TITLE SWISS-MODEL SERVER (https://swissmodel.expasy.org) TITLE 2 Multiple target project EXPDTA THEORETICAL MODEL (SWISS-MODEL SERVER) AUTHOR SWISS-MODEL SERVER (SEE REFERENCE IN JRNL Records) REVDAT 1 30-JUN-20 1MOD 1 08:53 JRNL AUTH A.WATERHOUSE,M.BERTONI,S.BIENERT,G.STUDER,G.TAURIELLO, JRNL AUTH 2 R.GUMIENNY,F.T.HEER,T.A.P.DE BEER,C.REMPFER,L.BORDOLI, JRNL AUTH 3 R.LEPORE,T.SCHWEDE JRNL TITL SWISS-MODEL: HOMOLOGY MODELLING OF PROTEIN STRUCTURES AND JRNL TITL 2 COMPLEXES JRNL REF NUCLEIC.ACIDS.RES.. V. 46 W296 2018 JRNL PMID 29788355 JRNL DOI 10.1093/nar/gky427 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH S.BIENERT,A.WATERHOUSE,T.A.P.DE BEER,G.TAURIELLO,G.STUDER, REMARK 1 AUTH 2 L.BORDOLI,T.SCHWEDE REMARK 1 TITL THE SWISS-MODEL REPOSITORY - NEW FEATURES AND FUNCTIONALITY REMARK 1 REF NUCLEIC.ACIDS.RES.. V. 22 2017 REMARK 1 REFN ISSN 0305-1048 REMARK 1 PMID 27899672 REMARK 1 DOI 10.1093/nar/gkw1132 REMARK 1 REMARK 1 REFERENCE 2 REMARK 1 AUTH N.GUEX,M.C.PEITSCH,T.SCHWEDE REMARK 1 TITL AUTOMATED COMPARATIVE PROTEIN STRUCTURE MODELING WITH REMARK 1 TITL 2 SWISS-MODEL AND SWISS-PDBVIEWER: A HISTORICAL PERSPECTIVE REMARK 1 REF ELECTROPHORESIS V. 30 2009 REMARK 1 REFN ISSN 0173-0835 REMARK 1 PMID 19517507 REMARK 1 DOI 10.1002/elps.200900140 REMARK 1 REMARK 1 REFERENCE 3 REMARK 1 AUTH P.BENKERT,M.BIASINI,T.SCHWEDE REMARK 1 TITL TOWARD THE ESTIMATION OF THE ABSOLUTE QUALITY OF INDIVIDUAL REMARK 1 TITL 2 PROTEIN STRUCTURE MODELS REMARK 1 REF BIOINFORMATICS V. 27 2011 REMARK 1 REFN ISSN 1367-4803 REMARK 1 PMID 21134891 REMARK 1 DOI 10.1093/bioinformatics/btq662 REMARK 1 REMARK 1 REFERENCE 4 REMARK 1 AUTH M.BERTONI,F.KIEFER,M.BIASINI,L.BORDOLI,T.SCHWEDE REMARK 1 TITL MODELING PROTEIN QUATERNARY STRUCTURE OF HOMO- AND REMARK 1 TITL 2 HETERO-OLIGOMERS BEYOND BINARY INTERACTIONS BY HOMOLOGY REMARK 1 REF SCI.REP. V. 7 2017 REMARK 1 REFN ISSN REMARK 1 PMID 28874689 REMARK 1 DOI 10.1038/s41598-017-09654-8 REMARK 1 REMARK 1 DISCLAIMER REMARK 1 The SWISS-MODEL SERVER produces theoretical models for proteins. REMARK 1 The results of any theoretical modelling procedure is REMARK 1 NON-EXPERIMENTAL and MUST be considered with care. These models may REMARK 1 contain significant errors. This is especially true for automated REMARK 1 modeling since there is no human intervention during model REMARK 1 building. Please read the header section and the logfile carefully REMARK 1 to know what templates and alignments were used during the model REMARK 1 building process. All information by the SWISS-MODEL SERVER is REMARK 1 provided "AS-IS", without any warranty, expressed or implied. REMARK 2 REMARK 2 COPYRIGHT NOTICE REMARK 2 This SWISS-MODEL protein model is copyright. It is produced by the REMARK 2 SWISS-MODEL server, developed by the Computational Structural REMARK 2 Biology Group at the SIB Swiss Institute of Bioinformatics at the REMARK 2 Biozentrum, University of Basel (https://swissmodel.expasy.org). This REMARK 2 model is licensed under the CC BY-SA 4.0 Creative Commons REMARK 2 Attribution-ShareAlike 4.0 International License REMARK 2 (https://creativecommons.org/licenses/by-sa/4.0/legalcode), i.e. you REMARK 2 can copy and redistribute the model in any medium or format, REMARK 2 transform and build upon the model for any purpose, even REMARK 2 commercially, under the following terms: REMARK 2 Attribution - You must give appropriate credit, provide a link to REMARK 2 the license, and indicate if changes were made. You may do so in any REMARK 2 reasonable manner, but not in any way that suggests the licensor REMARK 2 endorses you or your use. When you publish, patent or distribute REMARK 2 results that were fully or partially based on the model, please cite REMARK 2 the corresponding papers mentioned under JRNL. REMARK 2 ShareAlike - If you remix, transform, or build upon the material, REMARK 2 you must distribute your contributions under the same license as the REMARK 2 original. REMARK 2 No additional restrictions - you may not apply legal terms or REMARK 2 technological measures that legally restrict others from doing REMARK 2 anything the license permits. REMARK 2 Find a human-readable summary of (and not a substitute for) the REMARK 2 CC BY-SA 4.0 license at this link: REMARK 2 https://creativecommons.org/licenses/by-sa/4.0/ REMARK 3 REMARK 3 MODEL INFORMATION REMARK 3 ENGIN PROMOD3 REMARK 3 VERSN 3.0.0 REMARK 3 OSTAT hetero-1-1-mer REMARK 3 OSRSN TEMPLATE REMARK 3 QSPRD 0.876 REMARK 3 GMQE 0.88 REMARK 3 QMN4 -0.57 REMARK 3 MODT FALSE REMARK 3 REMARK 3 MODEL LIGAND 1 REMARK 3 NAME 32M REMARK 3 BIND A.57 REMARK 3 BIND 2 A.88 REMARK 3 BIND 3 A.97 REMARK 3 BIND 4 _.1 REMARK 3 REMARK 3 TEMPLATE 1 REMARK 3 PDBID 4zgm REMARK 3 CHAIN B REMARK 3 MMCIF B REMARK 3 CHAIN A REMARK 3 MMCIF A REMARK 3 PDBV 2020-06-19 REMARK 3 SMTLE 4zgm.1 REMARK 3 SMTLV 2020-06-24 REMARK 3 MTHD X-RAY DIFFRACTION 1.80 A REMARK 3 FOUND HHblits REMARK 3 GMQE 0.88 REMARK 3 SIM 0.63 REMARK 3 SID 98.69 REMARK 3 OSTAT hetero-1-1-mer REMARK 3 LIGND 32M REMARK 3 LIGND 2 32M REMARK 3 ALN B TRG HAEGTFTSDVSSYLEGQAAKEFIAWLRVGRG REMARK 3 ALN B TPL HAEGTFTSDVSSYLEGQAAKEFIAWLVRGRG REMARK 3 ALN B OFF 0 REMARK 3 ALN A TRG RPQGATVSLWETVQKWREYRRQCQRSLTEDPPPATDLFCNRTFDEYACWPDGEPGSFV REMARK 3 