066 HH12 ARG B 55 -22.048 3.480 -21.308 1.00126.09 H ATOM 2067 HH11 ARG B 55 -23.085 3.164 -19.931 1.00126.09 H ATOM 2068 HE ARG B 55 -24.397 0.233 -21.675 1.00115.64 H ATOM 2069 N ASN B 56 -21.625 0.204 -15.968 1.00 96.60 N ANISOU 2069 N ASN B 56 13772 11597 11333 222 993 655 ATOM 2070 CA ASN B 56 -20.310 0.849 -16.024 1.00101.12 C ANISOU 2070 CA ASN B 56 14404 12042 11974 131 1198 566 ATOM 2071 C ASN B 56 -19.708 0.471 -17.382 1.00106.02 C ANISOU 2071 C ASN B 56 15133 12623 12527 196 1213 614 ATOM 2072 O ASN B 56 -19.615 -0.718 -17.685 1.00106.99 O ANISOU 2072 O ASN B 56 15215 12853 12585 196 1028 621 ATOM 2073 CB ASN B 56 -19.465 0.410 -14.792 1.00109.74 C ANISOU 2073 CB ASN B 56 15364 13196 13135 -51 1167 409 ATOM 2074 CG ASN B 56 -17.936 0.435 -14.970 1.00122.22 C ANISOU 2074 CG ASN B 56 16961 14713 14766 -159 1311 293 ATOM 2075 OD1 ASN B 56 -17.268 -0.552 -14.685 1.00124.08 O ANISOU 2075 OD1 ASN B 56 17320 14812 15014 -124 1493 312 ATOM 2076 ND2 ASN B 56 -17.343 1.507 -15.486 1.00142.56 N ANISOU 2076 ND2 ASN B 56 19405 17397 17366 -287 1234 168 ATOM 2077 H ASN B 56 -21.630 -0.789 -16.216 1.00 96.60 H ATOM 2078 HA ASN B 56 -20.460 1.927 -15.954 1.00101.12 H ATOM 2079 HB3 ASN B 56 -19.712 -0.627 -14.551 1.00109.74 H ATOM 2080 HB2 ASN B 56 -19.750 0.987 -13.914 1.00109.74 H ATOM 2081 HD22 ASN B 56 -16.343 1.493 -15.652 1.00142.56 H ATOM 2082 HD21 ASN B 56 -17.841 2.329 -15.782 1.00142.56 H ATOM 2083 N GLU B 57 -19.293 1.484 -18.148 1.00108.75 N ANISOU 2083 N GLU B 57 15624 12813 12882 264 1437 656 ATOM 2084 CA GLU B 57 -18.549 1.330 -19.390 1.00105.56 C ANISOU 2084 CA GLU B 57 15344 12348 12416 329 1493 701 ATOM 2085 C GLU B 57 -17.119 1.831 -19.178 1.00104.52 C ANISOU 2085 C GLU B 57 15234 12094 12383 186 1696 569 ATOM 2086 O GLU B 57 -16.900 2.704 -18.334 1.00 90.04 O ANISOU 2086 O GLU B 57 13418 10148 10646 122 1906 505 ATOM 2087 CB GLU B 57 -19.287 2.088 -20.501 1.00108.42 C ANISOU 2087 CB GLU B 57 15872 12630 12694 544 1604 866 ATOM 2088 CG GLU B 57 -18.634 2.025 -21.902 1.00121.24 C ANISOU 2088 CG GLU B 57 17625 14208 14235 620 1645 917 ATOM 2089 CD GLU B 57 -19.605 2.465 -22.998 1.00127.74 C ANISOU 2089 CD GLU B 57 18620 14973 14942 860 1750 1092 ATOM 2090 OE1 GLU B 57 -19.725 1.709 -23.979 1.00118.30 O ANISOU 2090 OE1 GLU B 57 17521 13782 13647 939 1734 1143 ATOM 2091 OE2 GLU B 57 -20.386 3.412 -22.751 1.00124.04 O1- ANISOU 2091 OE2 GLU B 57 18192 14463 14473 980 1850 1182 ATOM 2092 H GLU B 57 -19.318 2.431 -17.801 1.00108.75 H ATOM 2093 HA GLU B 57 -18.515 0.285 -19.678 1.00105.56 H ATOM 2094 HB3 GLU B 57 -19.401 3.135 -20.219 1.00108.42 H ATOM 2095 HB2 GLU B 57 -20.288 1.672 -20.579 1.00108.42 H ATOM 2096 HG3 GLU B 57 -18.293 1.009 -22.106 1.00121.24 H ATOM 2097 HG2 GLU B 57 -17.757 2.671 -21.950 1.00121.24 H ATOM 2098 N ASP B 58 -16.192 1.244 -19.933 1.00110.94 N ANISOU 2098 N ASP B 58 16047 12931 13174 137 1647 524 ATOM 2099 CA ASP B 58 -14.753 1.469 -19.872 1.00112.61 C ANISOU 2099 CA ASP B 58 16275 13041 13472 9 1838 396 ATOM 2100 C ASP B 58 -14.224 0.981 -21.240 1.00112.79 C ANISOU 2100 C ASP B 58 16408 13023 13423 78 1844 452 ATOM 2101 O ASP B 58 -14.253 -0.228 -21.480 1.00115.07 O ANISOU 2101 O ASP B 58 16635 13430 13656 65 1647 449 ATOM 2102 CB ASP B 58 -14.156 0.715 -18.659 1.00102.28 C ANISOU 2102 CB ASP B 58 14775 11854 12233 -173 1750 228 ATOM 2103 CG ASP B 58 -12.639 0.767 -18.452 1.00107.20 C ANISOU 2103 CG ASP B 58 15381 12406 12943 -311 1942 73 ATOM 2104 OD1 ASP B 58 -11.882 1.270 -19.310 1.00110.38 O ANISOU 2104 OD1 ASP B 58 15928 12665 13346 -267 2114 106 ATOM 2105 OD2 ASP B 58 -12.210 0.201 -17.421 1.00105.29 O1- ANISOU 2105 OD2 ASP B 58 14978 12263 12764 -459 1926 -84 ATOM 2106 H ASP B 58 -16.459 0.493 -20.556 1.00110.94 H ATOM 2107 HA ASP B 58 -14.549 2.526 -19.705 1.00112.61 H ATOM 2108 HB3 ASP B 58 -14.464 -0.329 -18.704 1.00102.28 H ATOM 2109 HB2 ASP B 58 -14.620 1.103 -17.752 1.00102.28 H ATOM 2110 N PRO B 59 -13.872 1.901 -22.169 1.00114.43 N ANISOU 2110 N PRO B 59 16796 13054 13629 160 2084 511 ATOM 2111 CA PRO B 59 -13.518 1.513 -23.548 1.00121.12 C ANISOU 2111 CA PRO B 59 17771 13859 14392 248 2096 583 ATOM 2112 C PRO B 59 -12.156 0.807 -23.713 1.00114.05 C ANISOU 2112 C PRO B 59 16809 12973 13552 100 2104 447 ATOM 2113 O PRO B 59 -11.971 0.129 -24.727 1.00107.83 O ANISOU 2113 O PRO B 59 16084 12203 12683 158 2032 498 ATOM 2114 CB PRO B 59 -13.604 2.835 -24.330 1.00123.01 C ANISOU 2114 CB PRO B 59 18219 13891 14627 374 2391 677 ATOM 2115 CG PRO B 59 -13.300 3.911 -23.298 1.00118.90 C ANISOU 2115 CG PRO B 59 17661 13265 14252 255 2605 571 ATOM 2116 CD PRO B 59 -13.914 3.355 -22.015 1.00114.84 C ANISOU 2116 CD PRO B 59 16952 12929 13753 182 2369 520 ATOM 2117 HA PRO B 59 -14.270 0.822 -23.935 1.00121.12 H ATOM 2118 HB3 PRO B 59 -14.618 2.965 -24.711 1.00123.01 H ATOM 2119 HB2 PRO B 59 -12.927 2.877 -25.187 1.00123.01 H ATOM 2120 HG3 PRO B 59 -13.685 4.894 -23.572 1.00118.90 H ATOM 2121 HG2 PRO B 59 -12.219 3.992 -23.180 1.00118.90 H ATOM 2122 HD2 PRO B 59 -13.362 3.698 -21.138 1.00114.84 H ATOM 2123 HD3 PRO B 59 -14.958 3.661 -21.929 1.00114.84 H ATOM 2124 N GLU B 60 -11.254 0.941 -22.726 1.00111.09 N ANISOU 2124 N GLU B 60 16293 12617 13299 -82 2166 275 ATOM 2125 CA GLU B 60 -9.945 0.276 -22.685 1.00124.38 C ANISOU 2125 CA GLU B 60 17875 14349 15037 -221 2163 132 ATOM 2126 C GLU B 60 -10.001 -1.090 -21.971 1.00126.16 C ANISOU 2126 C GLU B 60 17938 14783 15214 -249 1865 117 ATOM 2127 O GLU B 60 -8.949 -1.661 -21.667 1.00128.13 O ANISOU 2127 O GLU B 60 18078 15103 15503 -349 1844 4 ATOM 2128 CB GLU B 60 -8.888 1.215 -22.048 1.00135.57 C ANISOU 2128 CB GLU B 60 19196 15721 16594 -398 2371 -60 ATOM 2129 CG GLU B 60 -8.614 2.499 -22.864 1.00147.56 C ANISOU 2129 CG GLU B 60 20882 17004 18182 -406 2718 -82 ATOM 2130 CD GLU B 60 -7.976 2.201 -24.221 1.00150.64 C ANISOU 2130 CD GLU B 60 21396 17298 18543 -362 2808 -47 ATOM 2131 OE1 GLU B 60 -6.867 1.623 -24.255 1.00144.09 O ANISOU 2131 OE1 GLU B 60 20459 16511 17776 -495 2843 -196 ATOM 2132 OE2 GLU B 60 -8.662 2.398 -25.246 1.00132.18 O1- ANISOU 2132 OE2 GLU B 60 19256 14858 16110 -186 2841 130 ATOM 2133 H GLU B 60 -11.482 1.493 -21.907 1.00111.09 H ATOM 2134 HA GLU B 60 -9.634 0.042 -23.704 1.00124.38 H ATOM 2135 HB3 GLU B 60 -7.944 0.678 -21.919 1.00135.57 H ATOM 2136 HB2 GLU B 60 -9.212 1.509 -21.049 1.00135.57 H ATOM 2137 HG3 GLU B 60 -7.946 3.166 -22.321 1.00147.56 H ATOM 2138 HG2 GLU B 60 -9.542 3.053 -23.003 1.00147.56 H ATOM 2139 N ARG B 61 -11.217 -1.590 -21.720 1.00112.25 N ANISOU 2139 N ARG B 61 16161 13117 13371 -159 1658 224 ATOM 2140 CA ARG B 61 -11.478 -2.857 -21.063 1.00 99.38 C ANISOU 2140 CA ARG B 61 14381 11668 11712 -192 1409 206 ATOM 2141 C ARG B 61 -12.289 -3.765 -21.993 1.00100.05 C ANISOU 2141 C ARG B 61 14538 11799 11678 -72 1233 336 ATOM 2142 O ARG B 61 -13.141 -3.282 -22.740 1.00103.97 O ANISOU 2142 O ARG B 61 15149 12244 12112 42 1254 443 ATOM 2143 CB ARG B 61 -12.246 -2.565 -19.766 1.00111.19 C ANISOU 2143 CB ARG B 61 15759 13240 13247 -236 1353 170 ATOM 2144 CG ARG B 61 -12.429 -3.765 -18.819 1.00109.37 C ANISOU 2144 CG ARG B 61 15390 13181 12984 -255 1119 165 ATOM 2145 CD ARG B 61 -13.175 -3.390 -17.532 1.00 99.90 C ANISOU 2145 CD ARG B 61 14094 12050 11812 -283 1065 145 ATOM 2146 NE ARG B 61 -14.580 -3.010 -17.767 1.00 94.38 N ANISOU 2146 NE ARG B 61 13484 11298 11078 -182 1056 260 ATOM 2147 CZ ARG B 61 -15.376 -2.348 -16.914 1.00 95.95 C ANISOU 2147 CZ ARG B 61 13651 11491 11314 -188 1092 257 ATOM 2148 NH1 ARG B 61 -14.971 -1.993 -15.695 1.00 97.03 N ANISOU 2148 NH1 ARG B 61 13674 11670 11522 -303 1142 136 ATOM 2149 NH2 ARG B 61 -16.607 -2.023 -17.290 1.00 93.75 N1+ ANISOU 2149 NH2 ARG B 61 13453 11175 10995 -74 1083 373 ATOM 2150 H ARG B 61 -12.039 -1.078 -22.015 1.00112.25 H ATOM 2151 HA ARG B 61 -10.537 -3.328 -20.799 1.00 99.38 H ATOM 2152 HB3 ARG B 61 -13.210 -2.121 -20.014 1.00111.19 H ATOM 2153 HB2 ARG B 61 -11.694 -1.803 -19.219 1.00111.19 H ATOM 2154 HG3 ARG B 61 -11.458 -4.192 -18.563 1.00109.37 H ATOM 2155 HG2 ARG B 61 -12.979 -4.557 -19.324 1.00109.37 H ATOM 2156 HD3 ARG B 61 -12.664 -2.536 -17.088 1.00 99.90 H ATOM 2157 HD2 ARG B 61 -13.125 -4.191 -16.799 1.00 99.90 H ATOM 2158 HH22 ARG B 61 -17.241 -1.579 -16.635 1.00 93.75 H ATOM 2159 HH21 ARG B 61 -16.898 -2.068 -18.267 1.00 93.75 H ATOM 2160 HH12 ARG B 61 -15.604 -1.516 -15.050 1.00 97.03 H ATOM 2161 HH11 ARG B 61 -14.005 -2.078 -15.421 1.00 97.03 H ATOM 2162 HE ARG B 61 -14.964 -3.362 -18.647 1.00 94.38 H ATOM 2163 N TYR B 62 -12.078 -5.077 -21.867 1.00 94.77 N ANISOU 2163 N TYR B 62 13803 11231 10976 -96 1076 322 ATOM 2164 CA TYR B 62 -12.978 -6.102 -22.378 1.00 96.74 C ANISOU 2164 CA TYR B 62 14083 11551 11121 -19 893 410 ATOM 2165 C TYR B 62 -13.397 -6.997 -21.184 1.00 94.69 C ANISOU 2165 C TYR B 62 13679 11422 10877 -70 730 379 ATOM 2166 O TYR B 62 -12.499 -7.544 -20.533 1.00 96.11 O ANISOU 2166 O TYR B 62 13760 11651 11105 -143 721 305 ATOM 2167 CB TYR B 62 -12.257 -6.888 -23.491 1.00104.60 C ANISOU 2167 CB TYR B 62 15156 12524 12064 -4 885 421 ATOM 2168 CG TYR B 62 -13.114 -7.949 -24.151 1.00100.38 C ANISOU 2168 CG TYR B 62 14660 12059 11421 57 722 486 ATOM 2169 CD1 TYR B 62 -13.830 -7.643 -25.325 1.00106.76 C ANISOU 2169 CD1 TYR B 62 15592 12849 12122 166 718 570 ATOM 2170 CD2 TYR B 62 -13.230 -9.231 -23.573 1.00 96.00 C ANISOU 2170 CD2 TYR B 62 14010 11600 10865 10 579 460 ATOM 2171 CE1 TYR B 62 -14.667 -8.609 -25.913 1.00110.50 C ANISOU 2171 CE1 TYR B 62 16079 13417 12490 205 564 602 ATOM 2172 CE2 TYR B 62 -14.087 -10.185 -24.144 1.00107.50 C ANISOU 2172 CE2 TYR B 62 15494 13118 12232 41 449 494 ATOM 2173 CZ TYR B 62 -14.806 -9.874 -25.311 1.00107.44 C ANISOU 2173 CZ TYR B 62 15594 13111 12119 129 435 554 ATOM 2174 OH TYR B 62 -15.674 -10.791 -25.821 1.00120.35 O ANISOU 2174 OH TYR B 62 17236 14832 13661 143 306 560 ATOM 2175 H TYR B 62 -11.314 -5.393 -21.268 1.00 94.77 H ATOM 2176 HA TYR B 62 -13.832 -5.636 -22.858 1.00 96.74 H ATOM 2177 HB3 TYR B 62 -11.360 -7.359 -23.103 1.00104.60 H ATOM 2178 HB2 TYR B 62 -11.917 -6.189 -24.258 1.00104.60 H ATOM 2179 HD1 TYR B 62 -13.752 -6.660 -25.764 1.00106.76 H ATOM 2180 HD2 TYR B 62 -12.695 -9.477 -22.666 1.00 96.00 H ATOM 2181 HE1 TYR B 62 -15.217 -8.349 -26.806 1.00110.50 H ATOM 2182 HE2 TYR B 62 -14.199 -11.146 -23.665 1.00107.50 H ATOM 2183 HH TYR B 62 -16.223 -10.448 -26.530 1.00120.35 H ATOM 2184 N PRO B 63 -14.718 -7.163 -20.914 1.00 94.60 N ANISOU 2184 N PRO B 63 13646 11475 10822 -27 605 435 ATOM 2185 CA PRO B 63 -15.858 -6.491 -21.572 1.00 94.22 C ANISOU 2185 CA PRO B 63 13687 11402 10710 77 610 523 ATOM 2186 C PRO B 63 -15.873 -4.992 -21.259 1.00 99.76 C ANISOU 2186 C PRO B 63 14411 12019 11474 90 769 525 ATOM 2187 O PRO B 63 -15.543 -4.603 -20.137 1.00 92.33 O ANISOU 2187 O PRO B 63 13376 11083 10623 0 818 447 ATOM 2188 CB PRO B 63 -17.100 -7.197 -20.990 1.00 89.13 C ANISOU 2188 CB PRO B 63 12969 10873 10022 94 435 551 ATOM 2189 CG PRO B 63 -16.578 -8.485 -20.375 1.00100.31 C ANISOU 2189 CG PRO B 63 14276 12354 11482 -2 348 484 ATOM 2190 CD PRO B 63 -15.215 -8.048 -19.862 1.00 97.36 C ANISOU 2190 CD PRO B 63 13878 11934 11180 -68 461 415 ATOM 2191 HA PRO B 63 -15.807 -6.677 -22.646 1.00 94.22 H ATOM 2192 HB3 PRO B 63 -17.868 -7.380 -21.741 1.00 89.13 H ATOM 2193 HB2 PRO B 63 -17.556 -6.590 -20.203 1.00 89.13 H ATOM 2194 HG3 PRO B 63 -16.446 -9.243 -21.150 1.00100.31 H ATOM 2195 HG2 PRO B 63 -17.228 -8.900 -19.602 1.00100.31 H ATOM 2196 HD2 PRO B 63 -15.318 -7.462 -18.947 1.00 97.36 H ATOM 2197 HD3 PRO B 63 -14.578 -8.900 -19.634 1.00 97.36 H ATOM 2198 N SER B 64 -16.224 -4.167 -22.248 1.00 90.70 N ANISOU 2198 N SER B 64 13392 10794 10273 204 867 610 ATOM 2199 CA SER B 64 -16.260 -2.721 -22.080 1.00101.43 C ANISOU 2199 CA SER B 64 14806 12038 11696 227 1065 621 ATOM 2200 C SER B 64 -17.401 -2.314 -21.138 1.00 91.25 C ANISOU 2200 C SER B 64 13444 10813 10416 259 995 656 ATOM 2201 O SER B 64 -17.147 -1.638 -20.144 1.00 85.01 O ANISOU 2201 O SER B 64 12628 9957 9714 207 1124 611 ATOM 2202 CB SER B 64 -16.315 -2.045 -23.463 1.00 93.79 C ANISOU 2202 CB SER B 64 14022 10943 10672 355 1237 712 ATOM 2203 OG SER B 64 -17.358 -2.597 -24.257 1.00102.00 O ANISOU 2203 OG SER B 64 15118 12067 11572 508 1111 829 ATOM 2204 H SER B 64 -16.529 -4.479 -23.157 1.00 90.70 H ATOM 2205 HA SER B 64 -15.326 -2.417 -21.609 1.00101.43 H ATOM 2206 HB3 SER B 64 -15.361 -2.161 -23.980 1.00 93.79 H ATOM 2207 HB2 SER B 64 -16.474 -0.969 -23.352 1.00 93.79 H ATOM 2208 HG SER B 64 -17.676 -1.891 -24.835 1.00102.00 H ATOM 2209 N VAL B 65 -18.614 -2.805 -21.414 1.00 86.74 N ANISOU 2209 N VAL B 65 12837 10363 9757 334 810 721 ATOM 2210 CA VAL B 65 -19.780 -2.611 -20.569 1.00 91.32 C ANISOU 2210 CA VAL B 65 13336 11013 10349 364 739 751 ATOM 2211 C VAL B 65 -19.895 -3.785 -19.572 1.00 94.18 C ANISOU 2211 C VAL B 65 13548 11491 10744 250 566 677 ATOM 2212 O VAL B 65 -19.921 -4.938 -20.001 1.00 93.95 O ANISOU 2212 O VAL B 65 13495 11547 10656 243 425 673 ATOM 2213 CB VAL B 65 -21.076 -2.515 -21.421 1.00 98.92 C ANISOU 2213 CB VAL B 65 14350 12044 11193 539 673 873 ATOM 2214 CG1 VAL B 65 -22.340 -2.300 -20.565 1.00 98.85 C ANISOU 2214 CG1 VAL B 65 14249 12105 11205 573 613 901 ATOM 2215 CG2 VAL B 65 -20.955 -1.375 -22.455 1.00 93.90 C ANISOU 2215 CG2 VAL B 65 13881 11284 10512 677 867 964 ATOM 2216 H VAL B 65 -18.740 -3.341 -22.259 1.00 86.74 H ATOM 