ALN A TRG NVSCPWYLPWASSVPQGHVYRFCTAEGLWLQKDNSSLPWRDLSECEESKRGERSSPEE REMARK 3 ALN A TRG QLLFLY REMARK 3 ALN A TPL RPQGATVSLWETVQKWREYRRQCQRSLTEDPPPATDLFCNRTFDEYACWPDGEPGSFV REMARK 3 ALN A TPL NVSCPWYLPWASSVPQGHVYRFCTAEGLWLQKDNSSLPWRDLSECEESKRGERSSPEE REMARK 3 ALN A TPL QLLFLY REMARK 3 ALN A OFF 0 HELIX 1 1 LEU A 9 GLU A 29 1 21 HELIX 2 2 ALA A 69 SER A 71 1 3 HELIX 3 3 SER A 101 CYS A 103 1 3 HELIX 4 4 THR B 7 VAL B 28 1 22 SHEET 1 1 1 SER A 56 SER A 61 0 SHEET 2 2 1 HIS A 76 CYS A 81 0 ATOM 1 N THR A 6 4.325 40.189 28.174 1.00 0.73 N ATOM 2 CA THR A 6 4.257 40.703 26.791 1.00 0.73 C ATOM 3 C THR A 6 5.672 41.010 26.307 1.00 0.73 C ATOM 4 O THR A 6 6.600 40.674 27.039 1.00 0.73 O ATOM 5 CB THR A 6 3.269 41.861 26.703 1.00 0.73 C ATOM 6 OG1 THR A 6 3.092 42.189 25.349 1.00 0.73 O ATOM 7 CG2 THR A 6 3.663 43.088 27.525 1.00 0.73 C ATOM 8 HA THR A 6 3.882 39.916 26.138 1.00 0.00 H ATOM 9 HB THR A 6 2.310 41.502 27.067 1.00 0.00 H ATOM 10 HG1 THR A 6 2.155 42.379 25.204 1.00 0.00 H ATOM 11 HG21 THR A 6 2.941 43.895 27.364 1.00 0.00 H ATOM 12 HG22 THR A 6 3.651 42.840 28.586 1.00 0.00 H ATOM 13 HG23 THR A 6 4.658 43.453 27.251 1.00 0.00 H ATOM 14 H1 THR A 6 3.409 39.901 28.497 1.00 0.00 H ATOM 15 H2 THR A 6 4.696 40.910 28.788 1.00 0.00 H ATOM 16 H3 THR A 6 4.971 39.406 28.202 1.00 0.00 H ATOM 17 N VAL A 7 5.856 41.325 25.020 1.00 0.77 N ATOM 18 CA VAL A 7 7.182 41.574 24.422 1.00 0.77 C ATOM 19 C VAL A 7 7.716 42.898 24.980 1.00 0.77 C ATOM 20 O VAL A 7 6.983 43.888 24.980 1.00 0.77 O ATOM 21 CB VAL A 7 7.092 41.665 22.884 1.00 0.77 C ATOM 22 CG1 VAL A 7 8.461 41.894 22.233 1.00 0.77 C ATOM 23 CG2 VAL A 7 6.473 40.413 22.246 1.00 0.77 C ATOM 24 H VAL A 7 5.057 41.670 24.505 1.00 0.00 H ATOM 25 HA VAL A 7 7.873 40.771 24.687 1.00 0.00 H ATOM 26 HB VAL A 7 6.454 42.510 22.632 1.00 0.00 H ATOM 27 HG11 VAL A 7 8.899 42.827 22.582 1.00 0.00 H ATOM 28 HG12 VAL A 7 9.125 41.068 22.475 1.00 0.00 H ATOM 29 HG13 VAL A 7 8.358 41.950 21.151 1.00 0.00 H ATOM 30 HG21 VAL A 7 6.490 40.507 21.159 1.00 0.00 H ATOM 31 HG22 VAL A 7 5.432 40.306 22.547 1.00 0.00 H ATOM 32 HG23 VAL A 7 7.036 39.522 22.531 1.00 0.00 H ATOM 33 N SER A 8 8.928 42.921 25.545 1.00 0.71 N ATOM 34 CA SER A 8 9.469 44.160 26.130 1.00 0.71 C ATOM 35 C SER A 8 10.131 45.065 25.074 1.00 0.71 C ATOM 36 O SER A 8 10.618 44.606 24.027 1.00 0.71 O ATOM 37 CB SER A 8 10.373 43.868 27.337 1.00 0.71 C ATOM 38 OG SER A 8 11.728 43.644 26.965 1.00 0.71 O ATOM 39 H SER A 8 9.498 42.083 25.516 1.00 0.00 H ATOM 40 HA SER A 8 8.636 44.725 26.531 1.00 0.00 H ATOM 41 HB2 SER A 8 10.327 44.708 28.025 1.00 0.00 H ATOM 42 HB3 SER A 8 9.994 42.991 27.860 1.00 0.00 H ATOM 43 HG SER A 8 12.035 42.887 27.480 1.00 0.00 H ATOM 44 N LEU A 9 10.314 46.343 25.438 1.00 0.74 N ATOM 45 CA LEU A 9 11.190 47.266 24.711 1.00 0.74 C ATOM 46 C LEU A 9 12.596 46.676 24.531 1.00 0.74 C ATOM 47 O LEU A 9 13.135 46.698 23.429 1.00 0.74 O ATOM 48 CB LEU A 9 11.241 48.611 25.467 1.00 0.74 C ATOM 49 CG LEU A 9 12.301 49.605 24.942 1.00 0.74 C ATOM 50 CD1 LEU A 9 12.068 49.991 23.486 1.00 0.74 C ATOM 51 CD2 LEU A 9 12.290 50.888 25.771 1.00 0.74 C ATOM 52 H LEU A 9 9.832 46.684 26.257 1.00 0.00 H ATOM 53 HA LEU A 9 10.774 47.436 23.716 1.00 0.00 H ATOM 54 HB2 LEU A 9 10.257 49.079 25.416 1.00 0.00 H ATOM 55 HB3 LEU A 9 11.463 48.411 26.517 1.00 0.00 H ATOM 56 HG LEU A 9 13.294 49.162 25.032 1.00 0.00 H ATOM 57 HD11 LEU A 9 12.103 49.118 22.837 1.00 0.00 H ATOM 58 HD12 LEU A 9 12.829 50.698 23.160 1.00 0.00 H ATOM 59 HD13 LEU A 9 11.094 50.460 23.389 1.00 0.00 H ATOM 60 HD21 LEU A 9 12.488 50.661 26.818 1.00 0.00 H ATOM 61 HD22 LEU A 9 13.062 51.566 25.406 1.00 0.00 H ATOM 62 HD23 LEU A 9 11.321 51.380 25.682 1.00 0.00 H ATOM 63 N TRP A 10 13.189 46.116 25.591 1.00 0.73 N ATOM 64 CA TRP A 10 14.573 45.639 25.536 1.00 0.73 C ATOM 65 C TRP A 10 14.755 44.399 24.659 1.00 0.73 C ATOM 66 O TRP A 10 15.676 44.381 23.842 1.00 0.73 O ATOM 67 CB TRP A 10 15.121 45.416 26.946 1.00 0.73 C ATOM 68 CG TRP A 10 16.543 44.940 26.984 1.00 0.73 C ATOM 69 CD1 TRP A 10 16.952 43.786 27.556 1.00 0.73 C ATOM 70 CD2 TRP A 10 17.749 45.545 26.407 1.00 0.73 C ATOM 71 NE1 TRP A 10 18.312 43.636 27.390 1.00 0.73 N ATOM 72 CE2 TRP A 10 18.854 44.680 26.675 1.00 0.73 C ATOM 73 CE3 TRP A 10 18.031 46.716 25.664 1.00 0.73 C ATOM 74 CZ2 TRP A 10 20.160 44.956 26.241 1.00 0.73 C ATOM 75 CZ3 TRP A 10 19.340 47.010 25.229 1.00 0.73 C ATOM 76 CH2 TRP A 10 20.405 46.137 25.521 1.00 0.73 C ATOM 77 H TRP A 10 12.668 46.018 26.449 1.00 0.00 H ATOM 78 HA TRP A 10 15.171 46.417 25.069 1.00 0.00 H ATOM 79 HB2 TRP A 10 14.495 44.674 27.445 1.00 0.00 H ATOM 80 HB3 TRP A 10 15.049 46.347 27.510 1.00 0.00 H ATOM 81 HD1 TRP A 10 16.298 43.075 28.046 1.00 0.00 H ATOM 82 HE3 TRP A 10 17.227 47.402 25.441 1.00 0.00 H ATOM 83 HZ2 TRP A 10 20.961 44.280 26.494 1.00 0.00 H ATOM 84 HZ3 TRP A 10 19.527 47.928 24.690 1.00 0.00 H ATOM 85 HH2 TRP A 10 21.411 46.391 25.220 1.00 0.00 H ATOM 86 HE1 TRP A 10 18.809 42.810 27.685 1.00 0.00 H ATOM 87 N GLU A 11 13.779 43.480 24.637 1.00 0.76 N ATOM 88 CA GLU A 11 13.780 42.379 23.652 1.00 0.76 C ATOM 89 C GLU A 11 13.727 42.932 22.217 1.00 0.76 C ATOM 90 O GLU A 11 14.558 42.578 21.377 1.00 0.76 O ATOM 91 CB GLU A 11 12.618 41.406 23.907 1.00 0.76 C ATOM 92 CG GLU A 11 12.596 40.258 22.903 1.00 0.76 C ATOM 93 CD GLU A 11 11.298 39.449 23.025 1.00 0.76 C ATOM 94 OE1 GLU A 11 11.051 38.696 22.052 1.00 0.76 O ATOM 95 OE2 GLU A 11 10.514 39.692 23.976 1.00 0.76 O ATOM 96 H GLU A 11 12.972 43.591 25.244 1.00 0.00 H ATOM 97 HA GLU A 11 14.718 41.828 23.755 1.00 0.00 H ATOM 98 HB2 GLU A 11 12.713 40.984 24.909 1.00 0.00 H ATOM 99 HB3 GLU A 11 11.677 41.960 23.842 1.00 0.00 H ATOM 100 HG2 GLU A 11 13.459 39.628 23.067 1.00 0.00 H ATOM 101 HG3 GLU A 11 12.687 40.643 21.896 1.00 0.00 H ATOM 102 N THR A 12 12.823 43.884 21.972 1.00 0.83 N ATOM 103 CA THR A 12 12.614 44.492 20.650 1.00 0.83 C ATOM 104 C THR A 12 13.863 45.232 20.155 1.00 0.83 C ATOM 105 O THR A 12 14.325 44.985 19.041 1.00 0.83 O ATOM 106 CB THR A 12 11.412 45.445 20.687 1.00 0.83 C ATOM 107 OG1 THR A 12 10.291 44.768 21.208 1.00 0.83 O ATOM 108 CG2 THR A 12 11.027 45.936 19.294 1.00 0.83 C ATOM 109 H THR A 12 12.196 44.142 22.726 1.00 0.00 H ATOM 110 HA THR A 12 12.389 43.702 19.934 1.00 0.00 H ATOM 111 HB THR A 12 11.639 46.303 21.319 1.00 0.00 H ATOM 112 HG1 THR A 12 10.430 44.617 22.156 1.00 0.00 H ATOM 113 HG21 THR A 12 10.114 46.531 19.358 1.00 0.00 H ATOM 114 HG22 THR A 12 10.852 45.084 18.636 1.00 0.00 H ATOM 115 HG23 THR A 12 11.822 46.551 18.879 1.00 0.00 H ATOM 116 N VAL A 13 14.547 45.965 21.044 1.00 0.81 N ATOM 117 CA VAL A 13 15.837 46.624 20.764 1.00 0.81 C ATOM 118 C VAL A 13 16.951 45.609 20.484 1.00 0.81 C ATOM 119 O VAL A 13 17.776 45.838 19.597 1.00 0.81 O ATOM 120 CB VAL A 13 16.237 47.562 21.926 1.00 0.81 C ATOM 121 CG1 VAL A 13 17.660 48.129 21.783 1.00 0.81 C ATOM 122 CG2 VAL A 13 15.304 48.775 22.018 1.00 0.81 C ATOM 123 H VAL A 13 14.127 46.098 21.961 1.00 0.00 H ATOM 124 HA VAL A 13 15.722 47.229 19.865 1.00 0.00 H ATOM 125 HB VAL A 13 16.184 47.008 22.864 1.00 0.00 H ATOM 126 HG21 VAL A 13 14.265 48.458 22.069 1.00 0.00 H ATOM 127 HG22 VAL A 13 15.531 49.354 22.914 1.00 0.00 H ATOM 128 HG23 VAL A 13 15.421 49.410 21.142 1.00 0.00 H ATOM 129 HG11 VAL A 13 18.395 47.332 21.885 1.00 0.00 H ATOM 130 HG12 VAL A 13 17.767 48.611 20.810 1.00 0.00 H ATOM 131 HG13 VAL A 13 17.842 48.864 22.568 1.00 0.00 H ATOM 132 N GLN A 14 17.010 44.484 21.206 1.00 0.84 N ATOM 133 CA GLN A 14 18.002 43.434 20.941 1.00 0.84 C ATOM 134 C GLN A 14 17.770 42.747 19.587 1.00 0.84 C ATOM 135 O GLN A 14 18.719 42.644 18.806 1.00 0.84 O ATOM 136 CB GLN A 14 18.024 42.405 22.081 1.00 0.84 C ATOM 137 CG GLN A 14 18.635 42.961 23.376 1.00 0.84 C ATOM 138 CD GLN A 14 18.563 41.931 24.498 1.00 0.84 C ATOM 139 OE1 GLN A 14 17.518 41.569 25.002 1.00 0.84 O ATOM 140 NE2 GLN A 14 19.663 41.303 24.855 1.00 0.84 N ATOM 141 H GLN A 14 16.301 44.319 21.919 1.00 0.00 H ATOM 142 HA GLN A 14 18.987 43.895 20.885 1.00 0.00 H ATOM 143 HB2 GLN A 14 17.010 42.055 22.278 1.00 0.00 H ATOM 144 HB3 GLN A 14 18.623 41.548 21.768 1.00 0.00 H ATOM 145 HG2 GLN A 14 19.674 43.237 23.196 1.00 0.00 H ATOM 146 HG3 GLN A 14 18.106 43.857 23.692 1.00 0.00 H ATOM 147 HE21 GLN A 14 20.519 41.449 24.362 1.00 0.00 H ATOM 148 HE22 GLN A 14 19.509 40.529 25.478 1.00 0.00 H ATOM 149 N LYS A 15 16.513 42.442 19.235 1.00 0.91 N ATOM 150 CA LYS A 15 16.146 41.896 17.918 1.00 0.91 C ATOM 151 C LYS A 15 16.439 42.881 16.781 1.00 0.91 C ATOM 152 O LYS A 15 17.165 42.527 15.857 1.00 0.91 O ATOM 153 CB LYS A 15 14.666 41.477 17.915 1.00 0.91 C ATOM 154 CG LYS A 15 14.384 40.231 18.769 1.00 0.91 C ATOM 155 CD LYS A 15 12.902 39.834 18.666 1.00 0.91 C ATOM 156 CE LYS A 15 12.654 38.517 19.399 1.00 0.91 C ATOM 157 NZ LYS A 15 11.203 38.222 19.495 1.00 0.91 N ATOM 158 H LYS A 15 15.773 42.603 19.919 1.00 0.00 H ATOM 159 HA LYS A 15 16.756 41.014 17.715 1.00 0.00 H ATOM 160 HB2 LYS A 15 14.048 42.305 18.270 1.00 0.00 H ATOM 161 HB3 LYS A 15 14.380 41.243 16.890 1.00 0.00 H ATOM 162 HG2 LYS A 15 15.002 39.404 18.415 1.00 0.00 H ATOM 163 HG3 LYS A 15 14.636 40.432 19.813 1.00 0.00 H ATOM 164 HD2 LYS A 15 12.293 40.634 19.099 1.00 0.00 H ATOM 165 HD3 LYS A 15 12.627 39.699 17.616 1.00 0.00 H ATOM 166 HE2 LYS A 15 13.045 38.621 20.414 1.00 0.00 H ATOM 167 HE3 LYS A 15 13.209 37.712 18.907 1.00 0.00 H ATOM 168 HZ1 LYS A 15 10.648 38.547 18.711 1.00 0.00 H ATOM 169 HZ2 LYS A 15 10.874 38.710 20.335 1.00 0.00 H ATOM 170 HZ3 LYS A 15 11.033 37.256 19.737 1.00 0.00 H ATOM 171 N TRP A 16 16.106 44.162 16.960 1.00 0.89 N ATOM 172 CA TRP A 16 16.412 45.224 15.993 1.00 0.89 C ATOM 173 C TRP A 16 17.916 45.441 15.769 1.00 0.89 C ATOM 174 O TRP A 16 18.359 45.571 14.628 1.00 0.89 O ATOM 175 CB TRP A 16 15.744 46.528 16.440 1.00 0.89 C ATOM 176 CG TRP A 16 16.119 47.705 15.598 1.00 0.89 C ATOM 177 CD1 TRP A 16 15.515 48.013 14.433 1.00 0.89 C ATOM 178 CD2 TRP A 16 17.210 48.673 15.746 1.00 0.89 C ATOM 179 NE1 TRP A 16 16.115 49.109 13.862 1.00 0.89 N ATOM 180 CE2 TRP A 16 17.178 49.539 14.615 1.00 0.89 C ATOM 181 CE3 TRP A 16 18.205 48.936 16.719 1.00 0.89 C ATOM 182 CZ2 TRP A 16 18.078 50.589 14.449 1.00 0.89 C ATOM 183 CZ3 TRP A 16 19.114 50.007 16.566 1.00 0.89 C ATOM 184 CH2 TRP A 16 19.049 50.834 15.429 1.00 0.89 C ATOM 185 H TRP A 16 15.505 44.391 17.746 1.00 0.00 H ATOM 186 HA TRP A 16 15.989 44.954 15.024 1.00 0.00 H ATOM 187 HB2 TRP A 16 14.662 46.397 16.385 1.00 0.00 H ATOM 188 HB3 