2217 HA VAL B 65 -19.676 -1.677 -20.023 1.00 91.32 H ATOM 2218 HB VAL B 65 -21.206 -3.450 -21.970 1.00 98.92 H ATOM 2219 HG11 VAL B 65 -23.226 -2.143 -21.180 1.00 98.85 H ATOM 2220 HG12 VAL B 65 -22.552 -3.149 -19.911 1.00 98.85 H ATOM 2221 HG13 VAL B 65 -22.206 -1.425 -19.931 1.00 98.85 H ATOM 2222 HG21 VAL B 65 -21.851 -1.277 -23.067 1.00 93.90 H ATOM 2223 HG22 VAL B 65 -20.784 -0.419 -21.958 1.00 93.90 H ATOM 2224 HG23 VAL B 65 -20.120 -1.527 -23.141 1.00 93.90 H ATOM 2225 N ILE B 66 -19.978 -3.465 -18.277 1.00 98.49 N ANISOU 2225 N ILE B 66 14007 12034 11380 170 598 620 ATOM 2226 CA ILE B 66 -20.306 -4.381 -17.189 1.00 90.77 C ANISOU 2226 CA ILE B 66 12893 11161 10434 81 458 563 ATOM 2227 C ILE B 66 -21.557 -3.813 -16.484 1.00 79.83 C ANISOU 2227 C ILE B 66 11453 9809 9072 113 436 595 ATOM 2228 O ILE B 66 -21.754 -2.594 -16.448 1.00 81.99 O ANISOU 2228 O ILE B 66 11756 10004 9394 130 576 602 ATOM 2229 CB ILE B 66 -19.111 -4.538 -16.192 1.00 90.30 C ANISOU 2229 CB ILE B 66 12768 11093 10449 -45 514 454 ATOM 2230 CG1 ILE B 66 -17.929 -5.232 -16.914 1.00 98.73 C ANISOU 2230 CG1 ILE B 66 13874 12148 11492 -69 516 426 ATOM 2231 CG2 ILE B 66 -19.444 -5.299 -14.881 1.00 91.98 C ANISOU 2231 CG2 ILE B 66 12856 11406 10686 -108 402 413 ATOM 2232 CD1 ILE B 66 -16.661 -5.388 -16.060 1.00101.95 C ANISOU 2232 CD1 ILE B 66 14211 12562 11962 -173 588 317 ATOM 2233 H ILE B 66 -19.959 -2.484 -18.002 1.00 98.49 H ATOM 2234 HA ILE B 66 -20.567 -5.363 -17.591 1.00 90.77 H ATOM 2235 HB ILE B 66 -18.789 -3.535 -15.902 1.00 90.30 H ATOM 2236 HG13 ILE B 66 -17.658 -4.684 -17.817 1.00 98.73 H ATOM 2237 HG12 ILE B 66 -18.261 -6.211 -17.267 1.00 98.73 H ATOM 2238 HG21 ILE B 66 -18.583 -5.353 -14.210 1.00 91.98 H ATOM 2239 HG22 ILE B 66 -20.226 -4.819 -14.291 1.00 91.98 H ATOM 2240 HG23 ILE B 66 -19.755 -6.324 -15.086 1.00 91.98 H ATOM 2241 HD11 ILE B 66 -15.780 -5.507 -16.693 1.00101.95 H ATOM 2242 HD12 ILE B 66 -16.496 -4.518 -15.425 1.00101.95 H ATOM 2243 HD13 ILE B 66 -16.718 -6.260 -15.405 1.00101.95 H ATOM 2244 N TRP B 67 -22.400 -4.716 -15.978 1.00 82.31 N ANISOU 2244 N TRP B 67 11696 10228 9350 125 279 614 ATOM 2245 CA TRP B 67 -23.657 -4.422 -15.312 1.00 90.32 C ANISOU 2245 CA TRP B 67 12636 11291 10389 143 238 635 ATOM 2246 C TRP B 67 -23.543 -4.961 -13.884 1.00 88.56 C ANISOU 2246 C TRP B 67 12311 11105 10232 26 198 556 ATOM 2247 O TRP B 67 -23.367 -6.165 -13.719 1.00 87.67 O ANISOU 2247 O TRP B 67 12162 11046 10103 -27 105 523 ATOM 2248 CB TRP B 67 -24.795 -5.131 -16.060 1.00 94.08 C ANISOU 2248 CB TRP B 67 13087 11872 10786 220 99 685 ATOM 2249 CG TRP B 67 -25.183 -4.523 -17.365 1.00102.94 C ANISOU 2249 CG TRP B 67 14302 12989 11821 364 135 771 ATOM 2250 CD1 TRP B 67 -24.754 -4.897 -18.594 1.00 98.91 C ANISOU 2250 CD1 TRP B 67 13869 12484 11227 405 116 788 ATOM 2251 CD2 TRP B 67 -26.098 -3.408 -17.576 1.00104.39 C ANISOU 2251 CD2 TRP B 67 14515 13165 11982 503 204 861 ATOM 2252 NE1 TRP B 67 -25.382 -4.118 -19.548 1.00107.99 N ANISOU 2252 NE1 TRP B 67 15095 13640 12295 566 164 883 ATOM 2253 CE2 TRP B 67 -26.236 -3.194 -18.980 1.00111.59 C ANISOU 2253 CE2 TRP B 67 15524 14089 12785 638 220 936 ATOM 2254 CE3 TRP B 67 -26.860 -2.584 -16.717 1.00108.72 C ANISOU 2254 CE3 TRP B 67 15019 13704 12586 539 255 892 ATOM 2255 CZ2 TRP B 67 -27.116 -2.234 -19.501 1.00104.65 C ANISOU 2255 CZ2 TRP B 67 14697 13224 11840 824 284 1051 ATOM 2256 CZ3 TRP B 67 -27.764 -1.629 -17.229 1.00116.32 C ANISOU 2256 CZ3 TRP B 67 16033 14666 13497 714 325 1002 ATOM 2257 CH2 TRP B 67 -27.893 -1.456 -18.619 1.00106.10 C ANISOU 2257 CH2 TRP B 67 14834 13394 12084 864 340 1085 ATOM 2258 H TRP B 67 -22.097 -5.675 -15.878 1.00 82.31 H ATOM 2259 HA TRP B 67 -23.866 -3.350 -15.291 1.00 90.32 H ATOM 2260 HB3 TRP B 67 -25.695 -5.125 -15.443 1.00 94.08 H ATOM 2261 HB2 TRP B 67 -24.555 -6.183 -16.208 1.00 94.08 H ATOM 2262 HD1 TRP B 67 -24.080 -5.722 -18.785 1.00 98.91 H ATOM 2263 HE1 TRP B 67 -25.315 -4.317 -20.537 1.00107.99 H ATOM 2264 HE3 TRP B 67 -26.773 -2.707 -15.650 1.00108.72 H ATOM 2265 HZ2 TRP B 67 -27.231 -2.120 -20.568 1.00104.65 H ATOM 2266 HZ3 TRP B 67 -28.362 -1.041 -16.546 1.00116.32 H ATOM 2267 HH2 TRP B 67 -28.603 -0.741 -19.008 1.00106.10 H ATOM 2268 N GLU B 68 -23.603 -4.069 -12.897 1.00 81.41 N ANISOU 2268 N GLU B 68 11372 10170 9391 -3 281 534 ATOM 2269 CA GLU B 68 -23.422 -4.400 -11.491 1.00 83.07 C ANISOU 2269 CA GLU B 68 11489 10422 9653 -102 265 460 ATOM 2270 C GLU B 68 -24.783 -4.364 -10.781 1.00 83.72 C ANISOU 2270 C GLU B 68 11510 10549 9752 -78 208 492 ATOM 2271 O GLU B 68 -25.520 -3.389 -10.953 1.00 83.44 O ANISOU 2271 O GLU B 68 11501 10472 9728 -8 272 544 ATOM 2272 CB GLU B 68 -22.452 -3.363 -10.901 1.00 91.36 C ANISOU 2272 CB GLU B 68 12546 11408 10759 -166 421 385 ATOM 2273 CG GLU B 68 -22.085 -3.654 -9.426 1.00123.53 C ANISOU 2273 CG GLU B 68 16524 15556 14857 -268 406 287 ATOM 2274 CD GLU B 68 -20.605 -3.868 -9.104 1.00135.99 C ANISOU 2274 CD GLU B 68 18083 17154 16434 -336 453 197 ATOM 2275 OE1 GLU B 68 -20.391 -4.291 -7.950 1.00133.42 O ANISOU 2275 OE1 GLU B 68 17663 16927 16105 -396 420 124 ATOM 2276 OE2 GLU B 68 -19.740 -3.633 -9.968 1.00130.06 O1- ANISOU 2276 OE2 GLU B 68 17405 16332 15678 -322 525 199 ATOM 2277 H GLU B 68 -23.776 -3.086 -13.102 1.00 81.41 H ATOM 2278 HA GLU B 68 -22.975 -5.392 -11.377 1.00 83.07 H ATOM 2279 HB3 GLU B 68 -22.902 -2.372 -10.956 1.00 91.36 H ATOM 2280 HB2 GLU B 68 -21.578 -3.314 -11.548 1.00 91.36 H ATOM 2281 HG3 GLU B 68 -22.596 -4.556 -9.101 1.00123.53 H ATOM 2282 HG2 GLU B 68 -22.462 -2.864 -8.777 1.00123.53 H ATOM 2283 N ALA B 69 -25.069 -5.392 -9.974 1.00 88.20 N ANISOU 2283 N ALA B 69 12000 11190 10322 -131 109 464 ATOM 2284 CA ALA B 69 -26.253 -5.473 -9.128 1.00 81.24 C ANISOU 2284 CA ALA B 69 11049 10350 9468 -130 65 478 ATOM 2285 C ALA B 69 -26.161 -4.488 -7.956 1.00 77.51 C ANISOU 2285 C ALA B 69 10550 9849 9053 -171 167 438 ATOM 2286 O ALA B 69 -25.113 -4.381 -7.319 1.00 83.24 O ANISOU 2286 O ALA B 69 11270 10571 9788 -236 226 369 ATOM 2287 CB ALA B 69 -26.430 -6.914 -8.619 1.00 80.79 C ANISOU 2287 CB ALA B 69 10938 10358 9399 -177 -37 456 ATOM 2288 H ALA B 69 -24.367 -6.116 -9.835 1.00 88.20 H ATOM 2289 HA ALA B 69 -27.124 -5.207 -9.724 1.00 81.24 H ATOM 2290 HB1 ALA B 69 -27.289 -6.995 -7.950 1.00 80.79 H ATOM 2291 HB2 ALA B 69 -26.590 -7.608 -9.446 1.00 80.79 H ATOM 2292 HB3 ALA B 69 -25.560 -7.257 -8.064 1.00 80.79 H ATOM 2293 N LYS B 70 -27.268 -3.796 -7.688 1.00 83.07 N ANISOU 2293 N LYS B 70 11236 10539 9788 -130 195 476 ATOM 2294 CA LYS B 70 -27.470 -2.905 -6.560 1.00 75.75 C ANISOU 2294 CA LYS B 70 10287 9578 8919 -165 300 442 ATOM 2295 C LYS B 70 -28.745 -3.367 -5.858 1.00 74.54 C ANISOU 2295 C LYS B 70 10063 9475 8784 -154 230 468 ATOM 2296 O LYS B 70 -29.798 -3.361 -6.500 1.00 78.13 O ANISOU 2296 O LYS B 70 10509 9947 9229 -73 182 536 ATOM 2297 CB LYS B 70 -27.649 -1.462 -7.082 1.00 84.27 C ANISOU 2297 CB LYS B 70 11441 10555 10025 -104 448 478 ATOM 2298 CG LYS B 70 -26.404 -0.852 -7.748 1.00 90.27 C ANISOU 2298 CG LYS B 70 12276 11243 10780 -127 555 440 ATOM 2299 CD LYS B 70 -25.233 -0.656 -6.762 1.00 96.74 C ANISOU 2299 CD LYS B 70 13073 12042 11643 -246 669 320 ATOM 2300 CE LYS B 70 -24.131 0.290 -7.264 1.00119.57 C ANISOU 2300 CE LYS B 70 16048 14821 14561 -264 850 280 ATOM 2301 NZ LYS B 70 -24.602 1.687 -7.362 1.00130.90 N1+ ANISOU 2301 NZ LYS B 70 17556 16131 16050 -211 1029 322 ATOM 2302 H LYS B 70 -28.079 -3.911 -8.293 1.00 83.07 H ATOM 2303 HA LYS B 70 -26.638 -2.958 -5.862 1.00 75.75 H ATOM 2304 HB3 LYS B 70 -27.955 -0.820 -6.254 1.00 84.27 H ATOM 2305 HB2 LYS B 70 -28.479 -1.437 -7.790 1.00 84.27 H ATOM 2306 HG3 LYS B 70 -26.701 0.087 -8.216 1.00 90.27 H ATOM 2307 HG2 LYS B 70 -26.081 -1.496 -8.569 1.00 90.27 H ATOM 2308 HD3 LYS B 70 -24.774 -1.634 -6.590 1.00 96.74 H ATOM 2309 HD2 LYS B 70 -25.601 -0.343 -5.783 1.00 96.74 H ATOM 2310 HE3 LYS B 70 -23.753 -0.060 -8.228 1.00119.57 H ATOM 2311 HE2 LYS B 70 -23.290 0.265 -6.568 1.00119.57 H ATOM 2312 HZ1 LYS B 70 -24.950 1.980 -6.461 1.00130.90 H ATOM 2313 HZ2 LYS B 70 -23.840 2.287 -7.643 1.00130.90 H ATOM 2314 HZ3 LYS B 70 -25.340 1.744 -8.048 1.00130.90 H ATOM 2315 N CYS B 71 -28.655 -3.752 -4.577 1.00 69.78 N ANISOU 2315 N CYS B 71 9406 8911 8197 -229 218 412 ATOM 2316 CA CYS B 71 -29.834 -4.159 -3.804 1.00 77.83 C ANISOU 2316 CA CYS B 71 10360 9970 9241 -235 169 426 ATOM 2317 C CYS B 71 -30.768 -2.954 -3.603 1.00 70.49 C ANISOU 2317 C CYS B 71 9429 8994 8361 -182 249 466 ATOM 2318 O CYS B 71 -30.282 -1.866 -3.288 1.00 68.52 O ANISOU 2318 O CYS B 71 9223 8675 8138 -187 377 446 ATOM 2319 CB CYS B 71 -29.437 -4.748 -2.439 1.00 74.40 C ANISOU 2319 CB CYS B 71 9887 9578 8802 -312 177 361 ATOM 2320 SG CYS B 71 -28.119 -6.001 -2.409 1.00 77.64 S ANISOU 2320 SG CYS B 71 10300 10054 9146 -342 99 332 ATOM 2321 H CYS B 71 -27.768 -3.704 -4.080 1.00 69.78 H ATOM 2322 HA CYS B 71 -30.363 -4.929 -4.369 1.00 77.83 H ATOM 2323 HB3 CYS B 71 -30.317 -5.193 -1.976 1.00 74.40 H ATOM 2324 HB2 CYS B 71 -29.128 -3.940 -1.777 1.00 74.40 H ATOM 2325 N ARG B 72 -32.077 -3.145 -3.815 1.00 71.61 N ANISOU 2325 N ARG B 72 9525 9170 8516 -126 189 518 ATOM 2326 CA ARG B 72 -33.047 -2.054 -3.689 1.00 72.54 C ANISOU 2326 CA ARG B 72 9631 9255 8675 -48 262 572 ATOM 2327 C ARG B 72 -33.252 -1.581 -2.242 1.00 77.11 C ANISOU 2327 C ARG B 72 10187 9802 9309 -113 348 528 ATOM 2328 O ARG B 72 -33.605 -0.419 -2.041 1.00 76.83 O ANISOU 2328 O ARG B 72 10183 9694 9315 -78 477 547 ATOM 2329 CB ARG B 72 -34.417 -2.458 -4.255 1.00 81.23 C ANISOU 2329 CB ARG B 72 10659 10437 9766 27 161 624 ATOM 2330 CG ARG B 72 -34.419 -2.888 -5.725 1.00 89.34 C ANISOU 2330 CG ARG B 72 11706 11513 10726 119 91 673 ATOM 2331 CD ARG B 72 -35.852 -3.138 -6.207 1.00 94.34 C ANISOU 2331 CD ARG B 72 12248 12254 11341 214 12 717 ATOM 2332 NE ARG B 72 -35.879 -3.700 -7.563 1.00 98.82 N ANISOU 2332 NE ARG B 72 12807 12914 11828 251 -100 719 ATOM 2333 CZ ARG B 72 -36.811 -4.486 -8.109 1.00113.35 C ANISOU 2333 CZ ARG B 72 14541 14887 13640 255 -218 691 ATOM 2334 NH1 ARG B 72 -37.901 -4.871 -7.443 1.00116.86 N ANISOU 2334 NH1 ARG B 72 14881 15378 14142 227 -232 665 ATOM 2335 NH2 ARG B 72 -36.643 -4.900 -9.355 1.00107.15 N1+ ANISOU 2335 NH2 ARG B 72 13750 14188 12772 274 -313 675 ATOM 2336 H ARG B 72 -32.427 -4.078 -4.015 1.00 71.61 H ATOM 2337 HA ARG B 72 -32.671 -1.203 -4.263 1.00 72.54 H ATOM 2338 HB3 ARG B 72 -35.099 -1.615 -4.136 1.00 81.23 H ATOM 2339 HB2 ARG B 72 -34.834 -3.259 -3.643 1.00 81.23 H ATOM 2340 HG3 ARG B 72 -33.780 -3.753 -5.894 1.00 89.34 H ATOM 2341 HG2 ARG B 72 -33.991 -2.066 -6.301 1.00 89.34 H ATOM 2342 HD3 ARG B 72 -36.380 -2.185 -6.279 1.00 94.34 H ATOM 2343 HD2 ARG B 72 -36.391 -3.739 -5.480 1.00 94.34 H ATOM 2344 HH22 ARG B 72 -37.408 -5.360 -9.854 1.00107.15 H ATOM 2345 HH21 ARG B 72 -35.787 -4.710 -9.857 1.00107.15 H ATOM 2346 HH12 ARG B 72 -38.545 -5.534 -7.843 1.00116.86 H ATOM 2347 HH11 ARG B 72 -38.126 -4.504 -6.513 1.00116.86 H ATOM 2348 HE ARG B 72 -35.164 -3.318 -8.194 1.00 98.82 H ATOM 2349 N HIS B 73 -33.103 -2.498 -1.281 1.00 77.85 N ANISOU 2349 N HIS B 73 10240 9942 9398 -199 294 473 ATOM 2350 CA HIS B 73 -33.447 -2.272 0.110 1.00 77.84 C ANISOU 2350 CA HIS B 73 10209 9934 9435 -255 356 432 ATOM 2351 C HIS B 73 -32.270 -2.672 1.003 1.00 73.70 C ANISOU 2351 C HIS B 73 9688 9445 8870 -346 362 350 ATOM 2352 O HIS B 73 -31.411 -3.460 0.601 1.00 75.51 O ANISOU 2352 O HIS B 73 9924 9722 9044 -362 284 336 ATOM 2353 CB HIS B 73 -34.733 -3.075 0.424 1.00 81.66 C ANISOU 2353 CB HIS B 73 10623 10460 9946 -243 288 460 ATOM 2354 CG HIS B 73 -35.885 -2.831 -0.532 1.00 80.57 C ANISOU 2354 CG HIS B 73 10447 10336 9830 -149 256 527 ATOM 2355 ND1 HIS B 73 -36.455 -1.586 -0.746 1.00 93.64 N ANISOU 2355 ND1 HIS B 73 12112 11945 11523 -69 350 577 ATOM 2356 CD2 HIS B 73 -36.550 -3.680 -1.388 1.00 84.83 C ANISOU 2356 CD2 HIS B 73 10934 10945 10352 -114 147 550 ATOM 2357 CE1 HIS B 73 -37.401 -1.729 -1.676 1.00 78.83 C ANISOU 2357 CE1 HIS B 73 10184 10127 9642 28 289 637 ATOM 2358 NE2 HIS B 73 -37.493 -2.971 -2.145 1.00 74.53 N ANISOU 2358 NE2 HIS B 73 9595 9661 9060 -5 159 612 ATOM 2359 H HIS B 73 -32.824 -3.454 -1.496 1.00 77.85 H ATOM 2360 HA HIS B 73 -33.629 -1.213 0.290 1.00 77.84 H ATOM 2361 HB3 HIS B 73 -35.069 -2.874 1.440 1.00 81.66 H ATOM 2362 HB2 HIS B 73 -34.512 -4.143 0.395 1.00 81.66 H ATOM 2363 HD1 HIS B 73 -36.179 -0.709 -0.329 1.00 93.64 H ATOM 2364 HD2 HIS B 73 -36.405 -4.737 -1.539 1.00 84.83 H ATOM 2365 HE1 HIS B 73 -38.015 -0.911 -2.030 1.00 78.83 H ATOM 2366 N LEU B 74 -32.252 -2.086 2.205 1.00 68.69 N ANISOU 2366 N LEU B 74 9047 8799 8253 -396 456 295 ATOM 2367 CA LEU B 74 -31.373 -2.462 3.312 1.00 72.46 C ANISOU 2367 CA LEU B 74 9506 9349 8675 -470 459 211 ATOM 2368 C LEU B 74 -31.887 -3.766 3.941 1.00 72.63 C ANISOU 2368 C LEU B 74 9497 9429 8670 -461 373 241 ATOM 2369 O LEU B 74 -31.111 -4.706 4.113 1.00 71.45 O ANISOU 2369 O LEU B 74 9346 9353 8449 -469 317 223 ATOM 2370 CB LEU B 74 -31.329 -1.285 4.320 1.00 77.07 C ANISOU 2370 CB LEU B 74 10086 9909 9288 -523 588 144 ATOM 2371 CG LEU B 74 -30.448 -1.470 5.578 1.00 75.11 C ANISOU 2371 CG LEU B 74 9807 9769 8964 -594 593 42 ATOM 2372 CD1 LEU B 74 -28.947 -1.474 5.243 1.00 63.05 C ANISOU 2372 CD1 LEU B 74 8276 8308 7372 -619 563 -18 ATOM 2373 CD2 LEU B 74 -30.769 -0.392 6.620 1.00 73.77 C ANISOU 2373 CD2 LEU B 74 9633 9577 8821 -661 731 -44 ATOM 2374 H LEU B 74 -32.895 -1.338 2.392 1.00 68.69 H ATOM 2375 HA LEU B 74 -30.364 -2.645 2.932 1.00 72.46 H ATOM 2376 HB3 LEU B 74 -32.348 -1.081 4.652 1.00 77.07 H ATOM 2377 HB2 LEU B 74 -31.005 -0.383 3.797 1.00 77.07 H ATOM 2378 HG LEU B 74 -30.692 -2.427 6.039 1.00 75.11 H ATOM 2379 HD11 LEU B 74 -28.349 -1.712 6.123 1.00 63.05 H ATOM 2380 HD12 LEU B 74 -28.705 -2.217 4.486 1.00 63.05 H ATOM 2381 HD13 LEU B 74 -28.615 -0.505 4.869 1.00 63.05 H ATOM 2382 HD21 LEU B 74 -30.201 -0.552 7.535 1.00 73.77 H ATOM 2383 HD22 LEU B 74 -30.531 0.603 6.247 1.00 73.77 H ATOM 2384 HD23 LEU B 74 -31.824 -0.403 6.895 1.00 73.77 H ATOM 2385 N GLY B 75 -33.202 -3.801 4.209 1.00 68.32 N ANISOU 2385 N GLY B 75 8929 8847 8181 -436 373 290 ATOM 2386 CA GLY B 75 -33.894 -4.966 4.746 1.00 74.29 C ANISOU 2386 CA GLY B 75 9662 9629 8933 -433 319 318 ATOM 2387 C GLY B 75 -34.305 -5.917 3.619 1.00 80.48 C ANISOU 2387 C GLY B 75 10440 10409 9731 -402 232 365 ATOM 2388 O GLY B 75 -33.869 -5.767 2.477 1.00 85.84 O ANISOU 2388 O GLY B 75 11139 11084 10394 -379 197 376 ATOM 2389 H GLY B 75 -33.777 -3.011 3.976 1.00 68.32 H ATOM 2390 HA3 GLY B 75 -34.770 -4.650 5.311 1.00 74.29 H ATOM 2391 HA2 GLY B 75 -33.235 -5.495 5.423 1.00 74.29 H ATOM 2392 N CYS B 76 -35.154 -6.894 3.939 1.00 73.63 N ANISOU 2392 N CYS B 76 9547 9542 8887 -410 212 381 ATOM 2393 CA CYS B 76 -35.724 -7.838 2.971 1.00 76.96 C ANISOU 2393 CA CYS B 76 9950 9967 9325 -407 145 398 ATOM 2394 C CYS B 76 -37.238 -7.643 2.932 1.00 71.46 C ANISOU 2394 C CYS B 76 9179 9265 8707 -406 151 404 ATOM 2395 O CYS B 76 -37.821 -7.289 3.952 1.00 77.95 O ANISOU 2395 O CYS B 76 9981 10068 9568 -412 214 403 ATOM 2396 CB CYS B 76 -35.412 -9.288 3.379 1.00 73.97 C ANISOU 2396 CB CYS B 76 9610 9591 8904 -429 141 394 ATOM 2397 SG CYS B 76 -33.647 -9.673 3.505 1.00 78.57 S ANISOU 2397 SG CYS B 76 10257 10212 9383 -409 132 390 ATOM 2398 H CYS B 76 -35.568 -6.909 4.870 1.00 73.63 H ATOM 2399 HA CYS B 76 -35.326 -7.661 1.971 1.00 76.96 H ATOM 2400 HB3 CYS B 76 -35.846 -9.968 2.642 1.00 73.97 H ATOM 2401 HB2 CYS B 76 -35.887 -9.540 4.331 1.00 73.97 H ATOM 2402 N ILE B 77 -37.847 -7.885 1.770 1.00 81.72 N ANISOU 2402 N ILE B 77 10432 10595 10025 -394 87 403 ATOM 2403 CA ILE B 77 -39.290 -7.874 1.586 1.00 89.55 C ANISOU 2403 CA ILE B 77 11323 11618 11083 -382 80 398 ATOM 2404 C ILE B 77 -39.883 -9.173 2.168 1.00 82.93 C ANISOU 2404 C ILE B 77 10456 10768 10284 -456 104 354 ATOM 2405 O ILE B 77 -39.390 -10.255 1.836 1.00 85.34 O ANISOU 2405 O ILE B 77 10800 11064 10560 -497 85 330 ATOM 2406 CB ILE B 77 -39.673 -7.698 0.089 1.00 91.19 C ANISOU 2406 CB ILE B 77 11477 11898 11273 -324 -3 408 ATOM 2407 CG1 ILE B 77 -39.183 -6.320 -0.421 1.00 92.07 C ANISOU 2407 CG1 ILE B 77 11637 11991 11354 -239 18 465 ATOM 2408 CG2 ILE B 77 -41.189 -7.846 -0.182 1.00 90.01 C ANISOU 2408 CG2 ILE B 77 11199 11824 11179 -312 -24 386 ATOM 2409 CD1 ILE B 77 -39.405 -6.102 -1.923 1.00107.16 C ANISOU 2409 CD1 ILE B 77 13523 13968 13224 -153 -49 496 ATOM 2410 H ILE B 77 -37.306 -8.307 1.018 1.00 81.72 H ATOM 2411 HA ILE B 77 -39.681 -7.016 2.122 1.00 89.55 H ATOM 2412 HB ILE B 77 -39.161 -8.471 -0.490 1.00 91.19 H ATOM 2413 HG13 ILE B 77 -38.123 -6.183 -0.200 1.00 92.07 H ATOM 2414 HG12 ILE B 77 -39.704 -5.534 0.130 1.00 92.07 H ATOM 2415 HG21 ILE B 77 -41.456 -7.645 -1.221 1.00 90.01 H ATOM 2416 HG22 ILE B 77 -41.548 -8.854 0.027 1.00 90.01 H ATOM 2417 HG23 ILE B 77 -41.751 -7.153 0.442 1.00 90.01 H ATOM 2418 HD11 ILE B 77 -38.683 -5.399 -2.328 1.00107.16 H ATOM 2419 HD12 ILE B 77 -39.314 -7.034 -2.485 1.00107.16 H ATOM 2420 HD13 ILE B 77 -40.395 -5.688 -2.117 1.00107.16 H ATOM 2421 N ASN B 78 -40.893 -9.034 3.031 1.00 90.96 N ANISOU 2421 N ASN B 78 11422 11772 11369 -472 164 345 ATOM 2422 CA ASN B 78 -41.641 -10.132 3.643 1.00 97.83 C ANISOU 2422 CA ASN B 78 12275 12609 12288 -548 224 301 ATOM 2423 C ASN B 78 -42.872 -10.512 2.790 1.00 91.42 C ANISOU 2423 C ASN B 78 11335 11866 11535 -580 184 240 ATOM 2424 O ASN B 78 -43.156 -9.848 1.791 1.00 82.49 O ANISOU 2424 O ASN B 78 10134 10819 10388 -523 105 248 ATOM 2425 CB ASN B 78 -41.996 -9.763 5.109 1.00 97.63 C ANISOU 2425 CB ASN B 78 12268 12529 12300 -557 324 315 ATOM 2426 CG ASN B 78 -43.074 -8.696 5.352 1.00101.78 C ANISOU 2426 CG ASN B 78 12705 13077 12887 -521 342 326 ATOM 2427 OD1 ASN B 78 -43.724 -8.185 4.445 1.00 96.56 O ANISOU 2427 OD1 ASN B 78 11944 12488 12258 -487 284 319 ATOM 2428 ND2 ASN B 78 -43.293 -8.377 6.617 1.00 94.73 N ANISOU 2428 ND2 ASN B 78 11850 12133 12010 -522 431 343 ATOM 2429 H ASN B 78 -41.252 -8.098 3.226 1.00 90.96 H ATOM 2430 HA ASN B 78 -41.028 -11.035 3.682 1.00 97.83 H ATOM 2431 HB3 ASN B 78 -41.087 -9.460 5.629 1.00 97.63 H ATOM 2432 HB2 ASN B 78 -42.349 -10.660 5.617 1.00 97.63 H ATOM 2433 HD22 ASN B 78 -44.099 -7.815 6.854 1.00 94.73 H ATOM 2434 HD21 ASN B 78 -42.729 -8.807 7.358 1.00 94.73 H ATOM 2435 N ALA B 79 -43.596 -11.563 3.204 1.00103.46 N ANISOU 2435 N ALA B 79 12829 13362 13120 -665 250 178 ATOM 2436 CA ALA B 79 -44.795 -12.089 2.536 1.00107.38 C ANISOU 2436 CA ALA B 79 13190 13938 13673 -728 224 82 ATOM 2437 C ALA B 79 -45.922 -11.061 2.313 1.00108.64 C ANISOU 2437 C ALA B 79 13200 14203 13877 -672 184 80 ATOM 2438 O ALA B 79 -46.630 -11.172 1.314 1.00 95.53 O ANISOU 2438 O ALA B 79 11406 12665 12225 -687 116 8 ATOM 2439 CB ALA B 79 -45.324 -13.291 3.335 1.00111.17 C ANISOU 2439 CB ALA B 79 13690 14331 14217 -840 346 13 ATOM 2440 H ALA B 79 -43.262 -12.102 3.999 1.00103.46 H ATOM 2441 HA ALA B 79 -44.490 -12.435 1.545 1.00107.38 H ATOM 2442 HB1 ALA B 79 -46.194 -13.736 2.849 1.00111.17 H ATOM 2443 HB2 ALA B 79 -44.567 -14.070 3.425 1.00111.17 H ATOM 2444 HB3 ALA B 79 -45.629 -12.991 4.337 1.00111.17 H ATOM 2445 N ASP B 80 -46.032 -10.072 3.211 1.00102.26 N ANISOU 2445 N ASP B 80 12405 13361 13088 -602 225 153 ATOM 2446 CA ASP B 80 -47.002 -8.966 3.151 1.00102.82 C ANISOU 2446 CA ASP B 80 12347 13524 13194 -517 199 174 ATOM 2447 C ASP B 80 -46.598 -7.894 2.117 1.00105.16 C ANISOU 2447 C ASP B 80 12649 13892 13413 -388 108 248 ATOM 2448 O ASP B 80 -47.390 -7.001 1.814 1.00101.76 O ANISOU 2448 O ASP B 80 12121 13547 12995 -284 89 286 ATOM 2449 CB ASP B 80 -47.232 -8.269 4.522 1.00118.20 C ANISOU 2449 CB ASP B 80 14324 15386 15199 -497 307 222 ATOM 2450 CG ASP B 80 -47.621 -9.166 5.703 1.00131.20 C ANISOU 2450 CG ASP B 80 15997 16941 16913 -604 421 172 ATOM 2451 OD1 ASP B 80 -48.262 -10.218 5.484 1.00127.64 O ANISOU 2451 OD1 ASP B 80 15488 16506 16502 -697 434 84 ATOM 2452 OD2 ASP B 80 -47.392 -8.708 6.845 1.00146.33 O1- ANISOU 2452 OD2 ASP B 80 17998 18763 18836 -596 510 218 ATOM 2453 H ASP B 80 -45.426 -10.064 4.018 1.00102.26 H ATOM 2454 HA ASP B 80 -47.961 -9.379 2.826 1.00102.82 H ATOM 2455 HB3 ASP B 80 -48.028 -7.531 4.418 1.00118.20 H ATOM 2456 HB2 ASP B 80 -46.336 -7.716 4.810 1.00118.20 H ATOM 2457 N GLY B 81 -45.367 -7.971 1.589 1.00 93.17 N ANISOU 2457 N GLY B 81 11252 12333 11817 -378 72 280 ATOM 2458 CA GLY B 81 -44.822 -7.035 0.610 1.00 93.90 C ANISOU 2458 CA GLY B 81 11385 12456 11838 -259 20 357 ATOM 2459 C GLY B 81 -44.160 -5.824 1.292 1.00 93.82 C ANISOU 2459 C GLY B 81 11474 12343 11832 -202 109 435 ATOM 2460 O GLY B 81 -43.822 -4.854 0.611 1.00 92.18 O ANISOU 2460 O GLY B 81 11296 12142 11587 -95 108 502 ATOM 2461 H GLY B 81 -44.770 -8.742 1.876 1.00 93.17 H ATOM 2462 HA3 GLY B 81 -45.602 -6.694 -0.075 1.00 93.90 H ATOM 2463 HA2 GLY B 81 -44.081 -7.562 0.008 1.00 93.90 H ATOM 2464 N ASN B 82 -43.969 -5.857 2.616 1.00 97.87 N ANISOU 2464 N ASN B 82 12041 12761 12384 -271 198 423 ATOM 2465 CA ASN B 82 -43.304 -4.813 3.401 1.00 96.21 C ANISOU 2465 CA ASN B 82 11925 12460 12170 -244 289 468 ATOM 2466 C ASN B 82 -41.830 -5.168 3.579 1.00 90.51 C ANISOU 2466 C ASN B 82 11323 11691 11378 -291 283 457 ATOM 2467 O ASN B 82 -41.478 -6.344 3.552 1.00 86.23 O ANISOU 2467 O ASN B 82 10800 11156 10807 -355 240 421 ATOM 2468 CB ASN B 82 -43.994 -4.665 4.779 1.00 92.60 C ANISOU 2468 CB ASN B 82 11452 11951 11781 -280 389 457 ATOM 2469 CG ASN B 82 -45.388 -4.027 4.755 1.00 99.03 C ANISOU 2469 CG ASN B 82 12136 12824 12666 -219 396 471 ATOM 2470 OD1 ASN B 82 -46.089 -4.052 5.759 1.00101.86 O ANISOU 2470 OD1 ASN B 82 12464 13215 13023 -106 397 529 ATOM 2471 ND2 ASN B 82 -45.812 -3.407 3.660 1.00100.83 N ANISOU 2471 ND2 ASN B 82 12284 13072 12956 -283 409 420 ATOM 2472 H ASN B 82 -44.161 -6.730 3.106 1.00 97.87 H ATOM 2473 HA ASN B 82 -43.359 -3.866 2.865 1.00 96.21 H ATOM 2474 HB3 ASN B 82 -43.390 -4.029 5.430 1.00 92.60 H ATOM 2475 HB2 ASN B 82 -44.049 -5.627 5.289 1.00 92.60 H ATOM 2476 HD22 ASN B 82 -46.757 -3.056 3.665 1.00100.83 H ATOM 2477 HD21 ASN B 82 -45.292 -3.461 2.795 1.00100.83 H ATOM 2478 N VAL B 83 -40.986 -4.146 3.764 1.00 85.02 N ANISOU 2478 N VAL B 83 10700 10947 10656 -259 338 483 ATOM 2479 CA VAL B 83 -39.573 -4.350 4.048 1.00 85.92 C ANISOU 2479 CA VAL B 83 10909 11029 10706 -310 352 455 ATOM 2480 C VAL B 83 -39.411 -4.579 5.563 1.00 85.99 C ANISOU 2480 C VAL B 83 10940 11015 10717 -375 416 420 ATOM 2481 O VAL B 83 -39.816 -3.729 6.357 1.00 96.05 O ANISOU 2481 O VAL B 83 12206 12255 12035 -374 503 419 ATOM 2482 CB VAL B 83 -38.694 -3.144 3.607 1.00 89.42 C ANISOU 2482 CB VAL B 83 11416 11434 11126 -275 409 468 ATOM 2483 CG1 VAL B 83 -37.191 -3.368 3.883 1.00 96.29 C ANISOU 2483 CG1 VAL B 83 12353 12306 11928 -337 409 418 ATOM 2484 CG2 VAL B 83 -38.881 -2.805 2.114 1.00 90.11 C ANISOU 2484 CG2 VAL B 83 11495 11541 11202 -186 360 519 ATOM 2485 H VAL B 83 -41.339 -3.213 3.902 1.00 85.02 H ATOM 2486 HA VAL B 83 -39.222 -5.230 3.513 1.00 85.92 H ATOM 2487 HB VAL B 83 -39.003 -2.267 4.182 1.00 89.42 H ATOM 2488 HG11 VAL B 83 -36.591 -2.537 3.511 1.00 96.29 H ATOM 2489 HG12 VAL B 83 -36.980 -3.458 4.951 1.00 96.29 H ATOM 2490 HG13 VAL B 83 -36.840 -4.280 3.396 1.00 96.29 H ATOM 2491 HG21 VAL B 83 -38.262 -1.954 1.827 1.00 90.11 H ATOM 2492 HG22 VAL B 83 -38.603 -3.649 1.479 1.00 90.11 H ATOM 2493 HG23 VAL B 83 -39.913 -2.543 1.879 1.00 90.11 H ATOM 2494 N ASP B 84 -38.820 -5.721 5.908 1.00 85.20 N ANISOU 2494 N ASP B 84 10872 10933 10565 -418 381 398 ATOM 2495 CA ASP B 84 -38.458 -6.130 7.251 1.00 79.95 C ANISOU 2495 CA ASP B 84 10250 10267 9858 -457 435 374 ATOM 2496 C ASP B 84 -36.972 -5.806 7.423 1.00 81.10 C ANISOU 2496 C ASP B 84 10453 10449 9911 -463 430 346 ATOM 2497 O ASP B 84 -36.138 -6.341 6.683 1.00 80.83 O ANISOU 2497 O ASP B 84 10444 10445 9823 -455 366 351 ATOM 2498 CB ASP B 84 -38.726 -7.637 7.451 1.00 81.25 C ANISOU 2498 CB ASP B 84 10416 10430 10026 -477 416 379 ATOM 2499 CG ASP B 84 -38.479 -8.195 8.856 1.00 82.39 C ANISOU 2499 CG ASP B 84 10625 10584 10097 -485 463 376 ATOM 2500 OD1 ASP B 84 -38.234 -7.413 9.801 1.00 93.68 O ANISOU 2500 OD1 ASP B 84 12074 12036 11484 -484 509 358 ATOM 2501 OD2 ASP B 84 -38.660 -9.423 8.987 1.00 92.87 O1- ANISOU 2501 OD2 ASP B 84 11985 11901 11402 -485 459 391 ATOM 2502 H ASP B 84 -38.492 -6.351 5.175 1.00 85.20 H ATOM 2503 HA ASP B 84 -39.047 -5.565 7.976 1.00 79.95 H ATOM 2504 HB3 ASP B 84 -38.132 -8.211 6.739 1.00 81.25 H ATOM 2505 HB2 ASP B 84 -39.763 -7.841 7.181 1.00 81.25 H ATOM 2506 N TYR B 85 -36.664 -4.915 8.368 1.00 78.52 N ANISOU 2506 N TYR B 85 10140 10127 9567 -483 504 307 ATOM 2507 CA TYR B 85 -35.303 -4.463 8.627 1.00 78.87 C ANISOU 2507 CA TYR B 85 10214 10228 9526 -506 515 248 ATOM 2508 C TYR B 85 -34.599 -5.303 9.706 1.00 75.92 C ANISOU 2508 C TYR B 85 9858 9940 9047 -507 503 228 ATOM 2509 O TYR B 85 -33.439 -5.008 10.004 1.00 82.62 O ANISOU 2509 O TYR B 85 10710 10870 9811 -522 504 169 ATOM 2510 CB TYR B 85 -35.296 -2.953 8.941 1.00 76.46 C ANISOU 2510 CB TYR B 85 9908 9889 9253 -541 620 195 ATOM 2511 CG TYR B 85 -35.746 -2.083 7.779 1.00 81.46 C ANISOU 2511 CG TYR B 85 10542 10439 9971 -509 648 232 ATOM 2512 CD1 TYR B 85 -34.839 -1.734 6.756 1.00 79.64 C ANISOU 2512 CD1 TYR B 85 10333 10202 9723 -495 622 231 ATOM 2513 CD2 TYR B 85 -37.077 -1.622 7.716 1.00 85.02 C ANISOU 2513 CD2 TYR B 85 10968 10824 10510 -475 699 279 ATOM 2514 CE1 TYR B 85 -35.251 -0.885 5.711 1.00 83.64 C ANISOU 2514 CE1 TYR B 85 10851 10639 10290 -438 649 285 ATOM 2515 CE2 TYR B 85 -37.494 -0.790 6.660 1.00 84.33 C ANISOU 2515 CE2 TYR B 85 10881 10679 10483 -412 724 332 ATOM 2516 CZ TYR B 85 -36.573 -0.404 5.668 1.00 86.77 C ANISOU 2516 CZ TYR B 85 11223 10981 10763 -389 700 339 ATOM 2517 OH TYR B 85 -36.961 0.444 4.674 1.00 87.78 O ANISOU 2517 OH TYR B 85 11363 11058 10933 -304 732 404 ATOM 2518 H TYR B 85 -37.391 -4.551 8.986 1.00 78.52 H ATOM 2519 HA TYR B 85 -34.699 -4.593 7.728 1.00 78.87 H ATOM 2520 HB3 TYR B 85 -34.287 -2.632 9.209 1.00 76.46 H ATOM 2521 HB2 TYR B 85 -35.906 -2.737 9.817 1.00 76.46 H ATOM 2522 HD1 TYR B 85 -33.825 -2.103 6.778 1.00 79.64 H ATOM 2523 HD2 TYR B 85 -37.785 -1.906 8.478 1.00 85.02 H ATOM 2524 HE1 TYR B 85 -34.548 -0.595 4.948 1.00 83.64 H ATOM 2525 HE2 TYR B 85 -38.517 -0.443 6.627 1.00 84.33 H ATOM 2526 HH TYR B 85 -36.233 0.882 4.231 1.00 87.78 H ATOM 2527 N HIS B 86 -35.243 -6.354 10.242 1.00 77.33 N ANISOU 2527 N HIS B 86 10047 10108 9226 -486 506 271 ATOM 2528 CA HIS B 86 -34.560 -7.349 11.086 1.00 89.19 C ANISOU 2528 CA HIS B 86 11586 11689 10615 -450 500 282 ATOM 2529 C HIS B 86 -33.764 -8.374 10.264 1.00 89.23 C ANISOU 2529 C HIS B 86 11612 11721 10571 -411 425 314 ATOM 2530 O HIS B 86 -32.980 -9.121 10.840 1.00 91.73 O ANISOU 2530 O HIS B 86 11959 12115 10780 -360 420 330 