TRP A 16 16.005 46.742 17.477 1.00 0.00 H ATOM 189 HD1 TRP A 16 14.667 47.488 14.020 1.00 0.00 H ATOM 190 HE3 TRP A 16 18.225 48.327 17.608 1.00 0.00 H ATOM 191 HZ2 TRP A 16 17.977 51.215 13.580 1.00 0.00 H ATOM 192 HZ3 TRP A 16 19.836 50.221 17.338 1.00 0.00 H ATOM 193 HH2 TRP A 16 19.709 51.679 15.313 1.00 0.00 H ATOM 194 HE1 TRP A 16 15.741 49.588 13.037 1.00 0.00 H ATOM 195 N ARG A 17 18.743 45.341 16.821 1.00 0.87 N ATOM 196 CA ARG A 17 20.209 45.412 16.679 1.00 0.87 C ATOM 197 C ARG A 17 20.776 44.263 15.846 1.00 0.87 C ATOM 198 O ARG A 17 21.746 44.485 15.125 1.00 0.87 O ATOM 199 CB ARG A 17 20.878 45.428 18.058 1.00 0.87 C ATOM 200 CG ARG A 17 20.743 46.788 18.758 1.00 0.87 C ATOM 201 CD ARG A 17 21.205 46.696 20.217 1.00 0.87 C ATOM 202 NE ARG A 17 22.647 46.378 20.309 1.00 0.87 N ATOM 203 CZ ARG A 17 23.257 45.702 21.265 1.00 0.87 C ATOM 204 NH1 ARG A 17 22.629 45.261 22.319 1.00 0.87 N ATOM 205 NH2 ARG A 17 24.535 45.459 21.179 1.00 0.87 N ATOM 206 H ARG A 17 18.331 45.202 17.739 1.00 0.00 H ATOM 207 HA ARG A 17 20.459 46.322 16.134 1.00 0.00 H ATOM 208 HB2 ARG A 17 20.439 44.645 18.678 1.00 0.00 H ATOM 209 HB3 ARG A 17 21.939 45.206 17.935 1.00 0.00 H ATOM 210 HG2 ARG A 17 19.706 47.108 18.747 1.00 0.00 H ATOM 211 HG3 ARG A 17 21.332 47.535 18.225 1.00 0.00 H ATOM 212 HD2 ARG A 17 21.008 47.653 20.705 1.00 0.00 H ATOM 213 HD3 ARG A 17 20.604 45.930 20.713 1.00 0.00 H ATOM 214 HE ARG A 17 23.211 46.656 19.526 1.00 0.00 H ATOM 215 HH11 ARG A 17 21.644 45.445 22.407 1.00 0.00 H ATOM 216 HH12 ARG A 17 23.115 44.748 23.030 1.00 0.00 H ATOM 217 HH21 ARG A 17 25.060 45.766 20.379 1.00 0.00 H ATOM 218 HH22 ARG A 17 25.000 44.941 21.901 1.00 0.00 H ATOM 219 N GLU A 18 20.210 43.064 15.970 1.00 0.92 N ATOM 220 CA GLU A 18 20.613 41.899 15.175 1.00 0.92 C ATOM 221 C GLU A 18 20.085 41.971 13.731 1.00 0.92 C ATOM 222 O GLU A 18 20.886 41.825 12.810 1.00 0.92 O ATOM 223 CB GLU A 18 20.185 40.612 15.902 1.00 0.92 C ATOM 224 CG GLU A 18 20.420 39.316 15.104 1.00 0.92 C ATOM 225 CD GLU A 18 21.884 39.035 14.718 1.00 0.92 C ATOM 226 OE1 GLU A 18 22.813 39.709 15.213 1.00 0.92 O ATOM 227 OE2 GLU A 18 22.108 38.214 13.798 1.00 0.92 O ATOM 228 H GLU A 18 19.400 42.971 16.574 1.00 0.00 H ATOM 229 HA GLU A 18 21.701 41.888 15.108 1.00 0.00 H ATOM 230 HB2 GLU A 18 19.124 40.682 16.140 1.00 0.00 H ATOM 231 HB3 GLU A 18 20.723 40.548 16.849 1.00 0.00 H ATOM 232 HG2 GLU A 18 20.044 38.480 15.698 1.00 0.00 H ATOM 233 HG3 GLU A 18 19.821 39.356 14.193 1.00 0.00 H ATOM 234 N TYR A 19 18.849 42.443 13.514 1.00 0.93 N ATOM 235 CA TYR A 19 18.328 42.760 12.179 1.00 0.93 C ATOM 236 C TYR A 19 19.211 43.786 11.454 1.00 0.93 C ATOM 237 O TYR A 19 19.725 43.499 10.375 1.00 0.93 O ATOM 238 CB TYR A 19 16.882 43.263 12.289 1.00 0.93 C ATOM 239 CG TYR A 19 16.189 43.574 10.953 1.00 0.93 C ATOM 240 CD1 TYR A 19 15.273 42.652 10.425 1.00 0.93 C ATOM 241 CD2 TYR A 19 16.418 44.815 10.305 1.00 0.93 C ATOM 242 CE1 TYR A 19 14.571 42.945 9.238 1.00 0.93 C ATOM 243 CE2 TYR A 19 15.707 45.106 9.100 1.00 0.93 C ATOM 244 CZ TYR A 19 14.796 44.181 8.580 1.00 0.93 C ATOM 245 OH TYR A 19 14.122 44.433 7.423 1.00 0.93 O ATOM 246 H TYR A 19 18.231 42.557 14.314 1.00 0.00 H ATOM 247 HA TYR A 19 18.322 41.849 11.578 1.00 0.00 H ATOM 248 HB2 TYR A 19 16.292 42.500 12.795 1.00 0.00 H ATOM 249 HB3 TYR A 19 16.848 44.157 12.907 1.00 0.00 H ATOM 250 HD1 TYR A 19 15.077 41.729 10.931 1.00 0.00 H ATOM 251 HD2 TYR A 19 17.100 45.538 10.698 1.00 0.00 H ATOM 252 HE1 TYR A 19 13.876 42.243 8.828 1.00 0.00 H ATOM 253 HE2 TYR A 19 15.870 46.035 8.582 1.00 0.00 H ATOM 254 HH TYR A 19 13.673 43.652 7.113 1.00 0.00 H ATOM 255 N ARG A 20 19.606 44.868 12.144 1.00 0.87 N ATOM 256 CA ARG A 20 20.554 45.864 11.620 1.00 0.87 C ATOM 257 C ARG A 20 21.942 45.283 11.320 1.00 0.87 C ATOM 258 O ARG A 20 22.516 45.639 10.296 1.00 0.87 O ATOM 259 CB ARG A 20 20.626 47.053 12.586 1.00 0.87 C ATOM 260 CG ARG A 20 21.543 48.163 12.047 1.00 0.87 C ATOM 261 CD ARG A 20 21.534 49.394 12.954 1.00 0.87 C ATOM 262 NE ARG A 20 22.171 49.102 14.250 1.00 0.87 N ATOM 263 CZ ARG A 20 22.560 49.997 15.133 1.00 0.87 C ATOM 264 NH1 ARG A 20 22.375 51.274 14.949 1.00 0.87 N ATOM 265 NH2 ARG A 20 23.186 49.618 16.213 1.00 0.87 N ATOM 266 H ARG A 20 19.151 45.049 13.036 1.00 0.00 H ATOM 267 HA ARG A 20 20.164 46.232 10.669 1.00 0.00 H ATOM 268 HB2 ARG A 20 20.992 46.708 13.554 1.00 0.00 H ATOM 269 HB3 ARG A 20 19.621 47.460 12.718 1.00 0.00 H ATOM 270 HG2 ARG A 20 22.566 47.796 11.978 1.00 0.00 H ATOM 271 HG3 ARG A 20 21.214 48.455 11.049 1.00 0.00 H ATOM 272 HD2 ARG A 20 22.081 50.191 12.445 1.00 0.00 H ATOM 273 HD3 ARG A 20 20.504 49.719 13.111 1.00 0.00 H ATOM 274 HE ARG A 20 22.323 48.129 14.454 1.00 0.00 H ATOM 275 HH11 ARG A 20 21.860 51.558 14.125 1.00 0.00 H ATOM 276 HH12 ARG A 20 22.689 51.960 15.604 1.00 0.00 H ATOM 277 HH21 ARG A 20 23.440 48.652 16.300 1.00 0.00 H ATOM 278 HH22 ARG A 20 23.542 50.311 16.842 1.00 0.00 H ATOM 279 N ARG A 21 22.460 44.352 12.131 1.00 0.85 N ATOM 280 CA ARG A 21 23.736 43.661 11.854 1.00 0.85 C ATOM 281 C ARG A 21 23.649 42.778 10.601 1.00 0.85 C ATOM 282 O ARG A 21 24.580 42.768 9.801 1.00 0.85 O ATOM 283 CB ARG A 21 24.149 42.835 13.086 1.00 0.85 C ATOM 284 CG ARG A 21 25.588 42.293 12.983 1.00 0.85 C ATOM 285 CD ARG A 21 25.853 41.172 13.999 1.00 0.85 C ATOM 286 NE ARG A 21 25.094 39.949 13.680 1.00 0.85 N ATOM 287 CZ ARG A 21 25.361 39.026 12.778 1.00 0.85 C ATOM 288 NH1 ARG A 21 26.432 39.062 12.032 1.00 0.85 N ATOM 289 NH2 ARG A 21 24.540 38.037 12.604 1.00 0.85 N ATOM 290 H ARG A 21 21.922 44.077 12.945 1.00 0.00 H ATOM 291 HA ARG A 21 24.502 44.413 11.650 1.00 0.00 H ATOM 292 HB2 ARG A 21 24.085 43.461 13.977 1.00 0.00 H ATOM 293 HB3 ARG A 21 23.450 42.007 13.205 1.00 0.00 H ATOM 294 HG2 ARG A 21 26.284 43.112 13.170 1.00 0.00 H ATOM 295 HG3 ARG A 21 25.783 41.905 11.984 1.00 0.00 H ATOM 296 HD2 ARG A 21 26.921 40.950 14.027 1.00 0.00 H ATOM 297 HD3 ARG A 21 25.554 41.517 14.991 1.00 0.00 H ATOM 298 HE ARG A 21 24.233 39.801 14.219 1.00 0.00 H ATOM 299 HH11 ARG A 21 27.049 39.848 12.127 1.00 0.00 H ATOM 300 HH12 ARG A 21 26.593 38.364 11.334 1.00 0.00 H ATOM 301 HH21 ARG A 21 23.658 38.054 13.137 1.00 0.00 H ATOM 302 HH22 ARG A 21 24.707 37.310 11.948 1.00 0.00 H ATOM 303 N GLN A 22 22.552 42.040 10.429 1.00 0.90 N ATOM 304 CA GLN A 22 22.317 41.196 9.249 1.00 0.90 C ATOM 305 C GLN A 22 22.090 42.026 7.981 1.00 0.90 C ATOM 306 O GLN A 22 22.740 41.772 6.972 1.00 0.90 O ATOM 307 CB GLN A 22 21.122 40.267 9.501 1.00 0.90 C ATOM 308 CG GLN A 22 21.407 39.232 10.601 1.00 0.90 C ATOM 309 CD GLN A 22 20.250 38.255 10.803 1.00 0.90 C ATOM 310 OE1 GLN A 22 19.330 38.143 10.014 1.00 0.90 O ATOM 311 NE2 GLN A 22 20.287 37.452 11.839 1.00 0.90 N ATOM 312 H GLN A 22 21.817 42.105 11.128 1.00 0.00 H ATOM 313 HA GLN A 22 23.201 40.587 9.064 1.00 0.00 H ATOM 314 HB2 GLN A 22 20.896 39.739 8.573 1.00 0.00 H ATOM 315 HB3 GLN A 22 20.249 40.859 9.781 1.00 0.00 H ATOM 316 HG2 GLN A 22 22.299 38.664 10.338 1.00 0.00 H ATOM 317 HG3 GLN A 22 21.600 39.740 11.543 1.00 0.00 H ATOM 318 HE21 GLN A 22 20.961 37.624 12.588 1.00 0.00 H ATOM 319 HE22 GLN A 22 19.493 36.850 11.952 1.00 0.00 H ATOM 320 N CYS A 23 21.420 43.166 8.126 1.00 0.94 N ATOM 321 CA CYS A 23 21.292 44.197 7.105 1.00 0.94 C ATOM 322 C CYS A 23 22.655 44.772 6.674 1.00 0.94 C ATOM 323 O CYS A 23 23.048 44.596 5.531 1.00 0.94 O ATOM 324 CB CYS A 23 20.334 45.244 7.685 1.00 0.94 C ATOM 325 SG CYS A 23 20.230 46.680 6.601 1.00 0.94 S ATOM 326 H CYS A 23 20.922 43.315 8.998 1.00 0.00 H ATOM 327 HA CYS A 23 20.835 43.768 6.207 1.00 0.00 H ATOM 328 HB2 CYS A 23 20.680 45.564 8.664 1.00 0.00 H ATOM 329 HB3 CYS A 23 19.347 44.791 7.799 1.00 0.00 H ATOM 330 HG CYS A 23 21.208 47.388 7.177 1.00 0.00 H ATOM 331 N GLN A 24 23.475 45.265 7.610 1.00 0.83 N ATOM 332 CA GLN A 24 24.795 45.853 7.317 1.00 0.83 C ATOM 333 C GLN A 24 25.819 44.872 6.729 1.00 0.83 C ATOM 334 O GLN A 24 26.660 45.293 5.937 1.00 0.83 O ATOM 335 CB GLN A 24 25.342 46.510 8.594 1.00 0.83 C ATOM 336 CG GLN A 24 24.531 47.772 8.933 1.00 0.83 C ATOM 337 CD GLN A 24 24.795 48.330 10.328 1.00 0.83 C ATOM 338 OE1 GLN A 24 25.173 47.661 11.280 1.00 0.83 O ATOM 339 NE2 GLN A 24 24.516 49.599 10.534 1.00 0.83 N ATOM 340 H GLN A 24 23.126 45.341 8.559 1.00 0.00 H ATOM 341 HA GLN A 24 24.675 46.627 6.558 1.00 0.00 H ATOM 342 HB2 GLN A 24 26.386 46.797 8.445 1.00 0.00 H ATOM 343 HB3 GLN A 24 25.295 45.790 9.413 1.00 0.00 H ATOM 344 HG2 GLN A 24 23.464 47.571 8.855 1.00 0.00 H ATOM 345 HG3 GLN A 24 24.772 48.538 8.194 1.00 0.00 H ATOM 346 HE21 GLN A 24 24.220 50.171 9.760 1.00 0.00 H ATOM 347 HE22 GLN A 24 24.853 49.981 11.394 1.00 0.00 H ATOM 348 N ARG A 25 25.670 43.569 7.007 1.00 0.80 N ATOM 349 CA ARG A 25 26.394 42.511 6.293 1.00 0.80 C ATOM 350 C ARG A 25 25.957 42.420 4.826 1.00 0.80 C ATOM 351 O ARG A 25 26.773 42.682 3.960 1.00 0.80 O ATOM 352 CB ARG A 25 26.232 41.191 7.063 1.00 0.80 C ATOM 353 CG ARG A 25 26.895 40.044 6.301 1.00 0.80 C ATOM 354 CD ARG A 25 27.075 38.761 7.113 1.00 0.80 C ATOM 355 NE ARG A 25 25.788 38.218 7.598 1.00 0.80 N ATOM 356 CZ ARG A 25 25.656 37.221 8.446 1.00 0.80 C ATOM 357 NH1 ARG A 25 24.477 36.756 8.759 1.00 0.80 N ATOM 358 NH2 ARG A 25 26.696 36.702 9.044 1.00 0.80 N ATOM 359 H ARG A 25 24.923 43.298 7.635 1.00 0.00 H ATOM 360 HA ARG A 25 27.458 42.762 6.249 1.00 0.00 H ATOM 361 HB2 ARG A 25 26.723 41.298 8.031 1.00 0.00 H ATOM 362 HB3 ARG A 25 25.177 40.966 7.215 1.00 0.00 H ATOM 363 HG2 ARG A 25 26.325 39.813 5.398 1.00 0.00 H ATOM 364 HG3 ARG A 25 27.885 40.397 6.023 1.00 0.00 H ATOM 365 HD2 ARG A 25 27.747 38.976 7.946 1.00 0.00 H ATOM 366 HD3 ARG A 25 27.556 38.020 6.467 1.00 0.00 H ATOM 367 HE ARG A 25 24.975 38.518 7.080 1.00 0.00 H ATOM 368 HH11 ARG A 25 23.676 37.109 8.256 1.00 0.00 H ATOM 369 HH12 ARG A 25 24.383 35.911 9.288 1.00 0.00 H ATOM 370 HH21 ARG A 25 27.584 37.001 8.660 1.00 0.00 H ATOM 371 HH22 ARG A 25 26.626 35.792 9.455 1.00 0.00 H ATOM 372 N SER A 26 24.651 42.304 4.587 1.00 0.89 N ATOM 373 CA SER A 26 24.038 42.204 3.248 1.00 0.89 C ATOM 374 C SER A 26 24.360 43.428 2.364 1.00 0.89 C ATOM 375 O SER A 26 25.074 43.285 1.379 1.00 0.89 O ATOM 376 CB SER A 26 22.516 41.988 3.380 1.00 0.89 C ATOM 377 OG SER A 26 22.197 41.098 4.448 1.00 0.89 O ATOM 378 H SER A 26 24.039 42.221 5.379 1.00 0.00 H ATOM 379 HA SER A 26 24.443 41.330 2.732 1.00 0.00 H ATOM 380 HB2 SER A 26 22.019 42.945 3.551 1.00 0.00 H ATOM 381 HB3 SER A 26 22.137 41.554 2.456 1.00 0.00 H ATOM 