ATOM 2531 CB HIS B 86 -35.536 -8.072 12.025 1.00 95.19 C ANISOU 2531 CB HIS B 86 12367 12398 11401 -435 560 326 ATOM 2532 CG HIS B 86 -36.375 -7.153 12.867 1.00107.93 C ANISOU 2532 CG HIS B 86 13967 14001 13042 -467 640 292 ATOM 2533 ND1 HIS B 86 -37.654 -6.808 12.492 1.00103.56 N ANISOU 2533 ND1 HIS B 86 13385 13349 12616 -495 688 307 ATOM 2534 CD2 HIS B 86 -36.142 -6.504 14.056 1.00113.22 C ANISOU 2534 CD2 HIS B 86 14637 14751 13630 -480 683 232 ATOM 2535 CE1 HIS B 86 -38.139 -6.010 13.439 1.00114.93 C ANISOU 2535 CE1 HIS B 86 14820 14791 14056 -519 764 269 ATOM 2536 NE2 HIS B 86 -37.272 -5.764 14.416 1.00119.20 N ANISOU 2536 NE2 HIS B 86 15381 15440 14469 -518 763 216 ATOM 2537 H HIS B 86 -36.213 -6.555 9.993 1.00 77.33 H ATOM 2538 HA HIS B 86 -33.841 -6.831 11.720 1.00 89.19 H ATOM 2539 HB3 HIS B 86 -34.977 -8.723 12.699 1.00 95.19 H ATOM 2540 HB2 HIS B 86 -36.194 -8.731 11.455 1.00 95.19 H ATOM 2541 HD1 HIS B 86 -38.098 -7.085 11.603 1.00103.56 H ATOM 2542 HD2 HIS B 86 -35.257 -6.502 14.671 1.00113.22 H ATOM 2543 HE1 HIS B 86 -39.134 -5.588 13.404 1.00114.93 H ATOM 2544 N MET B 87 -33.958 -8.370 8.943 1.00 87.88 N ANISOU 2544 N MET B 87 11430 11491 10470 -423 375 331 ATOM 2545 CA MET B 87 -33.166 -9.101 7.965 1.00 81.09 C ANISOU 2545 CA MET B 87 10594 10649 9568 -395 309 352 ATOM 2546 C MET B 87 -32.338 -8.084 7.159 1.00 77.33 C ANISOU 2546 C MET B 87 10097 10189 9097 -416 274 311 ATOM 2547 O MET B 87 -32.605 -6.881 7.246 1.00 76.07 O ANISOU 2547 O MET B 87 9912 9999 8992 -448 311 281 ATOM 2548 CB MET B 87 -34.112 -9.937 7.084 1.00 81.04 C ANISOU 2548 CB MET B 87 10597 10561 9632 -399 291 395 ATOM 2549 CG MET B 87 -34.905 -10.999 7.868 1.00 78.48 C ANISOU 2549 CG MET B 87 10300 10190 9327 -394 361 426 ATOM 2550 SD MET B 87 -33.882 -12.253 8.696 1.00 80.75 S ANISOU 2550 SD MET B 87 10670 10524 9487 -315 398 473 ATOM 2551 CE MET B 87 -33.452 -13.280 7.269 1.00 76.74 C ANISOU 2551 CE MET B 87 10200 9965 8992 -309 363 497 ATOM 2552 H MET B 87 -34.582 -7.673 8.567 1.00 87.88 H ATOM 2553 HA MET B 87 -32.474 -9.779 8.460 1.00 81.09 H ATOM 2554 HB3 MET B 87 -33.523 -10.434 6.317 1.00 81.04 H ATOM 2555 HB2 MET B 87 -34.810 -9.287 6.554 1.00 81.04 H ATOM 2556 HG3 MET B 87 -35.599 -11.508 7.199 1.00 78.48 H ATOM 2557 HG2 MET B 87 -35.530 -10.514 8.621 1.00 78.48 H ATOM 2558 HE1 MET B 87 -32.930 -14.177 7.594 1.00 76.74 H ATOM 2559 HE2 MET B 87 -34.359 -13.580 6.745 1.00 76.74 H ATOM 2560 HE3 MET B 87 -32.809 -12.739 6.574 1.00 76.74 H ATOM 2561 N ASN B 88 -31.333 -8.555 6.411 1.00 74.01 N ANISOU 2561 N ASN B 88 9692 9809 8619 -395 225 311 ATOM 2562 CA ASN B 88 -30.456 -7.707 5.596 1.00 76.19 C ANISOU 2562 CA ASN B 88 9958 10091 8899 -415 207 271 ATOM 2563 C ASN B 88 -30.400 -8.259 4.170 1.00 74.84 C ANISOU 2563 C ASN B 88 9812 9872 8754 -397 148 312 ATOM 2564 O ASN B 88 -30.043 -9.423 3.995 1.00 71.69 O ANISOU 2564 O ASN B 88 9439 9484 8315 -368 116 345 ATOM 2565 CB ASN B 88 -29.021 -7.686 6.176 1.00 79.11 C ANISOU 2565 CB ASN B 88 10311 10576 9171 -416 209 208 ATOM 2566 CG ASN B 88 -28.809 -6.901 7.468 1.00 85.01 C ANISOU 2566 CG ASN B 88 11023 11397 9879 -447 268 138 ATOM 2567 OD1 ASN B 88 -28.010 -7.322 8.300 1.00104.75 O ANISOU 2567 OD1 ASN B 88 13501 14029 12270 -421 258 106 ATOM 2568 ND2 ASN B 88 -29.457 -5.759 7.666 1.00 76.23 N ANISOU 2568 ND2 ASN B 88 9905 10212 8846 -494 331 115 ATOM 2569 H ASN B 88 -31.144 -9.557 6.381 1.00 74.01 H ATOM 2570 HA ASN B 88 -30.832 -6.687 5.583 1.00 76.19 H ATOM 2571 HB3 ASN B 88 -28.329 -7.257 5.453 1.00 79.11 H ATOM 2572 HB2 ASN B 88 -28.684 -8.706 6.340 1.00 79.11 H ATOM 2573 HD22 ASN B 88 -29.333 -5.252 8.526 1.00 76.23 H ATOM 2574 HD21 ASN B 88 -30.122 -5.370 7.009 1.00 76.23 H ATOM 2575 N SER B 89 -30.665 -7.403 3.177 1.00 69.86 N ANISOU 2575 N SER B 89 9178 9188 8178 -408 147 309 ATOM 2576 CA SER B 89 -30.302 -7.648 1.783 1.00 69.17 C ANISOU 2576 CA SER B 89 9116 9076 8090 -389 96 331 ATOM 2577 C SER B 89 -28.814 -7.304 1.605 1.00 75.30 C ANISOU 2577 C SER B 89 9904 9901 8808 -398 107 284 ATOM 2578 O SER B 89 -28.447 -6.144 1.827 1.00 71.95 O ANISOU 2578 O SER B 89 9462 9488 8387 -430 172 227 ATOM 2579 CB SER B 89 -31.112 -6.720 0.859 1.00 70.06 C ANISOU 2579 CB SER B 89 9227 9131 8262 -373 103 353 ATOM 2580 OG SER B 89 -32.450 -7.135 0.677 1.00 73.59 O ANISOU 2580 OG SER B 89 9643 9562 8756 -361 77 387 ATOM 2581 H SER B 89 -30.932 -6.449 3.400 1.00 69.86 H ATOM 2582 HA SER B 89 -30.483 -8.689 1.512 1.00 69.17 H ATOM 2583 HB3 SER B 89 -30.644 -6.660 -0.125 1.00 70.06 H ATOM 2584 HB2 SER B 89 -31.107 -5.715 1.269 1.00 70.06 H ATOM 2585 HG SER B 89 -32.965 -6.766 1.423 1.00 73.59 H ATOM 2586 N VAL B 90 -27.988 -8.277 1.215 1.00 70.73 N ANISOU 2586 N VAL B 90 9347 9346 8180 -376 60 298 ATOM 2587 CA VAL B 90 -26.555 -8.078 0.986 1.00 73.26 C ANISOU 2587 CA VAL B 90 9666 9722 8448 -381 68 249 ATOM 2588 C VAL B 90 -26.160 -8.543 -0.439 1.00 69.26 C ANISOU 2588 C VAL B 90 9203 9169 7944 -360 26 284 ATOM 2589 O VAL B 90 -26.709 -9.552 -0.900 1.00 70.57 O ANISOU 2589 O VAL B 90 9396 9298 8119 -339 -19 336 ATOM 2590 CB VAL B 90 -25.723 -8.869 2.032 1.00 75.27 C ANISOU 2590 CB VAL B 90 9892 10093 8613 -356 59 229 ATOM 2591 CG1 VAL B 90 -25.859 -8.250 3.435 1.00 72.63 C ANISOU 2591 CG1 VAL B 90 9511 9831 8255 -379 101 178 ATOM 2592 CG2 VAL B 90 -26.004 -10.385 2.073 1.00 70.67 C ANISOU 2592 CG2 VAL B 90 9347 9499 8004 -301 24 306 ATOM 2593 H VAL B 90 -28.349 -9.217 1.055 1.00 70.73 H ATOM 2594 HA VAL B 90 -26.324 -7.022 1.105 1.00 73.26 H ATOM 2595 HB VAL B 90 -24.679 -8.746 1.743 1.00 75.27 H ATOM 2596 HG11 VAL B 90 -25.207 -8.742 4.155 1.00 72.63 H ATOM 2597 HG12 VAL B 90 -25.595 -7.192 3.431 1.00 72.63 H ATOM 2598 HG13 VAL B 90 -26.882 -8.332 3.806 1.00 72.63 H ATOM 2599 HG21 VAL B 90 -25.447 -10.875 2.868 1.00 70.67 H ATOM 2600 HG22 VAL B 90 -27.059 -10.592 2.253 1.00 70.67 H ATOM 2601 HG23 VAL B 90 -25.712 -10.880 1.149 1.00 70.67 H ATOM 2602 N PRO B 91 -25.276 -7.780 -1.127 1.00 74.51 N ANISOU 2602 N PRO B 91 9878 9829 8603 -374 51 245 ATOM 2603 CA PRO B 91 -24.783 -8.151 -2.465 1.00 70.74 C ANISOU 2603 CA PRO B 91 9449 9308 8120 -352 20 275 ATOM 2604 C PRO B 91 -23.820 -9.350 -2.421 1.00 72.81 C ANISOU 2604 C PRO B 91 9713 9632 8320 -327 -15 279 ATOM 2605 O PRO B 91 -22.887 -9.354 -1.613 1.00 85.07 O ANISOU 2605 O PRO B 91 11220 11277 9825 -326 1 236 ATOM 2606 CB PRO B 91 -24.079 -6.871 -2.947 1.00 66.96 C ANISOU 2606 CB PRO B 91 8983 8798 7662 -378 94 224 ATOM 2607 CG PRO B 91 -23.620 -6.159 -1.688 1.00 64.21 C ANISOU 2607 CG PRO B 91 8575 8514 7309 -430 159 137 ATOM 2608 CD PRO B 91 -24.718 -6.491 -0.692 1.00 70.34 C ANISOU 2608 CD PRO B 91 9315 9339 8073 -421 126 157 ATOM 2609 HA PRO B 91 -25.613 -8.385 -3.134 1.00 70.74 H ATOM 2610 HB3 PRO B 91 -24.796 -6.255 -3.490 1.00 66.96 H ATOM 2611 HB2 PRO B 91 -23.235 -7.063 -3.612 1.00 66.96 H ATOM 2612 HG3 PRO B 91 -23.454 -5.088 -1.819 1.00 64.21 H ATOM 2613 HG2 PRO B 91 -22.678 -6.598 -1.360 1.00 64.21 H ATOM 2614 HD2 PRO B 91 -24.312 -6.511 0.318 1.00 70.34 H ATOM 2615 HD3 PRO B 91 -25.505 -5.734 -0.740 1.00 70.34 H ATOM 2616 N ILE B 92 -24.059 -10.339 -3.288 1.00 70.07 N ANISOU 2616 N ILE B 92 9414 9243 7968 -302 -57 329 ATOM 2617 CA ILE B 92 -23.148 -11.448 -3.547 1.00 79.09 C ANISOU 2617 CA ILE B 92 10578 10416 9058 -267 -71 344 ATOM 2618 C ILE B 92 -22.089 -10.957 -4.546 1.00 76.96 C ANISOU 2618 C ILE B 92 10322 10142 8779 -274 -55 310 ATOM 2619 O ILE B 92 -22.397 -10.706 -5.715 1.00 79.31 O ANISOU 2619 O ILE B 92 10668 10363 9104 -283 -60 324 ATOM 2620 CB ILE B 92 -23.877 -12.690 -4.128 1.00 86.42 C ANISOU 2620 CB ILE B 92 11560 11279 9995 -255 -97 396 ATOM 2621 CG1 ILE B 92 -24.940 -13.192 -3.129 1.00104.25 C ANISOU 2621 CG1 ILE B 92 13806 13529 12275 -260 -89 419 ATOM 2622 CG2 ILE B 92 -22.921 -13.847 -4.512 1.00 91.21 C ANISOU 2622 CG2 ILE B 92 12205 11897 10555 -214 -88 418 ATOM 2623 CD1 ILE B 92 -26.015 -14.056 -3.787 1.00107.66 C ANISOU 2623 CD1 ILE B 92 14269 13888 12747 -290 -107 432 ATOM 2624 H ILE B 92 -24.817 -10.247 -3.965 1.00 70.07 H ATOM 2625 HA ILE B 92 -22.662 -11.743 -2.613 1.00 79.09 H ATOM 2626 HB ILE B 92 -24.394 -12.369 -5.035 1.00 86.42 H ATOM 2627 HG13 ILE B 92 -25.448 -12.351 -2.654 1.00104.25 H ATOM 2628 HG12 ILE B 92 -24.450 -13.728 -2.318 1.00104.25 H ATOM 2629 HG21 ILE B 92 -23.454 -14.715 -4.898 1.00 91.21 H ATOM 2630 HG22 ILE B 92 -22.209 -13.561 -5.285 1.00 91.21 H ATOM 2631 HG23 ILE B 92 -22.342 -14.182 -3.652 1.00 91.21 H ATOM 2632 HD11 ILE B 92 -26.227 -14.950 -3.202 1.00107.66 H ATOM 2633 HD12 ILE B 92 -26.937 -13.482 -3.882 1.00107.66 H ATOM 2634 HD13 ILE B 92 -25.721 -14.366 -4.790 1.00107.66 H ATOM 2635 N GLN B 93 -20.883 -10.780 -4.005 1.00 80.89 N ANISOU 2635 N GLN B 93 10771 10729 9233 -266 -33 264 ATOM 2636 CA GLN B 93 -19.709 -10.226 -4.655 1.00 82.23 C ANISOU 2636 CA GLN B 93 10937 10907 9400 -285 0 211 ATOM 2637 C GLN B 93 -18.907 -11.391 -5.254 1.00 90.49 C ANISOU 2637 C GLN B 93 12014 11963 10404 -232 -23 250 ATOM 2638 O GLN B 93 -18.536 -12.296 -4.506 1.00102.52 O ANISOU 2638 O GLN B 93 13514 13562 11877 -177 -38 278 ATOM 2639 CB GLN B 93 -18.876 -9.506 -3.568 1.00 92.43 C ANISOU 2639 CB GLN B 93 12135 12316 10671 -320 43 111 ATOM 2640 CG GLN B 93 -19.607 -8.368 -2.816 1.00 97.86 C ANISOU 2640 CG GLN B 93 12788 13002 11392 -372 80 66 ATOM 2641 CD GLN B 93 -19.214 -6.994 -3.342 1.00103.93 C ANISOU 2641 CD GLN B 93 13554 13722 12211 -446 173 -20 ATOM 2642 OE1 GLN B 93 -19.579 -6.623 -4.449 1.00116.51 O ANISOU 2642 OE1 GLN B 93 15226 15183 13859 -451 210 17 ATOM 2643 NE2 GLN B 93 -18.460 -6.224 -2.566 1.00111.23 N ANISOU 2643 NE2 GLN B 93 14387 14763 13111 -499 222 -141 ATOM 2644 H GLN B 93 -20.737 -11.047 -3.047 1.00 80.89 H ATOM 2645 HA GLN B 93 -19.991 -9.513 -5.431 1.00 82.23 H ATOM 2646 HB3 GLN B 93 -17.961 -9.127 -4.019 1.00 92.43 H ATOM 2647 HB2 GLN B 93 -18.539 -10.236 -2.829 1.00 92.43 H ATOM 2648 HG3 GLN B 93 -19.389 -8.418 -1.748 1.00 97.86 H ATOM 2649 HG2 GLN B 93 -20.690 -8.456 -2.901 1.00 97.86 H ATOM 2650 HE22 GLN B 93 -18.167 -5.327 -2.924 1.00111.23 H ATOM 2651 HE21 GLN B 93 -18.188 -6.524 -1.643 1.00111.23 H ATOM 2652 N GLN B 94 -18.657 -11.354 -6.562 1.00 97.77 N ANISOU 2652 N GLN B 94 12998 12806 11343 -240 -13 259 ATOM 2653 CA GLN B 94 -17.895 -12.342 -7.322 1.00 90.22 C ANISOU 2653 CA GLN B 94 12085 11838 10356 -196 -21 293 ATOM 2654 C GLN B 94 -16.565 -11.715 -7.767 1.00 84.96 C ANISOU 2654 C GLN B 94 11395 11196 9689 -215 26 230 ATOM 2655 O GLN B 94 -16.590 -10.669 -8.414 1.00 91.46 O ANISOU 2655 O GLN B 94 12241 11957 10554 -264 67 193 ATOM 2656 CB GLN B 94 -18.779 -12.783 -8.521 1.00 99.27 C ANISOU 2656 CB GLN B 94 13325 12872 11520 -198 -49 351 ATOM 2657 CG GLN B 94 -18.129 -13.519 -9.719 1.00105.10 C ANISOU 2657 CG GLN B 94 14137 13553 12244 -184 -39 367 ATOM 2658 CD GLN B 94 -18.071 -15.039 -9.616 1.00119.50 C ANISOU 2658 CD GLN B 94 16001 15363 14040 -143 -36 414 ATOM 2659 OE1 GLN B 94 -18.725 -15.743 -10.379 1.00137.91 O ANISOU 2659 OE1 GLN B 94 18406 17618 16377 -159 -45 435 ATOM 2660 NE2 GLN B 94 -17.263 -15.579 -8.712 1.00118.09 N ANISOU 2660 NE2 GLN B 94 15777 15265 13827 -84 -13 427 ATOM 2661 H GLN B 94 -18.996 -10.553 -7.103 1.00 97.77 H ATOM 2662 HA GLN B 94 -17.682 -13.215 -6.704 1.00 90.22 H ATOM 2663 HB3 GLN B 94 -19.204 -11.873 -8.939 1.00 99.27 H ATOM 2664 HB2 GLN B 94 -19.628 -13.352 -8.147 1.00 99.27 H ATOM 2665 HG3 GLN B 94 -17.140 -13.136 -9.938 1.00105.10 H ATOM 2666 HG2 GLN B 94 -18.717 -13.290 -10.610 1.00105.10 H ATOM 2667 HE22 GLN B 94 -17.208 -16.584 -8.656 1.00118.09 H ATOM 2668 HE21 GLN B 94 -16.610 -14.998 -8.213 1.00118.09 H ATOM 2669 N GLU B 95 -15.438 -12.387 -7.476 1.00 99.04 N ANISOU 2669 N GLU B 95 13132 13071 11427 -169 32 219 ATOM 2670 CA GLU B 95 -14.172 -12.159 -8.177 1.00 97.39 C ANISOU 2670 CA GLU B 95 12901 12881 11219 -184 79 160 ATOM 2671 C GLU B 95 -14.315 -12.528 -9.661 1.00 99.04 C ANISOU 2671 C GLU B 95 13232 12950 11448 -179 87 213 ATOM 2672 O GLU B 95 -14.655 -13.673 -9.962 1.00101.55 O ANISOU 2672 O GLU B 95 13619 13217 11749 -138 54 290 ATOM 2673 CB GLU B 95 -13.024 -12.967 -7.534 1.00111.30 C ANISOU 2673 CB GLU B 95 14568 14800 12919 -118 77 139 ATOM 2674 CG GLU B 95 -12.239 -12.182 -6.462 1.00134.28 C ANISOU 2674 CG GLU B 95 17339 17862 15820 -168 110 8 ATOM 2675 CD GLU B 95 -10.941 -12.859 -6.017 1.00150.13 C ANISOU 2675 CD GLU B 95 19223 20076 17744 -84 93 -18 ATOM 2676 OE1 GLU B 95 -10.594 -13.964 -6.492 1.00136.26 O ANISOU 2676 OE1 GLU B 95 17508 18316 15948 21 78 76 ATOM 2677 OE2 GLU B 95 -10.159 -12.206 -5.297 1.00142.99 O1- ANISOU 2677 OE2 GLU B 95 18177 19342 16812 -123 104 -140 ATOM 2678 H GLU B 95 -15.464 -13.185 -6.866 1.00 99.04 H ATOM 2679 HA GLU B 95 -13.942 -11.097 -8.103 1.00 97.39 H ATOM 2680 HB3 GLU B 95 -12.335 -13.315 -8.307 1.00111.30 H ATOM 2681 HB2 GLU B 95 -13.413 -13.876 -7.072 1.00111.30 H ATOM 2682 HG3 GLU B 95 -12.865 -11.997 -5.584 1.00134.28 H ATOM 2683 HG2 GLU B 95 -11.962 -11.205 -6.870 1.00134.28 H ATOM 2684 N ILE B 96 -14.070 -11.554 -10.535 1.00 94.77 N ANISOU 2684 N ILE B 96 12722 12343 10942 -227 143 168 ATOM 2685 CA ILE B 96 -14.230 -11.634 -11.977 1.00 91.66 C ANISOU 2685 CA ILE B 96 12451 11818 10556 -223 154 214 ATOM 2686 C ILE B 96 -12.955 -11.065 -12.616 1.00 89.23 C ANISOU 2686 C ILE B 96 12143 11493 10265 -247 240 153 ATOM 2687 O ILE B 96 -12.359 -10.121 -12.092 1.00 99.14 O ANISOU 2687 O ILE B 