382 HG SER A 26 22.350 41.546 5.293 1.00 0.00 H ATOM 383 N LEU A 27 24.265 44.643 2.939 1.00 0.91 N ATOM 384 CA LEU A 27 24.710 45.888 2.284 1.00 0.91 C ATOM 385 C LEU A 27 26.187 45.879 1.829 1.00 0.91 C ATOM 386 O LEU A 27 26.499 46.491 0.807 1.00 0.91 O ATOM 387 CB LEU A 27 24.471 47.106 3.203 1.00 0.91 C ATOM 388 CG LEU A 27 23.017 47.408 3.618 1.00 0.91 C ATOM 389 CD1 LEU A 27 22.999 48.633 4.536 1.00 0.91 C ATOM 390 CD2 LEU A 27 22.097 47.716 2.441 1.00 0.91 C ATOM 391 H LEU A 27 23.768 44.703 3.819 1.00 0.00 H ATOM 392 HA LEU A 27 24.119 46.011 1.381 1.00 0.00 H ATOM 393 HB2 LEU A 27 25.068 46.973 4.106 1.00 0.00 H ATOM 394 HB3 LEU A 27 24.856 47.988 2.687 1.00 0.00 H ATOM 395 HG LEU A 27 22.602 46.567 4.163 1.00 0.00 H ATOM 396 HD11 LEU A 27 21.974 48.841 4.835 1.00 0.00 H ATOM 397 HD12 LEU A 27 23.401 49.497 4.004 1.00 0.00 H ATOM 398 HD13 LEU A 27 23.601 48.442 5.422 1.00 0.00 H ATOM 399 HD21 LEU A 27 22.042 46.849 1.784 1.00 0.00 H ATOM 400 HD22 LEU A 27 21.090 47.921 2.803 1.00 0.00 H ATOM 401 HD23 LEU A 27 22.470 48.577 1.888 1.00 0.00 H ATOM 402 N THR A 28 27.077 45.235 2.602 1.00 0.87 N ATOM 403 CA THR A 28 28.524 45.115 2.314 1.00 0.87 C ATOM 404 C THR A 28 28.849 43.982 1.334 1.00 0.87 C ATOM 405 O THR A 28 29.784 44.108 0.548 1.00 0.87 O ATOM 406 CB THR A 28 29.304 44.850 3.615 1.00 0.87 C ATOM 407 OG1 THR A 28 29.017 45.867 4.548 1.00 0.87 O ATOM 408 CG2 THR A 28 30.825 44.820 3.452 1.00 0.87 C ATOM 409 H THR A 28 26.706 44.659 3.347 1.00 0.00 H ATOM 410 HA THR A 28 28.891 46.046 1.882 1.00 0.00 H ATOM 411 HB THR A 28 28.991 43.895 4.037 1.00 0.00 H ATOM 412 HG1 THR A 28 28.092 45.735 4.809 1.00 0.00 H ATOM 413 HG21 THR A 28 31.299 44.782 4.435 1.00 0.00 H ATOM 414 HG22 THR A 28 31.156 45.711 2.917 1.00 0.00 H ATOM 415 HG23 THR A 28 31.116 43.930 2.894 1.00 0.00 H ATOM 416 N GLU A 29 28.237 42.814 1.549 1.00 0.85 N ATOM 417 CA GLU A 29 28.629 41.524 0.960 1.00 0.85 C ATOM 418 C GLU A 29 27.797 41.123 -0.274 1.00 0.85 C ATOM 419 O GLU A 29 28.298 40.360 -1.102 1.00 0.85 O ATOM 420 CB GLU A 29 28.558 40.415 2.034 1.00 0.85 C ATOM 421 CG GLU A 29 29.542 40.613 3.209 1.00 0.85 C ATOM 422 CD GLU A 29 29.523 39.477 4.259 1.00 0.85 C ATOM 423 OE1 GLU A 29 28.560 38.674 4.289 1.00 0.85 O ATOM 424 OE2 GLU A 29 30.320 39.565 5.224 1.00 0.85 O ATOM 425 H GLU A 29 27.511 42.787 2.256 1.00 0.00 H ATOM 426 HA GLU A 29 29.661 41.594 0.615 1.00 0.00 H ATOM 427 HB2 GLU A 29 27.536 40.364 2.416 1.00 0.00 H ATOM 428 HB3 GLU A 29 28.793 39.464 1.557 1.00 0.00 H ATOM 429 HG2 GLU A 29 30.553 40.680 2.800 1.00 0.00 H ATOM 430 HG3 GLU A 29 29.322 41.562 3.707 1.00 0.00 H ATOM 431 N ASP A 30 26.579 41.653 -0.451 1.00 0.89 N ATOM 432 CA ASP A 30 25.768 41.413 -1.652 1.00 0.89 C ATOM 433 C ASP A 30 26.483 41.983 -2.901 1.00 0.89 C ATOM 434 O ASP A 30 26.948 43.132 -2.870 1.00 0.89 O ATOM 435 CB ASP A 30 24.347 42.000 -1.508 1.00 0.89 C ATOM 436 CG ASP A 30 23.495 41.384 -0.384 1.00 0.89 C ATOM 437 OD1 ASP A 30 23.730 40.208 -0.024 1.00 0.89 O ATOM 438 OD2 ASP A 30 22.549 42.074 0.068 1.00 0.89 O ATOM 439 H ASP A 30 26.196 42.272 0.256 1.00 0.00 H ATOM 440 HA ASP A 30 25.666 40.333 -1.759 1.00 0.00 H ATOM 441 HB2 ASP A 30 23.819 41.855 -2.453 1.00 0.00 H ATOM 442 HB3 ASP A 30 24.424 43.074 -1.340 1.00 0.00 H ATOM 443 N PRO A 31 26.580 41.238 -4.022 1.00 0.86 N ATOM 444 CA PRO A 31 27.316 41.682 -5.210 1.00 0.86 C ATOM 445 C PRO A 31 26.674 42.925 -5.855 1.00 0.86 C ATOM 446 O PRO A 31 25.498 43.187 -5.603 1.00 0.86 O ATOM 447 CB PRO A 31 27.313 40.478 -6.159 1.00 0.86 C ATOM 448 CG PRO A 31 26.025 39.744 -5.785 1.00 0.86 C ATOM 449 CD PRO A 31 25.925 39.965 -4.275 1.00 0.86 C ATOM 450 HA PRO A 31 28.340 41.914 -4.919 1.00 0.00 H ATOM 451 HB2 PRO A 31 27.316 40.777 -7.208 1.00 0.00 H ATOM 452 HB3 PRO A 31 28.172 39.842 -5.941 1.00 0.00 H ATOM 453 HG2 PRO A 31 26.077 38.684 -6.035 1.00 0.00 H ATOM 454 HG3 PRO A 31 25.177 40.216 -6.284 1.00 0.00 H ATOM 455 HD2 PRO A 31 26.455 39.173 -3.744 1.00 0.00 H ATOM 456 HD3 PRO A 31 24.877 39.992 -3.971 1.00 0.00 H ATOM 457 N PRO A 32 27.395 43.694 -6.698 1.00 0.87 N ATOM 458 CA PRO A 32 26.828 44.871 -7.362 1.00 0.87 C ATOM 459 C PRO A 32 25.616 44.528 -8.248 1.00 0.87 C ATOM 460 O PRO A 32 25.579 43.430 -8.817 1.00 0.87 O ATOM 461 CB PRO A 32 27.963 45.478 -8.196 1.00 0.87 C ATOM 462 CG PRO A 32 29.230 44.939 -7.535 1.00 0.87 C ATOM 463 CD PRO A 32 28.805 43.562 -7.029 1.00 0.87 C ATOM 464 HA PRO A 32 26.529 45.579 -6.589 1.00 0.00 H ATOM 465 HB2 PRO A 32 27.934 46.568 -8.178 1.00 0.00 H ATOM 466 HB3 PRO A 32 27.909 45.116 -9.226 1.00 0.00 H ATOM 467 HG2 PRO A 32 30.056 44.873 -8.245 1.00 0.00 H ATOM 468 HG3 PRO A 32 29.498 45.573 -6.689 1.00 0.00 H ATOM 469 HD2 PRO A 32 29.404 43.289 -6.160 1.00 0.00 H ATOM 470 HD3 PRO A 32 28.923 42.823 -7.822 1.00 0.00 H ATOM 471 N PRO A 33 24.693 45.481 -8.475 1.00 0.83 N ATOM 472 CA PRO A 33 23.588 45.285 -9.404 1.00 0.83 C ATOM 473 C PRO A 33 24.081 45.210 -10.857 1.00 0.83 C ATOM 474 O PRO A 33 25.190 45.629 -11.189 1.00 0.83 O ATOM 475 CB PRO A 33 22.651 46.469 -9.163 1.00 0.83 C ATOM 476 CG PRO A 33 23.600 47.590 -8.744 1.00 0.83 C ATOM 477 CD PRO A 33 24.680 46.846 -7.955 1.00 0.83 C ATOM 478 HA PRO A 33 23.067 44.358 -9.164 1.00 0.00 H ATOM 479 HB2 PRO A 33 22.085 46.730 -10.056 1.00 0.00 H ATOM 480 HB3 PRO A 33 21.979 46.233 -8.335 1.00 0.00 H ATOM 481 HG2 PRO A 33 24.039 48.051 -9.631 1.00 0.00 H ATOM 482 HG3 PRO A 33 23.093 48.338 -8.132 1.00 0.00 H ATOM 483 HD2 PRO A 33 24.418 46.832 -6.896 1.00 0.00 H ATOM 484 HD3 PRO A 33 25.642 47.339 -8.098 1.00 0.00 H ATOM 485 N ALA A 34 23.211 44.756 -11.765 1.00 0.75 N ATOM 486 CA ALA A 34 23.553 44.594 -13.182 1.00 0.75 C ATOM 487 C ALA A 34 23.862 45.920 -13.916 1.00 0.75 C ATOM 488 O ALA A 34 24.405 45.901 -15.021 1.00 0.75 O ATOM 489 CB ALA A 34 22.401 43.842 -13.860 1.00 0.75 C ATOM 490 H ALA A 34 22.293 44.478 -11.453 1.00 0.00 H ATOM 491 HA ALA A 34 24.453 43.980 -13.245 1.00 0.00 H ATOM 492 HB1 ALA A 34 22.660 43.647 -14.902 1.00 0.00 H ATOM 493 HB2 ALA A 34 21.492 44.445 -13.826 1.00 0.00 H ATOM 494 HB3 ALA A 34 22.226 42.891 -13.355 1.00 0.00 H ATOM 495 N THR A 35 23.453 47.059 -13.345 1.00 0.70 N ATOM 496 CA THR A 35 23.741 48.408 -13.845 1.00 0.70 C ATOM 497 C THR A 35 23.481 49.435 -12.739 1.00 0.70 C ATOM 498 O THR A 35 22.514 49.299 -11.994 1.00 0.70 O ATOM 499 CB THR A 35 22.907 48.712 -15.112 1.00 0.70 C ATOM 500 OG1 THR A 35 23.139 50.023 -15.577 1.00 0.70 O ATOM 501 CG2 THR A 35 21.390 48.590 -14.947 1.00 0.70 C ATOM 502 H THR A 35 23.022 47.003 -12.432 1.00 0.00 H ATOM 503 HA THR A 35 24.797 48.458 -14.111 1.00 0.00 H ATOM 504 HB THR A 35 23.210 48.019 -15.897 1.00 0.00 H ATOM 505 HG1 THR A 35 24.047 50.073 -15.885 1.00 0.00 H ATOM 506 HG21 THR A 35 20.905 48.805 -15.900 1.00 0.00 H ATOM 507 HG22 THR A 35 21.128 47.577 -14.646 1.00 0.00 H ATOM 508 HG23 THR A 35 21.033 49.298 -14.201 1.00 0.00 H ATOM 509 N ASP A 36 24.232 50.543 -12.753 1.00 0.62 N ATOM 510 CA ASP A 36 24.030 51.721 -11.888 1.00 0.62 C ATOM 511 C ASP A 36 22.660 52.433 -12.054 1.00 0.62 C ATOM 512 O ASP A 36 22.372 53.379 -11.326 1.00 0.62 O ATOM 513 CB ASP A 36 25.184 52.720 -12.127 1.00 0.62 C ATOM 514 CG ASP A 36 26.586 52.100 -12.043 1.00 0.62 C ATOM 515 OD1 ASP A 36 26.827 51.310 -11.106 1.00 0.62 O ATOM 516 OD2 ASP A 36 27.340 52.272 -13.028 1.00 0.62 O ATOM 517 H ASP A 36 25.100 50.525 -13.269 1.00 0.00 H ATOM 518 HA ASP A 36 24.093 51.389 -10.850 1.00 0.00 H ATOM 519 HB2 ASP A 36 25.057 53.168 -13.116 1.00 0.00 H ATOM 520 HB3 ASP A 36 25.118 53.519 -11.388 1.00 0.00 H ATOM 521 N LEU A 37 21.802 51.997 -12.994 1.00 0.79 N ATOM 522 CA LEU A 37 20.382 52.396 -13.082 1.00 0.79 C ATOM 523 C LEU A 37 19.451 51.611 -12.132 1.00 0.79 C ATOM 524 O LEU A 37 18.255 51.887 -12.093 1.00 0.79 O ATOM 525 CB LEU A 37 19.883 52.285 -14.544 1.00 0.79 C ATOM 526 CG LEU A 37 20.141 53.487 -15.473 1.00 0.79 C ATOM 527 CD1 LEU A 37 19.464 54.771 -14.986 1.00 0.79 C ATOM 528 CD2 LEU A 37 21.624 53.773 -15.704 1.00 0.79 C ATOM 529 H LEU A 37 22.109 51.223 -13.567 1.00 0.00 H ATOM 530 HA LEU A 37 20.298 53.434 -12.760 1.00 0.00 H ATOM 531 HB2 LEU A 37 20.306 51.391 -15.002 1.00 0.00 H ATOM 532 HB3 LEU A 37 18.801 52.141 -14.535 1.00 0.00 H ATOM 533 HG LEU A 37 19.704 53.236 -16.441 1.00 0.00 H ATOM 534 HD11 LEU A 37 19.500 55.522 -15.773 1.00 0.00 H ATOM 535 HD12 LEU A 37 19.967 55.159 -14.099 1.00 0.00 H ATOM 536 HD13 LEU A 37 18.420 54.567 -14.741 1.00 0.00 H ATOM 537 HD21 LEU A 37 22.120 52.869 -16.057 1.00 0.00 H ATOM 538 HD22 LEU A 37 21.729 54.559 -16.450 1.00 0.00 H ATOM 539 HD23 LEU A 37 22.089 54.099 -14.773 1.00 0.00 H ATOM 540 N PHE A 38 19.952 50.622 -11.386 1.00 0.84 N ATOM 541 CA PHE A 38 19.201 50.047 -10.266 1.00 0.84 C ATOM 542 C PHE A 38 19.143 51.076 -9.127 1.00 0.84 C ATOM 543 O PHE A 38 20.157 51.697 -8.801 1.00 0.84 O ATOM 544 CB PHE A 38 19.845 48.735 -9.773 1.00 0.84 C ATOM 545 CG PHE A 38 19.487 47.463 -10.534 1.00 0.84 C ATOM 546 CD1 PHE A 38 19.089 46.312 -9.822 1.00 0.84 C ATOM 547 CD2 PHE A 38 19.566 47.402 -11.939 1.00 0.84 C ATOM 548 CE1 PHE A 38 18.747 45.131 -10.505 1.00 0.84 C ATOM 549 CE2 PHE A 38 19.217 46.224 -12.625 1.00 0.84 C ATOM 550 CZ PHE A 38 18.806 45.088 -11.908 1.00 0.84 C ATOM 551 H PHE A 38 20.954 50.473 -11.399 1.00 0.00 H ATOM 552 HA PHE A 38 18.178 49.844 -10.576 1.00 0.00 H ATOM 553 HB2 PHE A 38 20.928 48.854 -9.768 1.00 0.00 H ATOM 554 HB3 PHE A 38 19.543 48.589 -8.735 1.00 0.00 H ATOM 555 HD1 PHE A 38 19.027 46.337 -8.743 1.00 0.00 H ATOM 556 HD2 PHE A 38 19.881 48.269 -12.494 1.00 0.00 H ATOM 557 HE1 PHE A 38 18.410 44.264 -9.953 1.00 0.00 H ATOM 558 HE2 PHE A 38 19.245 46.196 -13.705 1.00 0.00 H ATOM 559 HZ PHE A 38 18.505 44.190 -12.433 1.00 0.00 H ATOM 560 N CYS A 39 18.032 51.141 -8.384 1.00 0.89 N ATOM 561 CA CYS A 39 18.066 51.823 -7.090 1.00 0.89 C ATOM 562 C CYS A 39 19.057 51.152 -6.154 1.00 0.89 C ATOM 563 O CYS A 39 18.878 49.983 -5.844 1.00 0.89 O ATOM 564 CB CYS A 39 16.702 51.831 -6.403 1.00 0.89 C ATOM 565 SG CYS A 39 15.855 53.288 -7.008 1.00 0.89 S ATOM 566 H CYS A 39 17.229 50.578 -8.647 1.00 0.00 H ATOM 567 HA CYS A 39 18.402 52.846 -7.253 1.00 0.00 H ATOM 568 HB2 CYS A 39 16.863 51.891 -5.321 1.00 0.00 H ATOM 569 HB3 CYS A 39 16.123 50.932 -6.636 1.00 0.00 H ATOM 570 HG CYS A 39 16.971 54.035 -7.112 1.00 0.00 H ATOM 571 N ASN A 40 19.840 51.974 -5.445 1.00 0.83 N ATOM 572 CA ASN A 40 20.703 51.451 -4.392 1.00 0.83 C ATOM 573 C ASN A 40 19.912 50.883 -3.203 1.00 0.83 C ATOM 574 O ASN A 40 19.094 51.590 -2.594 