96 13316 12804 11548 -296 302 63 ATOM 2688 CB ILE B 96 -15.518 -10.855 -12.417 1.00 93.31 C ANISOU 2688 CB ILE B 96 12719 11947 10786 -241 139 245 ATOM 2689 CG1 ILE B 96 -16.731 -11.813 -12.564 1.00 97.61 C ANISOU 2689 CG1 ILE B 96 13319 12462 11307 -213 60 316 ATOM 2690 CG2 ILE B 96 -15.406 -9.884 -13.612 1.00102.31 C ANISOU 2690 CG2 ILE B 96 13935 12992 11948 -256 213 235 ATOM 2691 CD1 ILE B 96 -17.134 -12.216 -13.995 1.00104.36 C ANISOU 2691 CD1 ILE B 96 14277 13233 12141 -202 52 350 ATOM 2692 H ILE B 96 -13.775 -10.639 -10.192 1.00 94.77 H ATOM 2693 HA ILE B 96 -14.303 -12.680 -12.283 1.00 91.66 H ATOM 2694 HB ILE B 96 -15.780 -10.208 -11.574 1.00 93.31 H ATOM 2695 HG13 ILE B 96 -17.601 -11.347 -12.099 1.00 97.61 H ATOM 2696 HG12 ILE B 96 -16.553 -12.722 -11.993 1.00 97.61 H ATOM 2697 HG21 ILE B 96 -16.366 -9.408 -13.817 1.00102.31 H ATOM 2698 HG22 ILE B 96 -14.692 -9.084 -13.436 1.00102.31 H ATOM 2699 HG23 ILE B 96 -15.091 -10.417 -14.507 1.00102.31 H ATOM 2700 HD11 ILE B 96 -17.980 -12.902 -13.962 1.00104.36 H ATOM 2701 HD12 ILE B 96 -17.480 -11.362 -14.574 1.00104.36 H ATOM 2702 HD13 ILE B 96 -16.325 -12.702 -14.540 1.00104.36 H ATOM 2703 N LEU B 97 -12.548 -11.661 -13.734 1.00 89.76 N ANISOU 2703 N LEU B 97 12298 11486 10319 -224 256 188 ATOM 2704 CA LEU B 97 -11.405 -11.215 -14.513 1.00 90.94 C ANISOU 2704 CA LEU B 97 12461 11599 10493 -251 354 130 ATOM 2705 C LEU B 97 -11.908 -10.327 -15.660 1.00 84.41 C ANISOU 2705 C LEU B 97 11759 10633 9678 -261 407 157 ATOM 2706 O LEU B 97 -13.001 -10.550 -16.190 1.00 93.76 O ANISOU 2706 O LEU B 97 13027 11765 10831 -228 344 231 ATOM 2707 CB LEU B 97 -10.642 -12.447 -15.047 1.00 99.44 C ANISOU 2707 CB LEU B 97 13551 12688 11543 -208 356 149 ATOM 2708 CG LEU B 97 -10.063 -13.406 -13.978 1.00 99.71 C ANISOU 2708 CG LEU B 97 13483 12857 11544 -155 306 160 ATOM 2709 CD1 LEU B 97 -9.572 -14.712 -14.622 1.00 99.62 C ANISOU 2709 CD1 LEU B 97 13544 12803 11503 -92 303 227 ATOM 2710 CD2 LEU B 97 -8.943 -12.769 -13.144 1.00 89.06 C ANISOU 2710 CD2 LEU B 97 11976 11660 10204 -174 346 55 ATOM 2711 H LEU B 97 -13.109 -12.415 -14.127 1.00 89.76 H ATOM 2712 HA LEU B 97 -10.737 -10.617 -13.897 1.00 90.94 H ATOM 2713 HB3 LEU B 97 -9.846 -12.116 -15.716 1.00 99.44 H ATOM 2714 HB2 LEU B 97 -11.335 -13.014 -15.664 1.00 99.44 H ATOM 2715 HG LEU B 97 -10.865 -13.674 -13.287 1.00 99.71 H ATOM 2716 HD11 LEU B 97 -8.794 -15.197 -14.029 1.00 99.62 H ATOM 2717 HD12 LEU B 97 -10.391 -15.425 -14.719 1.00 99.62 H ATOM 2718 HD13 LEU B 97 -9.160 -14.537 -15.614 1.00 99.62 H ATOM 2719 HD21 LEU B 97 -8.641 -13.438 -12.337 1.00 89.06 H ATOM 2720 HD22 LEU B 97 -8.068 -12.553 -13.757 1.00 89.06 H ATOM 2721 HD23 LEU B 97 -9.264 -11.838 -12.683 1.00 89.06 H ATOM 2722 N VAL B 98 -11.094 -9.353 -16.056 1.00 85.47 N ANISOU 2722 N VAL B 98 11899 10720 9855 -304 529 90 ATOM 2723 CA VAL B 98 -11.313 -8.512 -17.229 1.00 89.07 C ANISOU 2723 CA VAL B 98 12491 11033 10316 -293 623 120 ATOM 2724 C VAL B 98 -9.956 -8.327 -17.923 1.00 91.16 C ANISOU 2724 C VAL B 98 12779 11252 10607 -319 743 62 ATOM 2725 O VAL B 98 -8.916 -8.477 -17.276 1.00 90.07 O ANISOU 2725 O VAL B 98 12521 11206 10495 -361 765 -26 ATOM 2726 CB VAL B 98 -11.903 -7.120 -16.847 1.00 86.70 C ANISOU 2726 CB VAL B 98 12199 10684 10059 -319 706 98 ATOM 2727 CG1 VAL B 98 -13.290 -7.251 -16.195 1.00 86.32 C ANISOU 2727 CG1 VAL B 98 12123 10685 9989 -291 590 155 ATOM 2728 CG2 VAL B 98 -10.988 -6.228 -15.984 1.00 85.16 C ANISOU 2728 CG2 VAL B 98 11897 10527 9932 -413 826 -38 ATOM 2729 H VAL B 98 -10.194 -9.222 -15.601 1.00 85.47 H ATOM 2730 HA VAL B 98 -11.983 -9.010 -17.932 1.00 89.07 H ATOM 2731 HB VAL B 98 -12.063 -6.581 -17.781 1.00 86.70 H ATOM 2732 HG11 VAL B 98 -13.707 -6.275 -15.949 1.00 86.32 H ATOM 2733 HG12 VAL B 98 -13.987 -7.759 -16.860 1.00 86.32 H ATOM 2734 HG13 VAL B 98 -13.243 -7.818 -15.263 1.00 86.32 H ATOM 2735 HG21 VAL B 98 -11.490 -5.323 -15.642 1.00 85.16 H ATOM 2736 HG22 VAL B 98 -10.651 -6.754 -15.089 1.00 85.16 H ATOM 2737 HG23 VAL B 98 -10.111 -5.892 -16.541 1.00 85.16 H ATOM 2738 N LEU B 99 -9.974 -8.018 -19.224 1.00 92.24 N ANISOU 2738 N LEU B 99 13060 11258 10730 -288 824 107 ATOM 2739 CA LEU B 99 -8.782 -7.666 -19.988 1.00 96.74 C ANISOU 2739 CA LEU B 99 13675 11751 11332 -315 971 54 ATOM 2740 C LEU B 99 -8.674 -6.138 -20.000 1.00 94.49 C ANISOU 2740 C LEU B 99 13423 11368 11112 -362 1152 -3 ATOM 2741 O LEU B 99 -9.620 -5.490 -20.453 1.00 95.83 O ANISOU 2741 O LEU B 99 13697 11453 11259 -309 1179 73 ATOM 2742 CB LEU B 99 -8.887 -8.194 -21.439 1.00 95.11 C ANISOU 2742 CB LEU B 99 13623 11456 11059 -244 958 145 ATOM 2743 CG LEU B 99 -9.212 -9.689 -21.600 1.00 99.43 C ANISOU 2743 CG LEU B 99 14161 12075 11544 -204 799 201 ATOM 2744 CD1 LEU B 99 -9.371 -10.073 -23.080 1.00103.27 C ANISOU 2744 CD1 LEU B 99 14802 12478 11958 -148 800 270 ATOM 2745 CD2 LEU B 99 -8.164 -10.576 -20.920 1.00 98.11 C ANISOU 2745 CD2 LEU B 99 13864 12006 11409 -237 782 138 ATOM 2746 H LEU B 99 -10.862 -7.850 -19.685 1.00 92.24 H ATOM 2747 HA LEU B 99 -7.887 -8.091 -19.529 1.00 96.74 H ATOM 2748 HB3 LEU B 99 -7.950 -7.994 -21.951 1.00 95.11 H ATOM 2749 HB2 LEU B 99 -9.626 -7.609 -21.977 1.00 95.11 H ATOM 2750 HG LEU B 99 -10.169 -9.860 -21.112 1.00 99.43 H ATOM 2751 HD11 LEU B 99 -9.621 -11.129 -23.186 1.00103.27 H ATOM 2752 HD12 LEU B 99 -10.169 -9.504 -23.556 1.00103.27 H ATOM 2753 HD13 LEU B 99 -8.452 -9.891 -23.640 1.00103.27 H ATOM 2754 HD21 LEU B 99 -8.385 -11.636 -21.057 1.00 98.11 H ATOM 2755 HD22 LEU B 99 -7.168 -10.381 -21.318 1.00 98.11 H ATOM 2756 HD23 LEU B 99 -8.146 -10.381 -19.850 1.00 98.11 H ATOM 2757 N ARG B 100 -7.540 -5.615 -19.535 1.00 94.57 N ANISOU 2757 N ARG B 100 13340 11396 11195 -456 1281 -138 ATOM 2758 CA ARG B 100 -7.126 -4.213 -19.613 1.00104.34 C ANISOU 2758 CA ARG B 100 14612 12519 12515 -530 1510 -228 ATOM 2759 C ARG B 100 -6.150 -4.093 -20.785 1.00112.12 C ANISOU 2759 C ARG B 100 15690 13390 13522 -539 1665 -252 ATOM 2760 O ARG B 100 -5.275 -4.949 -20.877 1.00109.35 O ANISOU 2760 O ARG B 100 15240 13128 13180 -573 1634 -319 ATOM 2761 CB ARG B 100 -6.381 -3.895 -18.298 1.00111.41 C ANISOU 2761 CB ARG B 100 15306 13553 13472 -649 1531 -394 ATOM 2762 CG ARG B 100 -5.643 -2.534 -18.193 1.00127.72 C ANISOU 2762 CG ARG B 100 17354 15536 15640 -775 1784 -552 ATOM 2763 CD ARG B 100 -6.541 -1.293 -18.333 1.00119.91 C ANISOU 2763 CD ARG B 100 16447 14422 14690 -791 1913 -542 ATOM 2764 NE ARG B 100 -7.583 -1.296 -17.294 1.00108.01 N ANISOU 2764 NE ARG B 100 14877 13018 13144 -758 1747 -490 ATOM 2765 CZ ARG B 100 -8.813 -0.774 -17.322 1.00102.40 C ANISOU 2765 CZ ARG B 100 14274 12209 12424 -693 1766 -386 ATOM 2766 NH1 ARG B 100 -9.202 0.048 -18.301 1.00 98.21 N ANISOU 2766 NH1 ARG B 100 13927 11477 11912 -638 1947 -313 ATOM 2767 NH2 ARG B 100 -9.665 -1.119 -16.365 1.00110.04 N1+ ANISOU 2767 NH2 ARG B 100 15170 13285 13357 -667 1602 -344 ATOM 2768 H ARG B 100 -6.807 -6.244 -19.204 1.00 94.57 H ATOM 2769 HA ARG B 100 -7.981 -3.547 -19.747 1.00104.34 H ATOM 2770 HB3 ARG B 100 -5.637 -4.673 -18.117 1.00111.41 H ATOM 2771 HB2 ARG B 100 -7.096 -3.995 -17.487 1.00111.41 H ATOM 2772 HG3 ARG B 100 -4.867 -2.480 -18.955 1.00127.72 H ATOM 2773 HG2 ARG B 100 -5.084 -2.483 -17.256 1.00127.72 H ATOM 2774 HD3 ARG B 100 -6.975 -1.261 -19.334 1.00119.91 H ATOM 2775 HD2 ARG B 100 -5.936 -0.392 -18.223 1.00119.91 H ATOM 2776 HH22 ARG B 100 -10.621 -0.757 -16.400 1.00110.04 H ATOM 2777 HH21 ARG B 100 -9.402 -1.834 -15.669 1.00110.04 H ATOM 2778 HH12 ARG B 100 -10.171 0.411 -18.349 1.00 98.21 H ATOM 2779 HH11 ARG B 100 -8.569 0.354 -19.017 1.00 98.21 H ATOM 2780 HE ARG B 100 -7.282 -1.802 -16.435 1.00108.01 H ATOM 2781 N ARG B 101 -6.260 -3.062 -21.637 1.00108.54 N ANISOU 2781 N ARG B 101 15421 12747 13073 -495 1832 -191 ATOM 2782 CA ARG B 101 -5.228 -2.791 -22.651 1.00108.20 C ANISOU 2782 CA ARG B 101 15479 12565 13066 -516 2035 -228 ATOM 2783 C ARG B 101 -3.881 -2.420 -22.012 1.00108.11 C ANISOU 2783 C ARG B 101 15308 12601 13168 -675 2183 -437 ATOM 2784 O ARG B 101 -3.843 -1.547 -21.144 1.00117.45 O ANISOU 2784 O ARG B 101 16400 13808 14417 -769 2266 -548 ATOM 2785 CB ARG B 101 -5.666 -1.701 -23.644 1.00109.80 C ANISOU 2785 CB ARG B 101 15895 12555 13269 -450 2242 -147 ATOM 2786 CG ARG B 101 -6.633 -2.266 -24.695 1.00119.94 C ANISOU 2786 CG ARG B 101 17353 13796 14422 -277 2131 50 ATOM 2787 CD ARG B 101 -6.555 -1.550 -26.048 1.00119.49 C ANISOU 2787 CD ARG B 101 17513 13544 14345 -203 2351 116 ATOM 2788 NE ARG B 101 -7.631 -0.567 -26.235 1.00129.20 N ANISOU 2788 NE ARG B 101 18891 14675 15526 -79 2431 241 ATOM 2789 CZ ARG B 101 -8.770 -0.707 -26.923 1.00135.61 C ANISOU 2789 CZ ARG B 101 19817 15512 16197 88 2302 407 ATOM 2790 NH1 ARG B 101 -9.046 -1.832 -27.594 1.00131.31 N ANISOU 2790 NH1 ARG B 101 19266 15073 15554 134 2099 456 ATOM 2791 NH2 ARG B 101 -9.642 0.292 -26.932 1.00151.01 N1+ ANISOU 2791 NH2 ARG B 101 21887 17388 18104 214 2390 519 ATOM 2792 H ARG B 101 -7.014 -2.391 -21.536 1.00108.54 H ATOM 2793 HA ARG B 101 -5.058 -3.711 -23.213 1.00108.20 H ATOM 2794 HB3 ARG B 101 -4.765 -1.357 -24.160 1.00109.80 H ATOM 2795 HB2 ARG B 101 -6.065 -0.823 -23.133 1.00109.80 H ATOM 2796 HG3 ARG B 101 -7.645 -2.239 -24.282 1.00119.94 H ATOM 2797 HG2 ARG B 101 -6.414 -3.316 -24.878 1.00119.94 H ATOM 2798 HD3 ARG B 101 -6.475 -2.281 -26.848 1.00119.49 H ATOM 2799 HD2 ARG B 101 -5.639 -0.957 -26.095 1.00119.49 H ATOM 2800 HH22 ARG B 101 -10.634 0.198 -27.089 1.00151.01 H ATOM 2801 HH21 ARG B 101 -9.377 1.161 -26.419 1.00151.01 H ATOM 2802 HH12 ARG B 101 -9.865 -1.902 -28.172 1.00131.31 H ATOM 2803 HH11 ARG B 101 -8.402 -2.609 -27.545 1.00131.31 H ATOM 2804 HE ARG B 101 -7.478 0.302 -25.685 1.00129.20 H ATOM 2805 N GLU B 102 -2.817 -3.089 -22.474 1.00117.08 N ANISOU 2805 N GLU B 102 16403 13762 14319 -704 2210 -495 ATOM 2806 CA GLU B 102 -1.447 -2.925 -22.013 1.00118.38 C ANISOU 2806 CA GLU B 102 16386 14013 14579 -849 2330 -706 ATOM 2807 C GLU B 102 -0.524 -3.234 -23.224 1.00127.58 C ANISOU 2807 C GLU B 102 17623 15096 15754 -835 2428 -705 ATOM 2808 O GLU B 102 -0.489 -4.396 -23.645 1.00133.91 O ANISOU 2808 O GLU B 102 18451 15947 16482 -743 2272 -601 ATOM 2809 CB GLU B 102 -1.204 -3.845 -20.784 1.00111.44 C ANISOU 2809 CB GLU B 102 15258 13407 13679 -880 2124 -784 ATOM 2810 CG GLU B 102 0.240 -3.747 -20.232 1.00127.32 C ANISOU 2810 CG GLU B 102 17049 15568 15758 -1003 2205 -998 ATOM 2811 CD GLU B 102 0.437 -4.281 -18.809 1.00139.27 C ANISOU 2811 CD GLU B 102 18305 17364 17246 -1039 2044 -1102 ATOM 2812 OE1 GLU B 102 -0.086 -3.673 -17.854 1.00153.54 O ANISOU 2812 OE1 GLU B 102 20109 19219 19010 -1006 1920 -1038 ATOM 2813 OE2 GLU B 102 1.145 -5.301 -18.658 1.00154.41 O1- ANISOU 2813 OE2 GLU B 102 20021 19469 19179 -1091 2041 -1244 ATOM 2814 H GLU B 102 -2.931 -3.726 -23.257 1.00117.08 H ATOM 2815 HA GLU B 102 -1.324 -1.904 -21.658 1.00118.38 H ATOM 2816 HB3 GLU B 102 -1.425 -4.881 -21.050 1.00111.44 H ATOM 2817 HB2 GLU B 102 -1.913 -3.596 -19.993 1.00111.44 H ATOM 2818 HG3 GLU B 102 0.553 -2.703 -20.229 1.00127.32 H ATOM 2819 HG2 GLU B 102 0.924 -4.273 -20.900 1.00127.32 H ATOM 2820 N PRO B 103 0.192 -2.229 -23.793 1.00141.94 N ANISOU 2820 N PRO B 103 19499 16765 17667 -925 2708 -815 ATOM 2821 CA PRO B 103 0.116 -0.793 -23.456 1.00148.82 C ANISOU 2821 CA PRO B 103 20382 17528 18635 -1039 2946 -937 ATOM 2822 C PRO B 103 -1.243 -0.145 -23.850 1.00145.58 C ANISOU 2822 C PRO B 103 20209 16921 18185 -933 3016 -770 ATOM 2823 O PRO B 103 -1.928 -0.691 -24.716 1.00139.81 O ANISOU 2823 O PRO B 103 19667 16095 17361 -782 2955 -580 ATOM 2824 CB PRO B 103 1.310 -0.186 -24.221 1.00148.07 C ANISOU 2824 CB PRO B 103 20312 17303 18644 -1146 3237 -1079 ATOM 2825 CG PRO B 103 1.550 -1.107 -25.410 1.00143.89 C ANISOU 2825 CG PRO B 103 19924 16705 18041 -1019 3176 -928 ATOM 2826 CD PRO B 103 1.162 -2.483 -24.867 1.00138.37 C ANISOU 2826 CD PRO B 103 19115 16223 17237 -924 2832 -829 ATOM 2827 HA PRO B 103 0.310 -0.690 -22.392 1.00148.82 H ATOM 2828 HB3 PRO B 103 2.189 -0.201 -23.575 1.00148.07 H ATOM 2829 HB2 PRO B 103 1.156 0.849 -24.529 1.00148.07 H ATOM 2830 HG3 PRO B 103 2.573 -1.070 -25.792 1.00143.89 H ATOM 2831 HG2 PRO B 103 0.884 -0.833 -26.228 1.00143.89 H ATOM 2832 HD2 PRO B 103 0.763 -3.126 -25.653 1.00138.37 H ATOM 2833 HD3 PRO B 103 2.032 -2.987 -24.440 1.00138.37 H ATOM 2834 N PRO B 104 -1.611 0.998 -23.223 1.00150.37 N ANISOU 2834 N PRO B 104 20809 17473 18852 -1002 3145 -837 ATOM 2835 CA PRO B 104 -2.859 1.729 -23.543 1.00152.34 C ANISOU 2835 CA PRO B 104 21257 17572 19051 -876 3181 -664 ATOM 2836 C PRO B 104 -3.036 2.095 -25.027 1.00158.58 C ANISOU 2836 C PRO B 104 22330 18122 19803 -743 3361 -508 ATOM 2837 O PRO B 104 -2.060 2.471 -25.679 1.00156.67 O ANISOU 2837 O PRO B 104 22148 17749 19630 -808 3598 -592 ATOM 2838 CB PRO B 104 -2.776 2.989 -22.669 1.00148.26 C ANISOU 2838 CB PRO B 104 20686 17004 18644 -1011 3385 -814 ATOM 2839 CG PRO B 104 -1.934 2.563 -21.481 1.00149.50 C ANISOU 2839 CG PRO B 104 20548 17391 18863 -1195 3311 -1053 ATOM 2840 CD PRO B 104 -0.903 1.636 -22.110 1.00154.57 C ANISOU 2840 CD PRO B 104 21131 18104 19494 -1200 3258 -1087 ATOM 2841 HA PRO B 104 -3.694 1.105 -23.213 1.00152.34 H ATOM 2842 HB3 PRO B 104 -3.761 3.352 -22.371 1.00148.26 H ATOM 2843 HB2 PRO B 104 -2.272 3.798 -23.202 1.00148.26 H ATOM 2844 HG3 PRO B 104 -2.557 1.986 -20.795 1.00149.50 H ATOM 2845 HG2 PRO B 104 -1.499 3.391 -20.923 1.00149.50 H ATOM 2846 HD2 PRO B 104 -0.053 2.197 -22.502 1.00154.57 H ATOM 2847 HD3 PRO B 104 -0.543 0.940 -21.352 1.00154.57 H ATOM 2848 N HIS B 105 -4.270 1.961 -25.530 1.00167.04 N ANISOU 2848 N HIS B 105 23553 19161 20751 -555 3234 -289 ATOM 2849 CA HIS B 105 -4.739 2.225 -26.895 1.00175.22 C ANISOU 2849 CA HIS B 105 24867 20005 21704 -375 3367 -100 ATOM 2850 C HIS B 105 -4.217 1.250 -27.976 1.00160.44 C ANISOU 2850 C HIS B 105 23064 18146 19749 -306 3280 -34 ATOM 2851 O HIS B 105 -4.787 1.218 -29.065 1.00151.42 O ANISOU 2851 O HIS B 105 22133 16910 18492 -130 3303 143 ATOM 2852 CB HIS B 105 -4.548 3.705 -27.296 1.00187.83 C ANISOU 2852 CB HIS B 105 26623 21341 23401 -405 3775 -141 ATOM 2853 CG HIS B 105 -5.187 4.704 -26.358 1.00194.10 C ANISOU 2853 CG HIS B 105 27389 22098 24261 -446 3874 -178 ATOM 2854 ND1 HIS B 105 -4.477 5.367 -25.372 1.00186.13 N ANISOU 2854 ND1 HIS B 105 26481 21082 23160 -271 3793 6 ATOM 2855 CD2 HIS B 105 -6.484 5.170 -26.260 1.00192.61 C ANISOU 2855 CD2 HIS B 105 27084 21877 24221 -643 4067 -387 ATOM 2856 CE1 HIS B 105 -5.334 6.172 -24.737 1.00180.98 C ANISOU 2856 CE1 HIS B 105 25782 20382 22601 -356 3929 -77 ATOM 2857 NE2 HIS B 105 -6.558 6.126 -25.238 1.00182.75 N ANISOU 2857 NE2 HIS B 105 25876 20589 22973 -590 4100 -323 ATOM 2858 H HIS B 105 -5.050 1.746 -24.899 1.00167.04 H ATOM 2859 HA HIS B 105 -5.815 2.054 -26.857 1.00175.22 H ATOM 2860 HB3 HIS B 105 -4.968 3.869 -28.289 1.00187.83 H ATOM 2861 HB2 HIS B 105 -3.486 3.932 -27.379 1.00187.83 H ATOM 2862 HD1 HIS B 105 -3.498 5.248 -25.164 1.00186.13 H ATOM 2863 HD2 HIS B 105 -7.352 4.896 -26.835 1.00192.61 H ATOM 2864 HE1 HIS B 105 -5.060 6.809 -23.909 1.00180.98 H ATOM 2865 N CYS B 106 -3.188 0.444 -27.670 1.00157.29 N ANISOU 2865 N CYS B 106 22494 17878 19392 -422 3170 -159 ATOM 2866 CA CYS B 106 -2.667 -0.624 -28.530 1.00147.89 C ANISOU 2866 CA CYS B 106 21342 16719 18130 -370 3067 -108 ATOM 2867 C CYS B 106 -3.705 -1.775 -28.588 1.00131.81 C ANISOU 2867 C CYS B 106 19276 14852 15955 -260 2727 22 ATOM 2868 O CYS B 106 -3.898 -2.444 -27.570 1.00113.50 O ANISOU 2868 O CYS B 106 16765 12716 13645 -318 2515 -33 ATOM 2869 CB CYS B 106 -1.269 -1.073 -28.033 1.00159.17 C ANISOU 2869 CB CYS B 106 22590 18222 19666 -531 3111 -298 ATOM 2870 SG CYS B 106 -0.591 -2.515 -28.902 1.00116.44 S ANISOU 2870 SG CYS B 106 17108 12963 14172 -486 2855 -254 ATOM 2871 H CYS B 106 -2.782 0.544 -26.748 1.00157.29 H ATOM 2872 HA CYS B 106 -2.530 -0.191 -29.519 1.00147.89 H ATOM 2873 HB3 CYS B 106 -1.303 -1.336 -26.978 1.00159.17 H ATOM 2874 HB2 CYS B 106 -0.556 -0.252 -28.130 1.00159.17 H ATOM 2875 HG CYS B 106 -1.251 -3.429 -28.189 1.00116.44 H ATOM 2876 N PRO B 107 -4.419 -1.949 -29.727 1.00122.15 N ANISOU 2876 N PRO B 107 18242 13578 14591 -94 2671 195 ATOM 2877 CA PRO B 107 -5.721 -2.646 -29.734 1.00120.84 C ANISOU 2877 CA PRO B 107 18067 13547 14301 14 2405 316 ATOM 2878 C PRO B 107 -5.696 -4.153 -29.434 1.00117.18 C ANISOU 2878 C PRO B 107 17484 13262 13778 1 2124 316 ATOM 2879 O PRO B 107 -6.734 -4.700 -29.060 1.00125.82 O ANISOU 2879 O PRO B 107 18531 14473 14801 51 1920 379 ATOM 2880 CB PRO B 107 -6.277 -2.374 -31.141 1.00123.55 C ANISOU 2880 CB PRO B 107 18653 13787 14503 197 2473 481 ATOM 2881 CG PRO B 107 -5.043 -2.157 -32.005 1.00114.16 C ANISOU 2881 CG PRO B 107 17581 12458 13336 180 2672 452 ATOM 2882 CD PRO B 107 -4.102 -1.420 -31.056 1.00114.67 C ANISOU 2882 CD PRO B 107 17519 12460 13589 -2 2860 273 ATOM 2883 HA PRO B 107 -6.378 -2.176 -29.007 1.00120.84 H ATOM 2884 HB3 PRO B 107 -6.874 -1.461 -31.116 1.00123.55 H ATOM 2885 HB2 PRO B 107 -6.924 -3.169 -31.519 1.00123.55 H ATOM 2886 HG3 PRO B 107 -5.256 -1.611 -32.925 1.00114.16 H ATOM 2887 HG2 PRO B 107 -4.603 -3.118 -32.283 1.00114.16 H ATOM 2888 HD2 PRO B 107 -3.056 -1.569 -31.331 1.00114.67 H ATOM 2889 HD3 PRO B 107 -4.321 -0.351 -31.080 1.00114.67 H ATOM 2890 N AASN B 108 -4.546 -4.792 -29.665 0.50108.41 N ANISOU 2890 N AASN B 108 16325 12155 12711 -73 2149 238 ATOM 2891 N BASN B 108 -4.800 -4.952 -29.739 0.50112.99 N ANISOU 2891 N BASN B 108 16915 12745 13269 -56 2119 256 ATOM 2892 CA AASN B 108 -4.358 -6.241 -29.751 0.50100.84 C ANISOU 2892 CA AASN B 108 15315 11300 11699 -73 1971 244 ATOM 2893 CA BASN B 108 -4.977 -6.422 -29.593 0.50106.79 C ANISOU 2893 CA BASN B 108 16042 12107 12425 -54 1878 271 ATOM 2894 C AASN B 108 -3.659 -6.857 -28.528 0.50 97.13 C ANISOU 2894 C AASN B 108 14613 10973 11321 -181 1873 131 ATOM 2895 C BASN B 108 -3.905 -6.919 -28.602 0.50101.62 C ANISOU 2895 C BASN B 108 15183 11544 11884 -177 1864 137 ATOM 2896 O AASN B 108 -3.457 -8.072 -28.530 0.50105.88 O ANISOU 2896 O AASN B 108 15665 12165 12400 -180 1745 134 ATOM 2897 O BASN B 108 -3.433 -8.035 -28.769 0.50111.98 O ANISOU 2897 O BASN B 108 16455 12915 13176 -181 1776 131 ATOM 2898 CB AASN B 108 -3.523 -6.547 -31.025 0.50 95.53 C ANISOU 2898 CB AASN B 108 14759 10517 11020 -65 2112 238 ATOM 2899 CB BASN B 108 -5.098 -7.105 -30.974 0.50105.63 C ANISOU 2899 CB BASN B 108 16062 11921 12153 39 1845 361 ATOM 2900 CG AASN B 108 -2.148 -5.870 -31.028 0.50 92.11 C ANISOU 2900 CG AASN B 108 14267 9999 10730 -176 2344 106 ATOM 2901 CG BASN B 108 -6.426 -6.879 -31.702 0.50105.63 C ANISOU 2901 CG BASN B 108 16205 11927 12004 176 1770 491 ATOM 2902 OD1AASN B 108 -2.061 -4.674 -31.278 0.50106.30 O ANISOU 2902 OD1AASN B 108 16164 11653 12572 -179 2563 95 ATOM 2903 OD1BASN B 108 -6.601 -7.274 -32.848 0.50104.10 O ANISOU 2903 OD1BASN B 108 16150 11715 11690 258 1753 558 ATOM 2904 ND2AASN B 108 -1.076 -6.584 -30.714 0.50 74.23 N ANISOU 2904 ND2AASN B 108 11838 7824 8543 -265 2316 -2 ATOM 2905 ND2BASN B 108 -7.401 -6.254 -31.068 0.50 98.81 N ANISOU 2905 ND2BASN B 108 15303 11106 11134 209 1720 527 ATOM 2906 H AASN B 108 -3.752 -4.249 -29.989 0.50108.41 H ATOM 2907 H BASN B 108 -3.924 -4.567 -30.062 0.50112.99 H ATOM 2908 HA AASN B 108 -5.326 -6.735 -29.848 0.50100.84 H ATOM 2909 HA BASN B 108 -5.938 -6.565 -29.098 0.50106.79 H ATOM 2910 HB3AASN B 108 -4.066 -6.184 -31.901 0.50 95.53 H ATOM 2911 HB3BASN B 108 -4.926 -8.176 -30.863 0.50105.63 H ATOM 2912 HB2AASN B 108 -3.413 -7.622 -31.166 0.50 95.53 H ATOM 2913 HB2BASN B 108 -4.277 -6.777 -31.612 0.50105.63 H ATOM 2914 HD22AASN B 108 -0.181 -6.118 -30.712 0.50 74.23 H ATOM 2915 HD22BASN B 108 -8.284 -6.095 -31.531 0.50 98.81 H ATOM 2916 HD21AASN B 108 -1.137 -7.561 -30.474 0.50 74.23 H ATOM 2917 HD21BASN B 108 -7.263 -5.934 -30.120 0.50 98.81 H ATOM 2918 N SER B 109 -3.237 -6.038 -27.562 1.00101.21 N ANISOU 2918 N SER B 109 14999 11517 11938 -268 1944 31 ATOM 2919 CA SER B 109 -2.402 -6.470 -26.445 1.00103.55 C ANISOU 2919 CA SER B 109 15070 11953 12320 -371 1907 -102 ATOM 2920 C SER B 109 -3.087 -6.054 -25.142 1.00108.19 C ANISOU 2920 C SER B 109 15512 12651 12944 -419 1833 -153 ATOM 2921 O SER B 109 -3.415 -4.876 -24.970 1.00103.28 O ANISOU 2921 O SER B 109 14934 11944 12363 -446 1962 -175 ATOM 2922 CB SER B 109 -0.997 -5.846 -26.598 1.00103.84 C ANISOU 2922 CB SER B 109 15078 11921 12457 -459 2129 -229 ATOM 2923 OG SER B 109 -0.066 -6.358 -25.660 1.00117.16 O ANISOU 2923 OG SER B 109 16531 13778 14207 -542 2081 -361 ATOM 2924 H SER B 109 -3.533 -5.068 -27.532 1.00101.21 H ATOM 2925 HA SER B 109 -2.289 -7.555 -26.445 1.00103.55 H ATOM 2926 HB3 SER B 109 -1.050 -4.765 -26.468 1.00103.84 H ATOM 2927 HB2 SER B 109 -0.600 -6.023 -27.596 1.00103.84 H ATOM 2928 HG SER B 109 -0.162 -5.841 -24.840 1.00117.16 H ATOM 2929 N PHE B 110 -3.296 -7.034 -24.259 1.00105.81 N ANISOU 2929 N PHE B 110 15047 12528 12630 -428 1651 -173 ATOM 2930 CA PHE B 110 -3.972 -6.855 -22.984 1.00102.76 C ANISOU 2930 CA PHE B 110 14532 12261 12251 -453 1544 -198 ATOM 2931 C PHE B 110 -3.172 -7.477 -21.834 1.00104.36 C ANISOU 2931 C PHE B 110 14509 12665 12479 -500 1458 -298 ATOM 2932 O PHE B 110 -2.360 -8.385 -22.039 1.00112.02 O ANISOU 2932 O PHE B 110 15431 13695 13435 -475 1425 -302 ATOM 2933 CB PHE B 110 -5.362 -7.523 -23.033 1.00102.63 C ANISOU 2933 CB PHE B 110 14588 12265 12142 -360 1358 -57 ATOM 2934 CG PHE B 110 -6.343 -6.982 -24.057 1.00103.94 C ANISOU 2934 CG PHE B 110 14954 12287 12251 -285 1400 53 ATOM 2935 CD1 PHE B 110 -6.248 -7.381 -25.404 1.00 96.91 C ANISOU 2935 CD1 PHE B 110 14215 11308 11298 -221 1425 125 ATOM 2936 CD2 PHE B 110 -7.276 -5.985 -23.705 1.00 98.40 C ANISOU 2936 CD2 PHE B 110 14288 11550 11549 -266 1420 88 ATOM 2937 CE1 PHE B 110 -7.082 -6.812 -26.354 1.00102.54 C ANISOU 2937 CE1 PHE B 110 15105 11921 11935 -131 1458 229 ATOM 2938 CE2 PHE B 110 -8.130 -5.457 -24.662 1.00 97.95 C ANISOU 2938 CE2 PHE B 110 14406 11387 11421 -167 1455 201 ATOM 2939 CZ PHE B 110 -8.025 -5.862 -25.986 1.00107.85 C ANISOU 2939 CZ PHE B 110 15804 12575 12600 -95 1470 271 ATOM 2940 H PHE B 110 -3.039 -7.991 -24.494 1.00105.81 H ATOM 2941 HA PHE B 110 -4.076 -5.793 -22.780 1.00102.76 H ATOM 2942 HB3 PHE B 110 -5.821 -7.436 -22.047 1.00102.63 H ATOM 2943 HB2 PHE B 110 -5.241 -8.591 -23.213 1.00102.63 H ATOM 2944 HD1 PHE B 110 -5.511 -8.113 -25.699 1.00 96.91 H ATOM 2945 HD2 PHE B 110 -7.349 -5.637 -22.689 1.00 98.40 H ATOM 2946 HE1 PHE B 110 -6.983 -7.094 -27.389 1.00102.54 H ATOM 2947 HE2 PHE B 110 -8.852 -4.708 -24.372 1.00 97.95 H ATOM 2948 HZ PHE B 110 -8.661 -5.425 -26.740 1.00107.85 H ATOM 2949 N ARG B 111 -3.508 -7.054 -20.616 1.00 99.52 N ANISOU 2949 N ARG B 111 13767 12156 11891 -553 1426 -368 ATOM 2950 CA ARG B 111 -3.213 -7.773 -19.392 1.00 98.95 C ANISOU 2950 CA ARG B 111 13486 12307 11802 -560 1295 -427 ATOM 2951 C ARG B 111 -4.528 -8.129 -18.696 1.00 99.29 C ANISOU 2951 C ARG B 111 13544 12391 11789 -504 1133 -325 ATOM 2952 O ARG B 111 -5.511 -7.393 -18.777 1.00100.68 O ANISOU 2952 O ARG B 111 13815 12466 11974 -510 1161 -286 ATOM 2953 CB ARG B 111 -2.286 -6.931 -18.512 1.00101.59 C ANISOU 2953 CB ARG B 111 13635 12759 12205 -680 1399 -621 ATOM 2954 CG ARG B 111 -1.974 -7.513 -17.118 1.00111.21 C ANISOU 2954 CG ARG B 111 14630 14243 13383 -664 1264 -683 ATOM 2955 CD ARG B 111 -0.751 -6.790 -16.582 1.00133.15 C ANISOU 2955 CD ARG B 111 17203 17177 16213 -770 1373 -897 ATOM 2956 NE ARG B 111 -0.377 -7.119 -15.204 1.00146.52 N ANISOU 2956 NE ARG B 111 18680 19123 17869 -793 1281 -998 ATOM 2957 CZ ARG B 111 0.371 -6.315 -14.434 1.00151.86 C ANISOU 2957 CZ ARG B 111 19150 19971 18579 -909 1365 -1216 ATOM 2958 NH1 ARG B 111 0.911 -5.186 -14.917 1.00168.26 N ANISOU 2958 NH1 ARG B 111 21207 21980 20742 -1022 1555 -1362 ATOM 2959 NH2 ARG B 111 0.550 -6.649 -13.158 1.00137.12 N1+ ANISOU 2959 NH2 ARG B 111 17096 18351 16654 -913 1263 -1296 ATOM 2960 H ARG B 111 -4.182 -6.290 -20.528 1.00 99.52 H ATOM 2961 HA ARG B 111 -2.698 -8.707 -19.621 1.00 98.95 H ATOM 2962 HB3 ARG B 111 -2.707 -5.931 -18.379 1.00101.59 H ATOM 2963 HB2 ARG B 111 -1.354 -6.781 -19.062 1.00101.59 H ATOM 2964 HG3 ARG B 111 -1.760 -8.581 -17.199 1.00111.21 H ATOM 2965 HG2 ARG B 111 -2.822 -7.395 -16.442 1.00111.21 H ATOM 2966 HD3 ARG B 111 -0.930 -5.724 -16.681 1.00133.15 H ATOM 2967 HD2 ARG B 111 0.107 -7.064 -17.193 1.00133.15 H ATOM 2968 HH22 ARG B 111 0.988 -6.027 -12.493 1.00137.12 H ATOM 2969 HH21 ARG B 111 0.058 -7.436 -12.759 1.00137.12 H ATOM 2970 HH12 ARG B 111 1.398 -4.500 -14.366 1.00168.26 H ATOM 2971 HH11 ARG B 111 0.768 -4.931 -15.907 1.00168.26 H ATOM 2972 HE ARG B 111 -0.605 -8.083 -14.930 1.00146.52 H ATOM 2973 N LEU B 112 -4.499 -9.272 -18.016 1.00 98.56 N ANISOU 2973 N LEU B 112 13366 12438 11642 -441 983 -280 ATOM 2974 CA LEU B 112 -5.555 -9.744 -17.140 1.00 99.22 C ANISOU 2974 CA LEU B 112 13439 12586 11675 -387 830 -194 ATOM 2975 C LEU B 112 -5.596 -8.886 -15.854 1.00106.19 C ANISOU 2975 C LEU B 112 14179 13586 12582 -454 836 -298 ATOM 2976 O LEU B 112 -4.613 -8.861 -15.110 1.00103.70 O ANISOU 2976 O LEU B 112 13703 13414 12286 -502 881 -428 ATOM 2977 CB LEU B 112 -5.260 -11.241 -16.864 1.00102.08 C ANISOU 2977 CB LEU B 112 13745 13058 11982 -303 727 -138 ATOM 2978 CG LEU B 112 -6.492 -12.099 -16.517 1.00104.11 C ANISOU 2978 CG LEU B 112 14070 13303 12184 -230 599 -12 ATOM 2979 CD1 LEU B 112 -7.527 -12.130 -17.661 1.00100.20 C ANISOU 2979 CD1 LEU B 112 13761 12636 11673 -216 596 76 ATOM 2980 CD2 LEU B 112 -6.052 -13.525 -16.142 1.00116.63 C ANISOU 2980 CD2 LEU B 112 15599 14990 13726 -143 547 33 ATOM 2981 H LEU B 112 -3.655 -9.839 -18.038 1.00 98.56 H ATOM 2982 HA LEU B 112 -6.505 -9.646 -17.666 1.00 99.22 H ATOM 2983 HB3 LEU B 112 -4.498 -11.323 -16.085 1.00102.08 H ATOM 2984 HB2 LEU B 112 -4.799 -11.688 -17.746 1.00102.08 H ATOM 2985 HG LEU B 112 -6.956 -11.649 -15.639 1.00104.11 H ATOM 2986 HD11 LEU B 112 -7.972 -13.117 -17.798 1.00100.20 H ATOM 2987 HD12 LEU B 112 -8.345 -11.433 -17.466 1.00100.20 H ATOM 2988 HD13 LEU B 112 -7.072 -11.854 -18.611 1.00100.20 H ATOM 2989 HD21 LEU B 112 -6.748 -13.977 -15.436 1.00116.63 H ATOM 2990 HD22 LEU B 112 -6.002 -14.168 -17.021 1.00116.63 H ATOM 2991 HD23 LEU B 112 -5.062 -13.549 -15.682 1.00116.63 H ATOM 2992 N GLU B 113 -6.718 -8.210 -15.598 1.00105.40 N ANISOU 2992 N GLU B 113 14129 13439 12481 -458 797 -252 ATOM 2993 CA GLU B 113 -7.058 -7.664 -14.288 1.00105.00 C ANISOU 2993 CA GLU B 113 13952 13500 12444 -515 790 -339 ATOM 2994 C GLU B 113 -7.984 -8.635 -13.538 1.00101.01 C ANISOU 2994 C GLU B 113 13435 13061 11883 -447 635 -241 ATOM 2995 O GLU B 113 -8.559 -9.542 -14.142 1.00 95.35 O ANISOU 2995 O GLU B 113 12841 12250 11138 -383 565 -113 ATOM 2996 CB GLU B 113 -7.714 -6.281 -14.426 1.00112.28 C ANISOU 2996 CB GLU B 113 14940 14288 13432 -595 932 -392 ATOM 2997 CG GLU B 113 -6.724 -5.142 -14.726 1.00114.90 C ANISOU 2997 CG GLU B 113 15231 14594 13832 -694 1114 -541 ATOM 2998 CD GLU B 113 -7.366 -3.751 -14.805 1.00127.11 C ANISOU 2998 CD GLU B 113 16856 15987 15454 -775 1301 -601 ATOM 2999 OE1 GLU B 113 -6.585 -2.789 -14.922 1.00124.72 O ANISOU 2999 OE1 GLU B 113 16509 15661 15218 -878 1476 -749 ATOM 3000 OE2 GLU B 113 -8.610 -3.622 -14.862 1.00122.68 O1- ANISOU 3000 OE2 GLU B 113 16399 15328 14885 -732 1283 -502 ATOM 3001 H GLU B 113 -7.485 -8.233 -16.269 1.00105.40 H ATOM 3002 HA GLU B 113 -6.154 -7.555 -13.694 1.00105.00 H ATOM 3003 HB3 GLU B 113 -8.289 -6.025 -13.534 1.00112.28 H ATOM 3004 HB2 GLU B 113 -8.420 -6.328 -15.246 1.00112.28 H ATOM 3005 HG3 GLU B 113 -6.211 -5.336 -15.669 1.00114.90 H ATOM 3006 HG2 GLU B 113 -5.951 -5.107 -13.959 1.00114.90 H ATOM 3007 N LYS B 114 -8.118 -8.406 -12.230 1.00100.82 N ANISOU 3007 N LYS B 114 13261 13207 11840 -467 593 -313 ATOM 3008 CA LYS B 114 -9.054 -9.075 -11.340 1.00109.11 C ANISOU 3008 CA LYS B 114 14278 14338 12838 -411 470 -243 ATOM 3009 C LYS B 114 -9.826 -7.933 -10.674 1.00 94.93 C ANISOU 3009 C LYS B 114 12482 12506 11082 -481 508 -287 ATOM 3010 O LYS B 114 -9.181 -7.029 -10.141 1.00 89.95 O ANISOU 3010 O LYS B 114 11766 11926 10487 -572 602 -426 ATOM 3011 CB LYS B 114 -8.255 -9.954 -10.341 1.00122.03 C ANISOU 3011 CB LYS B 114 15749 16204 14411 -366 410 -291 ATOM 3012 CG LYS B 114 -9.065 -10.513 -9.149 1.00133.45 C ANISOU 3012 CG LYS B 114 17186 17727 15791 -274 294 -190 ATOM 3013 CD LYS B 114 -8.231 -11.034 -7.961 1.00147.99 C ANISOU 3013 CD LYS B 114 18854 19821 17554 -216 253 -247 ATOM 3014 CE LYS B 114 -7.864 -12.535 -8.007 1.00156.35 C ANISOU 3014 CE LYS B 114 19910 20945 18549 -81 215 -154 ATOM 3015 NZ LYS B 114 -7.686 -13.085 -6.652 1.00165.71 N1+ ANISOU 3015 NZ LYS B 114 20972 22359 19633 27 152 -141 ATOM 3016 H LYS B 114 -7.793 -7.522 -11.858 1.00100.82 H ATOM 3017 HA LYS B 114 -9.752 -9.692 -11.905 1.00109.11 H ATOM 3018 HB3 LYS B 114 -7.442 -9.343 -9.944 1.00122.03 H ATOM 3019 HB2 LYS B 114 -7.795 -10.776 -10.889 1.00122.03 H ATOM 3020 HG3 LYS B 114 -9.754 -11.283 -9.501 1.00133.45 H ATOM 3021 HG2 LYS B 114 -9.706 -9.730 -8.743 1.00133.45 H ATOM 3022 HD3 LYS B 114 -8.799 -10.796 -7.060 1.00147.99 H ATOM 3023 HD2 LYS B 114 -7.317 -10.443 -7.877 1.00147.99 H ATOM 3024 HE3 LYS B 114 -6.966 -12.702 -8.604 1.00156.35 H ATOM 3025 HE2 LYS B 114 -8.672 -13.103 -8.470 1.00156.35 H ATOM 3026 HZ1 LYS B 114 -8.607 -12.977 -6.191 1.00165.71 H ATOM 3027 HZ2 LYS B 114 -7.507 -14.074 -6.657 1.00165.71 H ATOM 3028 HZ3 LYS B 114 -7.008 -12.587 -6.102 1.00165.71 H ATOM 3029 N ILE B 115 -11.154 -7.994 -10.718 1.00 85.49 N ANISOU 3029 N ILE B 115 11380 11219 9883 -445 448 -180 ATOM 3030 CA ILE B 115 -12.061 -7.058 -10.060 1.00 86.77 C ANISOU 3030 CA ILE B 115 11543 11346 10078 -492 478 -202 ATOM 3031 C ILE B 115 -13.111 -7.855 -9.265 1.00 87.69 C ANISOU 3031 C ILE B 115 11652 11510 10154 -435 356 -114 ATOM 3032 O ILE B 115 -13.201 -9.076 -9.417 1.00 82.91 O ANISOU 3032 O ILE B 115 11076 10920 9505 -360 265 -23 ATOM 3033 CB ILE B 115 -12.766 -6.121 -11.090 1.00 90.65 C ANISOU 3033 CB ILE B 115 12172 11647 10623 -507 577 -166 ATOM 3034 CG1 ILE B 115 -13.597 -6.863 -12.164 1.00 96.76 C ANISOU 3034 CG1 ILE B 115 13078 12319 11367 -420 504 -23 ATOM 3035 CG2 ILE B 115 -11.757 -5.149 -11.737 1.00 90.17 C ANISOU 3035 CG2 ILE B 115 12110 11539 10612 -579 735 -276 ATOM 3036 CD1 ILE B 115 -14.520 -5.949 -12.981 1.00 91.97 C ANISOU 3036 CD1 ILE B 115 12587 11574 10782 -395 559 42 ATOM 3037 H ILE B 115 -11.626 -8.796 -11.142 1.00 85.49 H ATOM 3038 HA ILE B 115 -11.514 -6.454 -9.333 1.00 86.77 H ATOM 3039 HB ILE B 115 -13.466 -5.500 -10.527 1.00 90.65 H ATOM 3040 HG13 ILE B 115 -14.221 -7.622 -11.696 1.00 96.76 H ATOM 3041 HG12 ILE B 115 -12.929 -7.406 -12.835 1.00 96.76 H ATOM 3042 HG21 ILE B 115 -12.256 -4.357 -12.298 1.00 90.17 H ATOM 3043 HG22 ILE B 115 -11.138 -4.661 -10.983 1.00 90.17 H ATOM 3044 HG23 ILE B 115 -11.083 -5.661 -12.425 1.00 90.17 H ATOM 3045 HD11 ILE B 115 -15.189 -6.544 -13.602 1.00 91.97 H ATOM 3046 HD12 ILE B 115 -15.140 -5.332 -12.331 1.00 91.97 H ATOM 3047 HD13 ILE B 115 -13.957 -5.289 -13.642 1.00 91.97 H ATOM 3048 N LEU B 116 -13.868 -7.163 -8.411 1.00 86.27 N ANISOU 3048 N LEU B 116 11439 11343 9997 -476 375 -149 ATOM 3049 CA LEU B 116 -14.940 -7.719 -7.599 1.00 82.98 C ANISOU 3049 CA LEU B 116 11014 10960 9555 -436 282 -78 ATOM 3050 C LEU B 116 -16.239 -7.096 -8.133 1.00 78.38 C ANISOU 3050 C LEU B 116 10534 10231 9014 -427 294 -2 ATOM 3051 O LEU B 116 -16.281 -5.869 -8.222 1.00 86.09 O ANISOU 3051 O LEU B 116 11538 11132 10039 -470 396 -43 ATOM 3052 CB LEU B 116 -14.656 -7.300 -6.136 1.00 93.37 C ANISOU 3052 CB LEU B 116 12205 12414 10857 -486 299 -181 ATOM 3053 CG LEU B 116 -15.374 -8.148 -5.071 1.00104.62 C ANISOU 3053 CG LEU B 116 13585 13945 12223 -425 198 -125 ATOM 3054 CD1 LEU B 116 -14.759 -9.554 -4.940 1.00 98.17 C ANISOU 3054 CD1 LEU B 116 12733 13237 11332 -340 132 -85 ATOM 3055 CD2 LEU B 116 -15.361 -7.433 -3.712 1.00109.77 C ANISOU 3055 CD2 LEU B 116 14134 14711 12863 -483 228 -229 ATOM 3056 H LEU B 116 -13.840 -6.155 -8.405 1.00 86.27 H ATOM 3057 HA LEU B 116 -14.972 -8.804 -7.688 1.00 82.98 H ATOM 3058 HB3 LEU B 116 -14.930 -6.250 -6.015 1.00 93.37 H ATOM 3059 HB2 LEU B 116 -13.583 -7.330 -5.942 1.00 93.37 H ATOM 3060 HG LEU B 116 -16.414 -8.247 -5.381 1.00104.62 H ATOM 3061 HD11 LEU B 116 -15.031 -10.024 -3.994 1.00 98.17 H ATOM 3062 HD12 LEU B 116 -15.109 -10.210 -5.734 1.00 98.17 H ATOM 3063 HD13 LEU B 116 -13.669 -9.526 -4.992 1.00 98.17 H ATOM 3064 HD21 LEU B 116 -15.999 -7.941 -2.990 1.00109.77 H ATOM 3065 HD22 LEU B 116 -14.351 -7.394 -3.298 1.00109.77 H ATOM 3066 HD23 LEU B 116 -15.724 -6.408 -3.800 1.00109.77 H ATOM 3067 N VAL B 117 -17.225 -7.911 -8.525 1.00 78.12 N ANISOU 3067 N VAL B 117 10557 10165 8961 -367 203 103 ATOM 3068 CA VAL B 117 -18.493 -7.426 -9.076 1.00 83.41 C ANISOU 3068 CA VAL B 117 11306 10730 9656 -342 197 175 ATOM 3069 C VAL B 117 -19.658 -8.057 -8.289 1.00 86.23 C ANISOU 3069 C VAL B 117 11632 11125 10005 -323 112 222 ATOM 3070 O VAL B 117 -19.649 -9.267 -8.053 1.00 86.43 O ANISOU 3070 O VAL B 117 11639 11202 9997 -300 43 249 ATOM 3071 CB VAL B 117 -18.649 -7.821 -10.581 1.00 86.72 C ANISOU 3071 CB VAL B 117 11824 11071 10053 -297 178 237 ATOM 3072 CG1 VAL B 117 -20.012 -7.425 -11.192 1.00105.87 C ANISOU 3072 CG1 VAL B 117 14308 13438 12478 -252 148 311 ATOM 3073 CG2 VAL B 117 -17.513 -7.240 -11.449 1.00 96.43 C ANISOU 3073 CG2 VAL B 117 13098 12239 11300 -315 287 195 ATOM 3074 H VAL B 117 -17.117 -8.923 -8.469 1.00 78.12 H ATOM 3075 HA VAL B 117 -18.575 -6.340 -8.982 1.00 83.41 H ATOM 3076 HB VAL B 117 -18.570 -8.906 -10.660 1.00 86.72 H ATOM 3077 HG11 VAL B 117 -20.013 -7.505 -12.277 1.00105.87 H ATOM 3078 HG12 VAL B 117 -20.816 -8.067 -10.829 1.00105.87 H ATOM 3079 HG13 VAL B 117 -20.271 -6.394 -10.946 1.00105.87 H ATOM 3080 HG21 VAL B 117 -17.634 -7.509 -12.500 1.00 96.43 H ATOM 3081 HG22 VAL B 117 -17.494 -6.150 -11.387 1.00 96.43 H ATOM 3082 HG23 VAL B 117 -16.535 -7.605 -11.133 1.00 96.43 H ATOM 3083 N SER B 118 -20.650 -7.239 -7.927 1.00 77.04 N ANISOU 3083 N SER B 118 10472 9925 8876 -326 135 236 ATOM 3084 CA ASER B 118 -21.918 -7.695 -7.377 0.50 77.74 C ANISOU 3084 CA ASER B 118 10536 10032 8969 -309 68 282 ATOM 3085 CA BSER B 118 -22.036 -7.727 -7.441 0.50 74.32 C ANISOU 3085 CA BSER B 118 10103 9599 8536 -309 68 282 ATOM 3086 C SER B 118 -22.815 -8.246 -8.502 1.00 74.62 C ANISOU 3086 C SER B 118 10198 9596 8559 -263 2 353 ATOM 3087 O SER B 118 -23.139 -7.516 -9.447 1.00 83.36 O ANISOU 3087 O SER B 118 11359 10648 9668 -229 31 381 ATOM 3088 CB ASER B 118 -22.587 -6.539 -6.626 0.50 78.65 C ANISOU 3088 CB ASER B 118 10626 10129 9128 -327 129 264 ATOM 3089 CB BSER B 118 -22.683 -6.558 -6.741 0.50 71.31 C ANISOU 3089 CB BSER B 118 9697 9198 8200 -328 131 262 ATOM 3090 OG ASER B 118 -23.841 -6.919 -6.071 0.50 80.21 O ANISOU 3090 OG ASER B 118 10795 10346 9335 -313 69 304 ATOM 3091 OG BSER B 118 -21.803 -5.984 -5.795 0.50 64.91 O ANISOU 3091 OG BSER B 118 8830 8436 7396 -387 202 171 ATOM 3092 H SER B 118 -20.550 -6.233 -8.089 1.00 77.04 H ATOM 3093 HA ASER B 118 -21.716 -8.474 -6.644 0.50 77.74 H ATOM 3094 HA BSER B 118 -21.841 -8.509 -6.707 0.50 74.32 H ATOM 3095 HB3ASER B 118 -22.738 -5.696 -7.294 0.50 78.65 H ATOM 3096 HB3BSER B 118 -23.589 -6.893 -6.237 0.50 71.31 H ATOM 3097 HB2ASER B 118 -21.930 -6.187 -5.830 0.50 78.65 H ATOM 3098 HB2BSER B 118 -22.966 -5.805 -7.477 0.50 71.31 H ATOM 3099 HG ASER B 118 -24.346 -6.116 -5.910 0.50 80.21 H ATOM 3100 HG BSER B 118 -22.235 -5.244 -5.363 0.50 64.91 H ATOM 3101 N VAL B 119 -23.201 -9.521 -8.373 1.00 78.06 N ANISOU 3101 N VAL B 119 10621 10063 8977 -261 -72 374 ATOM 3102 CA VAL B 119 -23.941 -10.260 -9.396 1.00 83.05 C ANISOU 3102 CA VAL B 119 11290 10679 9586 -243 -136 409 ATOM 3103 C VAL B 119 -25.435 -10.438 -9.041 1.00 86.16 C ANISOU 3103 C VAL B 119 11640 11095 10003 -247 -180 423 ATOM 3104 O VAL B 119 -26.253 -10.714 -9.918 1.00 96.50 O ANISOU 3104 O VAL B 119 12956 12415 11293 -242 -236 430 ATOM 3105 CB VAL B 119 -23.276 -11.651 -9.598 1.00 92.48 C ANISOU 3105 CB VAL B 119 12511 11877 10750 -252 -153 404 ATOM 3106 CG1 VAL B 119 -23.944 -12.542 -10.658 1.00109.06 C ANISOU 3106 CG1 VAL B 119 14652 13959 12825 -254 -202 415 ATOM 3107 CG2 VAL B 119 -21.787 -11.496 -9.966 1.00 85.64 C ANISOU 3107 CG2 VAL B 119 11671 11001 9865 -245 -106 386 ATOM 3108 H VAL B 119 -22.888 -10.041 -7.555 1.00 78.06 H ATOM 3109 HA VAL B 119 -23.911 -9.725 -10.346 1.00 83.05 H ATOM 3110 HB VAL B 119 -23.322 -12.181 -8.646 1.00 92.48 H ATOM 3111 HG11 VAL B 119 -23.368 -13.448 -10.828 1.00109.06 H ATOM 3112 HG12 VAL B 119 -24.939 -12.864 -10.363 1.00109.06 H ATOM 3113 HG13 VAL B 119 -24.034 -12.020 -11.612 1.00109.06 H ATOM 3114 HG21 VAL B 119 -21.312 -12.463 -10.138 1.00 85.64 H ATOM 3115 HG22 VAL B 119 -21.656 -10.902 -10.873 1.00 85.64 H ATOM 3116 HG23 VAL B 119 -21.229 -11.003 -9.173 1.00 85.64 H ATOM 3117 N GLY B 120 -25.796 -10.244 -7.771 1.00 79.50 N ANISOU 3117 N GLY B 120 10745 10266 9195 -261 -156 415 ATOM 3118 CA GLY B 120 -27.174 -10.327 -7.320 1.00 79.11 C ANISOU 3118 CA GLY B 120 10646 10236 9176 -271 -186 423 ATOM 3119 C GLY B 120 -27.152 -10.222 -5.799 1.00 78.36 C ANISOU 3119 C GLY B 120 10508 10155 9108 -292 -144 409 ATOM 3120 O GLY B 120 -26.084 -10.177 -5.183 1.00 80.01 O ANISOU 3120 O GLY B 120 10722 10377 9301 -297 -104 386 ATOM 3121 H GLY B 120 -25.110 -9.991 -7.069 1.00 79.50 H ATOM 3122 HA3 GLY B 120 -27.629 -11.270 -7.618 1.00 79.11 H ATOM 3123 HA2 GLY B 120 -27.760 -9.509 -7.741 1.00 79.11 H ATOM 3124 N CYS B 121 -28.337 -10.168 -5.184 1.00 71.44 N ANISOU 3124 N CYS B 121 9587 9289 8267 -304 -152 413 ATOM 3125 CA CYS B 121 -28.483 -9.972 -3.737 1.00 73.90 C ANISOU 3125 CA CYS B 121 9863 9617 8600 -321 -111 402 ATOM 3126 C CYS B 121 -29.152 -11.193 -3.093 1.00 71.70 C ANISOU 3126 C CYS B 121 9572 9339 8332 -342 -118 407 ATOM 3127 O CYS B 121 -29.981 -11.860 -3.720 1.00 70.58 O ANISOU 3127 O CYS B 121 9422 9185 8212 -359 -149 405 ATOM 3128 CB CYS B 121 -29.262 -8.670 -3.462 1.00 75.85 C ANISOU 3128 CB CYS B 121 10076 9852 8889 -313 -78 404 ATOM 3129 SG CYS B 121 -28.397 -7.185 -4.042 1.00 79.41 S ANISOU 3129 SG CYS B 121 10563 10272 9339 -294 -13 393 ATOM 3130 H CYS B 121 -29.191 -10.285 -5.716 1.00 71.44 H ATOM 3131 HA CYS B 121 -27.503 -9.868 -3.271 1.00 73.90 H ATOM 3132 HB3 CYS B 121 -29.451 -8.572 -2.391 1.00 75.85 H ATOM 3133 HB2 CYS B 121 -30.234 -8.700 -3.944 1.00 75.85 H ATOM 3134 N THR B 122 -28.790 -11.455 -1.836 1.00 71.03 N ANISOU 3134 N THR B 122 9485 9274 8230 -340 -80 407 ATOM 3135 CA THR B 122 -29.354 -12.522 -1.022 1.00 68.51 C ANISOU 3135 CA THR B 122 9168 8942 7922 -349 -50 420 ATOM 3136 C THR B 122 -29.758 -11.904 0.336 1.00 73.82 C ANISOU 3136 C THR B 122 9802 9640 8605 -349 -11 415 ATOM 3137 O THR B 122 -29.236 -10.841 0.702 1.00 72.96 O ANISOU 3137 O THR B 122 9670 9563 8487 -348 -4 392 ATOM 3138 CB THR B 122 -28.305 -13.661 -0.876 1.00 67.37 C ANISOU 3138 CB THR B 122 9079 8796 7721 -317 -27 443 ATOM 3139 OG1 THR B 122 -28.888 -14.883 -0.473 1.00 70.55 O ANISOU 3139 OG1 THR B 122 9510 9146 8148 -330 23 459 ATOM 3140 CG2 THR B 122 -27.116 -13.359 0.054 1.00 71.90 C ANISOU 3140 CG2 THR B 122 9649 9446 8225 -267 -5 450 ATOM 3141 H THR B 122 -28.144 -10.841 -1.342 1.00 71.03 H ATOM 3142 HA THR B 122 -30.257 -12.924 -1.485 1.00 68.51 H ATOM 3143 HB THR B 122 -27.895 -13.857 -1.863 1.00 67.37 H ATOM 3144 HG1 THR B 122 -29.089 -15.382 -1.290 1.00 70.55 H ATOM 3145 HG21 THR B 122 -26.406 -14.180 0.085 1.00 71.90 H ATOM 3146 HG22 THR B 122 -26.572 -12.478 -0.287 1.00 71.90 H ATOM 3147 HG23 THR B 122 -27.429 -13.182 1.080 1.00 71.90 H ATOM 3148 N CYS B 123 -30.717 -12.537 1.020 1.00 80.24 N ANISOU 3148 N CYS B 123 10615 10430 9442 -358 29 428 ATOM 3149 CA CYS B 123 -31.285 -12.070 2.278 1.00 76.23 C ANISOU 3149 CA CYS B 123 10081 9938 8944 -359 77 426 ATOM 3150 C CYS B 123 -30.635 -12.877 3.405 1.00 77.68 C ANISOU 3150 C CYS B 123 10305 10160 9051 -308 126 454 ATOM 3151 O CYS B 123 -30.797 -14.097 3.410 1.00 87.27 O ANISOU 3151 O CYS B 123 11571 11331 10258 -288 167 489 ATOM 3152 CB CYS B 123 -32.816 -12.284 2.282 1.00 79.64 C ANISOU 3152 CB CYS B 123 10485 10317 9458 -398 99 423 ATOM 3153 SG CYS B 123 -33.633 -11.678 3.781 1.00 77.14 S ANISOU 3153 SG CYS B 123 10132 10011 9167 -403 156 418 ATOM 3154 H CYS B 123 -31.002 -13.476 0.741 1.00 80.24 H ATOM 3155 HA CYS B 123 -31.089 -11.009 2.411 1.00 76.23 H ATOM 3156 HB3 CYS B 123 -33.051 -13.342 2.192 1.00 79.64 H ATOM 3157 HB2 CYS B 123 -33.284 -11.799 1.428 1.00 79.64 H ATOM 3158 N VAL B 124 -29.902 -12.210 4.300 1.00 72.70 N ANISOU 3158 N VAL B 124 9651 9614 8356 -283 131 435 ATOM 3159 CA VAL B 124 -29.213 -12.841 5.418 1.00 78.35 C ANISOU 3159 CA VAL B 124 10389 10416 8966 -210 166 460 ATOM 3160 C VAL B 124 -29.770 -12.349 6.761 1.00 79.79 C ANISOU 3160 C VAL B 124 10551 10630 9136 -211 214 449 ATOM 3161 O VAL B 124 -30.212 -11.202 6.870 1.00 78.89 O ANISOU 3161 O VAL B 124 10390 10506 9076 -272 213 400 ATOM 3162 CB VAL B 124 -27.678 -12.549 5.394 1.00 75.72 C ANISOU 3162 CB VAL B 124 10025 10203 8542 -176 126 426 ATOM 3163 CG1 VAL B 124 -26.986 -13.162 4.166 1.00 80.90 C ANISOU 3163 CG1 VAL B 124 10708 10817 9215 -176 87 438 ATOM 3164 CG2 VAL B 124 -27.285 -11.062 5.525 1.00 74.17 C ANISOU 3164 CG2 VAL B 124 9763 10062 8355 -237 115 341 ATOM 3165 H VAL B 124 -29.889 -11.192 4.283 1.00 72.70 H ATOM 3166 HA VAL B 124 -29.383 -13.911 5.382 1.00 78.35 H ATOM 3167 HB VAL B 124 -27.252 -13.060 6.261 1.00 75.72 H ATOM 3168 HG11 VAL B 124 -25.910 -12.981 4.179 1.00 80.90 H ATOM 3169 HG12 VAL B 124 -27.125 -14.239 4.120 1.00 80.90 H ATOM 3170 HG13 VAL B 124 -27.386 -12.742 3.243 1.00 80.90 H ATOM 3171 HG21 VAL B 124 -26.206 -10.923 5.450 1.00 74.17 H ATOM 3172 HG22 VAL B 124 -27.741 -10.457 4.741 1.00 74.17 H ATOM 3173 HG23 VAL B 124 -27.589 -10.648 6.484 1.00 74.17 H ATOM 3174 N THR B 125 -29.684 -13.218 7.773 1.00 87.63 N ANISOU 3174 N THR B 125 11588 11646 10061 -138 271 502 ATOM 3175 CA THR B 125 -29.875 -12.881 9.179 1.00 96.28 C ANISOU 3175 CA THR B 125 12674 12810 11097 -110 319 497 ATOM 3176 C THR B 125 -28.653 -12.040 9.643 1.00 83.90 C ANISOU 3176 C THR B 125 11043 11418 9417 -90 274 432 ATOM 3177 O THR B 125 -27.529 -12.441 9.321 1.00 86.18 O ANISOU 3177 O THR B 125 11321 11797 9625 -34 234 434 ATOM 3178 CB THR B 125 -29.850 -14.206 9.990 1.00 99.17 C ANISOU 3178 CB THR B 125 13123 13152 11405 -14 405 586 ATOM 3179 OG1 THR B 125 -28.678 -14.961 9.714 1.00105.92 O ANISOU 3179 OG1 THR B 125 14003 14076 12165 78 382 626 ATOM 3180 CG2 THR B 125 -31.046 -15.116 9.681 1.00 98.10 C ANISOU 3180 CG2 THR B 125 13041 12839 11393 -61 474 620 ATOM 3181 H THR B 125 -29.307 -14.150 7.621 1.00 87.63 H ATOM 3182 HA THR B 125 -30.833 -12.380 9.313 1.00 96.28 H ATOM 3183 HB THR B 125 -29.861 -13.966 11.057 1.00 99.17 H ATOM 3184 HG1 THR B 125 -27.925 -14.404 9.949 1.00105.92 H ATOM 3185 HG21 THR B 125 -31.014 -16.038 10.267 1.00 98.10 H ATOM 3186 HG22 THR B 125 -31.980 -14.611 9.929 1.00 98.10 H ATOM 3187 HG23 THR B 125 -31.071 -15.397 8.626 1.00 98.10 H ATOM 3188 N PRO B 126 -28.851 -10.909 10.356 1.00 79.87 N ANISOU 3188 N PRO B 126 10480 10960 8908 -148 284 356 ATOM 3189 CA PRO B 126 -27.761 -10.138 11.002 1.00 92.21 C ANISOU 3189 CA PRO B 126 11971 12702 10362 -151 260 263 ATOM 3190 C PRO B 126 -26.818 -10.954 11.910 1.00 88.91 C ANISOU 3190 C PRO B 126 11550 12466 9765 -24 258 291 ATOM 3191 O PRO B 126 -27.092 -12.116 12.203 1.00 90.76 O ANISOU 3191 O PRO B 126 11853 12662 9969 59 307 385 ATOM 3192 CB PRO B 126 -28.517 -9.080 11.829 1.00 89.21 C ANISOU 3192 CB PRO B 126 11560 12314 10022 -234 308 189 ATOM 3193 CG PRO B 126 -29.819 -8.875 11.080 1.00 89.69 C ANISOU 3193 CG PRO B 126 11658 12177 10243 -288 337 237 ATOM 3194 CD PRO B 126 -30.144 -10.281 10.600 1.00 92.85 C ANISOU 3194 CD PRO B 126 12122 12492 10663 -224 329 343 ATOM 3195 HA PRO B 126 -27.178 -9.664 10.212 1.00 92.21 H ATOM 3196 HB3 PRO B 126 -27.959 -8.153 11.960 1.00 89.21 H ATOM 3197 HB2 PRO B 126 -28.745 -9.464 12.825 1.00 89.21 H ATOM 3198 HG3 PRO B 126 -29.651 -8.236 10.213 1.00 89.69 H ATOM 3199 HG2 PRO B 126 -30.608 -8.422 11.682 1.00 89.69 H ATOM 3200 HD2 PRO B 126 -30.680 -10.840 11.368 1.00 92.85 H ATOM 3201 HD3 PRO B 126 -30.759 -10.228 9.705 1.00 92.85 H ATOM 3202 N ILE B 127 -25.728 -10.315 12.365 1.00 98.43 N ANISOU 3202 N ILE B 127 12673 13867 10859 -11 211 206 ATOM 3203 CA ILE B 127 -24.835 -10.876 13.402 1.00117.66 C ANISOU 3203 CA ILE B 127 15063 16551 13090 110 198 196 ATOM 3204 C ILE B 127 -25.097 -10.009 14.623 1.00106.69 C ANISOU 3204 C ILE B 127 13621 15265 11651 47 228 90 ATOM 3205 O ILE B 127 -25.681 -10.425 15.623 1.00 99.99 O ANISOU 3205 O ILE B 127 12834 14341 10815 67 284 148 ATOM 3206 CB ILE B 127 -23.325 -10.873 12.993 1.00123.61 C ANISOU 3206 CB ILE B 127 15725 17496 13746 144 130 129 ATOM 3207 CG1 ILE B 127 -23.080 -11.586 11.640 1.00122.15 C ANISOU 3207 CG1 ILE B 127 15584 17171 13657 146 106 193 ATOM 3208 CG2 ILE B 127 -22.424 -11.497 14.092 1.00127.54 C ANISOU 3208 CG2 ILE B 127 16185 18252 14022 321 109 163 ATOM 3209 CD1 ILE B 127 -21.605 -11.664 11.207 1.00130.41 C ANISOU 3209 CD1 ILE B 127 16555 18401 14595 220 50 163 ATOM 3210 H ILE B 127 -25.584 -9.349 12.096 1.00 98.43 H ATOM 3211 HA ILE B 127 -25.104 -11.909 13.647 1.00117.66 H ATOM 3212 HXT ILE B 127 -24.735 -8.981 14.556 1.00106.69 H ATOM 3213 HB ILE B 127 -23.010 -9.835 12.863 1.00123.61 H ATOM 3214 HG13 ILE B 127 -23.647 -11.092 10.851 1.00122.15 H ATOM 3215 HG12 ILE B 127 -23.477 -12.599 11.697 1.00122.15 H ATOM 3216 HG21 ILE B 127 -21.364 -11.392 13.858 1.00127.54 H ATOM 3217 HG22 ILE B 127 -22.569 -11.032 15.068 1.00127.54 H ATOM 3218 HG23 ILE B 127 -22.626 -12.563 14.211 1.00127.54 H ATOM 3219 HD11 ILE B 127 -21.507 -11.796 10.130 1.00130.41 H ATOM 3220 HD12 ILE B 127 -21.053 -10.763 11.477 1.00130.41 H ATOM 3221 HD13 ILE B 127 -21.101 -12.517 11.667 1.00130.41 H TER 3222 ILE B 127 HETATM 3223 C23 RMK B 201 -11.399 -15.885 -18.307 1.00115.62 C HETATM 3224 C24 RMK B 201 -12.532 -12.362 -19.414 1.00 97.77 C HETATM 3225 C25 RMK B 201 -12.083 -12.339 -20.859 1.00105.88 C HETATM 3226 C21 RMK B 201 -11.505 -14.383 -18.428 1.00116.44 C HETATM 3227 C14 RMK B 201 -14.125 -16.354 -14.961 1.00 97.35 C HETATM 3228 C15 RMK B 201 -14.130 -17.439 -15.791 1.00117.17 C HETATM 3229 C16 RMK B 201 -14.300 -18.522 -14.888 1.00116.33 C HETATM 3230 C13 RMK B 201 -13.950 -14.954 -15.415 1.00 88.26 C HETATM 3231 C12 RMK B 201 -17.747 -11.403 -17.921 1.00 83.49 C HETATM 3232 C11 RMK B 201 -18.953 -10.705 -17.730 1.00 88.35 C HETATM 3233 N3 RMK B 201 -13.851 -14.762 -16.738 1.00104.38 N HETATM 3234 C4 RMK B 201 -17.764 -8.963 -16.535 1.00 84.35 C HETATM 3235 C5 RMK B 201 -18.978 -9.495 -17.011 1.00 89.65 C HETATM 3236 C2 RMK B 201 -16.532 -10.903 -17.387 1.00 79.14 C HETATM 3237 O1 RMK B 201 -13.900 -14.027 -14.611 1.00 95.89 O HETATM 3238 N5 RMK B 201 -14.300 -16.784 -13.652 1.00109.55 N HETATM 3239 C17 RMK B 201 -14.337 -16.033 -12.394 1.00106.49 C HETATM 3240 C19 RMK B 201 -15.245 -16.685 -11.336 1.00107.54 C HETATM 3241 C18 RMK B 201 -12.913 -15.814 -11.859 1.00114.16 C HETATM 3242 N4 RMK B 201 -14.377 -18.136 -13.625 1.00110.96 N HETATM 3243 C RMK B 201 -13.656 -13.470 -17.396 1.00 92.37 C HETATM 3244 C20 RMK B 201 -12.832 -13.679 -18.704 1.00104.49 C HETATM 3245 C26 RMK B 201 -13.437 -11.794 -20.481 1.00107.33 C HETATM 3246 C22 RMK B 201 -10.794 -15.183 -19.498 1.00114.97 C HETATM 3247 C1 RMK B 201 -15.058 -12.898 -17.707 1.00 91.38 C HETATM 3248 O RMK B 201 -15.900 -13.631 -18.211 1.00 91.38 O HETATM 3249 N RMK B 201 -15.289 -11.607 -17.412 1.00 81.94 N HETATM 3250 C3 RMK B 201 -16.552 -9.654 -16.731 1.00 78.68 C HETATM 3251 C6 RMK B 201 -20.255 -8.830 -16.734 1.00107.25 C HETATM 3252 C9 RMK B 201 -21.032 -8.052 -17.638 1.00115.48 C HETATM 3253 C10 RMK B 201 -20.733 -7.689 -19.062 1.00120.71 C HETATM 3254 N2 RMK B 201 -22.150 -7.627 -17.066 1.00107.00 N HETATM 3255 N1 RMK B 201 -22.092 -8.122 -15.811 1.00110.28 N HETATM 3256 C7 RMK B 201 -20.957 -8.861 -15.563 1.00121.83 C HETATM 3257 C8 RMK B 201 -20.681 -9.520 -14.251 1.00 95.28 C HETATM 3258 H231 RMK B 201 -10.722 -16.280 -17.552 1.00115.62 H HETATM 3259 H232 RMK B 201 -12.300 -16.468 -18.478 1.00115.62 H HETATM 3260 HC24 RMK B 201 -12.050 -11.629 -18.768 1.00 97.77 H HETATM 3261 H251 RMK B 201 -11.309 -11.627 -21.134 1.00105.88 H HETATM 3262 H252 RMK B 201 -12.064 -13.276 -21.410 1.00105.88 H HETATM 3263 HC21 RMK B 201 -10.851 -13.814 -17.770 1.00116.44 H HETATM 3264 HC15 RMK B 201 -14.027 -17.474 -16.866 1.00117.17 H HETATM 3265 HC16 RMK B 201 -14.349 -19.578 -15.110 1.00116.33 H HETATM 3266 HC12 RMK B 201 -17.805 -12.335 -18.458 1.00 83.49 H HETATM 3267 HC11 RMK B 201 -19.875 -11.124 -18.108 1.00 88.35 H HETATM 3268 HC4 RMK B 201 -17.767 -8.033 -15.987 1.00 84.35 H HETATM 3269 HC17 RMK B 201 -14.783 -15.061 -12.596 1.00106.49 H HETATM 3270 H191 RMK B 201 -15.321 -16.048 -10.455 1.00107.54 H HETATM 3271 H192 RMK B 201 -16.256 -16.831 -11.719 1.00107.54 H HETATM 3272 H193 RMK B 201 -14.865 -17.653 -11.011 1.00107.54 H HETATM 3273 H181 RMK B 201 -12.925 -15.227 -10.941 1.00114.16 H HETATM 3274 H182 RMK B 201 -12.421 -16.763 -11.644 1.00114.16 H HETATM 3275 H183 RMK B 201 -12.300 -15.278 -12.584 1.00114.16 H HETATM 3276 HXT RMK B 201 -13.103 -12.827 -16.720 1.00 92.37 H HETATM 3277 HC20 RMK B 201 -13.406 -14.309 -19.388 1.00104.49 H HETATM 3278 H261 RMK B 201 -14.300 -12.384 -20.774 1.00107.33 H HETATM 3279 H262 RMK B 201 -13.570 -10.715 -20.514 1.00107.33 H HETATM 3280 H221 RMK B 201 -11.291 -15.326 -20.455 1.00114.97 H HETATM 3281 H222 RMK B 201 -9.708 -15.112 -19.544 1.00114.97 H HETATM 3282 HC3 RMK B 201 -15.641 -9.240 -16.322 1.00 78.68 H HETATM 3283 H101 RMK B 201 -20.755 -8.571 -19.702 1.00120.71 H HETATM 3284 H102 RMK B 201 -21.453 -6.971 -19.457 1.00120.71 H HETATM 3285 H103 RMK B 201 -19.742 -7.241 -19.147 1.00120.71 H HETATM 3286 H8_1 RMK B 201 -19.666 -9.305 -13.915 1.00 95.28 H HETATM 3287 H8_2 RMK B 201 -21.370 -9.180 -13.478 1.00 95.28 H HETATM 3288 H8_3 RMK B 201 -20.779 -10.603 -14.336 1.00 95.28 H HETATM 3289 HN3 RMK B 201 -13.983 -15.557 -17.350 1.00104.38 H HETATM 3290 HN RMK B 201 -14.495 -11.113 -17.011 1.00 81.94 H HETATM 3291 HN1 RMK B 201 -22.827 -7.948 -15.140 1.00110.28 H HETATM 3292 O HOH A 207 -24.151 -8.619 -12.822 0.50 81.99 O HETATM 3293 H1 HOH A 207 -23.775 -7.785 -13.260 1.00 81.99 H HETATM 3294 H2 HOH A 207 -23.490 -8.848 -12.091 1.00 81.99 H HETATM 3295 O HOH A 211 -13.941 -19.814 -9.652 1.00 91.47 O HETATM 3296 H1 HOH A 211 -13.263 -20.096 -10.337 1.00 91.47 H HETATM 3297 H2 HOH A 211 -13.785 -18.845 -9.443 1.00 91.47 H HETATM 3298 O HOH B 315 -17.781 -9.043 -24.667 1.00108.42 O HETATM 3299 H1 HOH B 315 -16.983 -9.644 -24.552 1.00108.42 H HETATM 3300 H2 HOH B 315 -18.100 -8.761 -23.761 1.00108.42 H HETATM 3301 O HOH B 327 -26.592 -9.283 -13.817 0.50 81.65 O HETATM 3302 H1 HOH B 327 -25.740 -9.037 -13.266 1.00 81.65 H HETATM 3303 H2 HOH B 327 -26.216 -9.714 -14.636 1.00 81.65 H CONECT 171 181 CONECT 701 1516 CONECT 778 1540 CONECT 1516 701 CONECT 1540 778 CONECT 1591 1599 CONECT 1780 1790 CONECT 2320 3129 CONECT 2397 3153 CONECT 3129 2320 CONECT 3153 2397 CONECT 3204 3212 CONECT 3292 3293 3294 CONECT 3295 3296 3297 CONECT 3298 3299 3300 CONECT 3301 3302 3303 CONECT 1599 1591 CONECT 3212 3204 CONECT 3293 3292 CONECT 3294 3292 CONECT 3296 3295 CONECT 3297 3295 CONECT 3299 3298 CONECT 3300 3298 CONECT 3302 3301 CONECT 3303 3301 CONECT 181 171 CONECT 1790 1780 CONECT 3223 3226 3246 3258 3259 CONECT 3224 3225 3244 3245 3260 CONECT 3225 3224 3245 3261 3262 CONECT 3226 3223 3244 3246 3263 CONECT 3227 3228 3230 3238 CONECT 3227 3228 CONECT 3228 3227 3229 3264 CONECT 3228 3227 CONECT 3229 3228 3242 3265 CONECT 3229 3242 CONECT 3230 3227 3233 3237 CONECT 3230 3237 CONECT 3231 3232 3236 3266 CONECT 3231 3232 CONECT 3232 3231 3235 3267 CONECT 3232 3231 CONECT 3233 3230 3243 3289 CONECT 3234 3235 3250 3268 CONECT 3234 3235 CONECT 3235 3232 3234 3251 CONECT 3235 3234 CONECT 3236 3231 3249 3250 CONECT 3236 3250 CONECT 3237 3230 CONECT 3237 3230 CONECT 3238 3227 3239 3242 CONECT 3239 3238 3240 3241 3269 CONECT 3240 3239 3270 3271 3272 CONECT 3241 3239 3273 3274 3275 CONECT 3242 3229 3238 CONECT 3242 3229 CONECT 3243 3233 3244 3247 3276 CONECT 3244 3224 3226 3243 3277 CONECT 3245 3224 3225 3278 3279 CONECT 3246 3223 3226 3280 3281 CONECT 3247 3243 3248 3249 CONECT 3247 3248 CONECT 3248 3247 CONECT 3248 3247 CONECT 3249 3236 3247 3290 CONECT 3250 3234 3236 3282 CONECT 3250 3236 CONECT 3251 3235 3252 3256 CONECT 3251 3256 CONECT 3252 3251 3253 3254 CONECT 3252 3254 CONECT 3253 3252 3283 3284 3285 CONECT 3254 3252 3255 CONECT 3254 3252 CONECT 3255 3254 3256 3291 CONECT 3256 3251 3255 3257 CONECT 3256 3251 CONECT 3257 3256 3286 3287 3288 CONECT 3258 3223 CONECT 3259 3223 CONECT 3260 3224 CONECT 3261 3225 CONECT 3262 3225 CONECT 3263 3226 CONECT 3264 3228 CONECT 3265 3229 CONECT 3266 3231 CONECT 3267 3232 CONECT 3268 3234 CONECT 3269 3239 CONECT 3270 3240 CONECT 3271 3240 CONECT 3272 3240 CONECT 3273 3241 CONECT 3274 3241 CONECT 3275 3241 CONECT 3276 3243 CONECT 3277 3244 CONECT 3278 3245 CONECT 3279 3245 CONECT 3280 3246 CONECT 3281 3246 CONECT 3282 3250 CONECT 3283 3253 CONECT 3284 3253 CONECT 3285 3253 CONECT 3286 3257 CONECT 3287 3257 CONECT 3288 3257 CONECT 3289 3233 CONECT 3290 3249 CONECT 3291 3255 END If you find results from this site helpful for your research, please cite one of our papers:
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