1.00 0.83 O ATOM 575 CB ASN A 40 21.690 52.529 -3.921 1.00 0.83 C ATOM 576 CG ASN A 40 22.756 52.805 -4.962 1.00 0.83 C ATOM 577 OD1 ASN A 40 23.510 51.934 -5.348 1.00 0.83 O ATOM 578 ND2 ASN A 40 22.920 54.036 -5.388 1.00 0.83 N ATOM 579 H ASN A 40 19.948 52.927 -5.755 1.00 0.00 H ATOM 580 HA ASN A 40 21.277 50.625 -4.826 1.00 0.00 H ATOM 581 HB2 ASN A 40 21.152 53.440 -3.659 1.00 0.00 H ATOM 582 HB3 ASN A 40 22.197 52.165 -3.027 1.00 0.00 H ATOM 583 HD21 ASN A 40 22.310 54.774 -5.100 1.00 0.00 H ATOM 584 HD22 ASN A 40 23.577 54.122 -6.145 1.00 0.00 H ATOM 585 N ARG A 41 20.438 49.766 -2.699 1.00 0.80 N ATOM 586 CA ARG A 41 20.225 49.194 -1.368 1.00 0.80 C ATOM 587 C ARG A 41 20.334 50.232 -0.247 1.00 0.80 C ATOM 588 O ARG A 41 21.184 51.123 -0.281 1.00 0.80 O ATOM 589 CB ARG A 41 21.233 48.047 -1.158 1.00 0.80 C ATOM 590 CG ARG A 41 22.699 48.532 -1.199 1.00 0.80 C ATOM 591 CD ARG A 41 23.711 47.389 -1.180 1.00 0.80 C ATOM 592 NE ARG A 41 23.825 46.742 -2.492 1.00 0.80 N ATOM 593 CZ ARG A 41 24.698 45.807 -2.810 1.00 0.80 C ATOM 594 NH1 ARG A 41 25.660 45.438 -2.007 1.00 0.80 N ATOM 595 NH2 ARG A 41 24.612 45.244 -3.972 1.00 0.80 N ATOM 596 H ARG A 41 21.069 49.245 -3.313 1.00 0.00 H ATOM 597 HA ARG A 41 19.217 48.786 -1.339 1.00 0.00 H ATOM 598 HB2 ARG A 41 21.038 47.572 -0.199 1.00 0.00 H ATOM 599 HB3 ARG A 41 21.073 47.289 -1.923 1.00 0.00 H ATOM 600 HG2 ARG A 41 22.890 49.156 -0.329 1.00 0.00 H ATOM 601 HG3 ARG A 41 22.883 49.134 -2.089 1.00 0.00 H ATOM 602 HD2 ARG A 41 24.684 47.795 -0.897 1.00 0.00 H ATOM 603 HD3 ARG A 41 23.403 46.650 -0.442 1.00 0.00 H ATOM 604 HE ARG A 41 23.153 47.003 -3.219 1.00 0.00 H ATOM 605 HH11 ARG A 41 25.768 45.854 -1.097 1.00 0.00 H ATOM 606 HH12 ARG A 41 26.245 44.652 -2.277 1.00 0.00 H ATOM 607 HH21 ARG A 41 23.842 45.522 -4.590 1.00 0.00 H ATOM 608 HH22 ARG A 41 25.161 44.434 -4.226 1.00 0.00 H ATOM 609 N THR A 42 19.588 50.024 0.838 1.00 0.90 N ATOM 610 CA THR A 42 19.709 50.851 2.049 1.00 0.90 C ATOM 611 C THR A 42 19.104 50.171 3.279 1.00 0.90 C ATOM 612 O THR A 42 18.001 49.635 3.231 1.00 0.90 O ATOM 613 CB THR A 42 19.120 52.266 1.826 1.00 0.90 C ATOM 614 OG1 THR A 42 19.412 53.138 2.905 1.00 0.90 O ATOM 615 CG2 THR A 42 17.599 52.344 1.667 1.00 0.90 C ATOM 616 H THR A 42 19.012 49.182 0.847 1.00 0.00 H ATOM 617 HA THR A 42 20.774 50.982 2.239 1.00 0.00 H ATOM 618 HB THR A 42 19.594 52.708 0.964 1.00 0.00 H ATOM 619 HG1 THR A 42 18.733 53.032 3.591 1.00 0.00 H ATOM 620 HG21 THR A 42 17.338 53.385 1.473 1.00 0.00 H ATOM 621 HG22 THR A 42 17.099 52.016 2.588 1.00 0.00 H ATOM 622 HG23 THR A 42 17.282 51.724 0.832 1.00 0.00 H ATOM 623 N PHE A 43 19.686 50.456 4.445 1.00 0.92 N ATOM 624 CA PHE A 43 18.928 50.437 5.693 1.00 0.92 C ATOM 625 C PHE A 43 18.184 51.776 5.841 1.00 0.92 C ATOM 626 O PHE A 43 18.783 52.826 5.618 1.00 0.92 O ATOM 627 CB PHE A 43 19.890 50.176 6.866 1.00 0.92 C ATOM 628 CG PHE A 43 19.232 49.831 8.194 1.00 0.92 C ATOM 629 CD1 PHE A 43 18.233 48.838 8.275 1.00 0.92 C ATOM 630 CD2 PHE A 43 19.641 50.493 9.367 1.00 0.92 C ATOM 631 CE1 PHE A 43 17.631 48.533 9.509 1.00 0.92 C ATOM 632 CE2 PHE A 43 19.057 50.165 10.602 1.00 0.92 C ATOM 633 CZ PHE A 43 18.049 49.191 10.674 1.00 0.92 C ATOM 634 H PHE A 43 20.497 51.055 4.414 1.00 0.00 H ATOM 635 HA PHE A 43 18.193 49.633 5.656 1.00 0.00 H ATOM 636 HB2 PHE A 43 20.540 49.352 6.591 1.00 0.00 H ATOM 637 HB3 PHE A 43 20.541 51.044 6.995 1.00 0.00 H ATOM 638 HD1 PHE A 43 17.912 48.311 7.387 1.00 0.00 H ATOM 639 HD2 PHE A 43 20.387 51.274 9.319 1.00 0.00 H ATOM 640 HE1 PHE A 43 16.824 47.817 9.559 1.00 0.00 H ATOM 641 HE2 PHE A 43 19.333 50.718 11.486 1.00 0.00 H ATOM 642 HZ PHE A 43 17.560 48.980 11.614 1.00 0.00 H ATOM 643 N ASP A 44 16.905 51.771 6.229 1.00 0.90 N ATOM 644 CA ASP A 44 16.165 53.006 6.561 1.00 0.90 C ATOM 645 C ASP A 44 15.683 53.046 8.018 1.00 0.90 C ATOM 646 O ASP A 44 14.590 53.510 8.324 1.00 0.90 O ATOM 647 CB ASP A 44 15.063 53.282 5.531 1.00 0.90 C ATOM 648 CG ASP A 44 13.866 52.322 5.521 1.00 0.90 C ATOM 649 OD1 ASP A 44 13.728 51.428 6.373 1.00 0.90 O ATOM 650 OD2 ASP A 44 12.995 52.521 4.638 1.00 0.90 O ATOM 651 H ASP A 44 16.415 50.881 6.296 1.00 0.00 H ATOM 652 HA ASP A 44 16.850 53.853 6.497 1.00 0.00 H ATOM 653 HB2 ASP A 44 15.531 53.266 4.548 1.00 0.00 H ATOM 654 HB3 ASP A 44 14.691 54.295 5.690 1.00 0.00 H ATOM 655 N GLU A 45 16.520 52.466 8.902 1.00 0.89 N ATOM 656 CA GLU A 45 16.261 52.212 10.327 1.00 0.89 C ATOM 657 C GLU A 45 15.041 51.301 10.638 1.00 0.89 C ATOM 658 O GLU A 45 15.086 50.574 11.636 1.00 0.89 O ATOM 659 CB GLU A 45 16.309 53.526 11.136 1.00 0.89 C ATOM 660 CG GLU A 45 17.593 54.380 10.932 1.00 0.89 C ATOM 661 CD GLU A 45 18.923 53.737 11.397 1.00 0.89 C ATOM 662 OE1 GLU A 45 18.884 52.936 12.361 1.00 0.89 O ATOM 663 OE2 GLU A 45 19.998 54.335 11.191 1.00 0.89 O ATOM 664 H GLU A 45 17.425 52.194 8.548 1.00 0.00 H ATOM 665 HA GLU A 45 17.106 51.646 10.695 1.00 0.00 H ATOM 666 HB2 GLU A 45 15.443 54.134 10.862 1.00 0.00 H ATOM 667 HB3 GLU A 45 16.212 53.281 12.196 1.00 0.00 H ATOM 668 HG2 GLU A 45 17.458 55.308 11.486 1.00 0.00 H ATOM 669 HG3 GLU A 45 17.673 54.657 9.880 1.00 0.00 H ATOM 670 N TYR A 46 14.090 51.139 9.703 1.00 0.90 N ATOM 671 CA TYR A 46 12.978 50.186 9.751 1.00 0.90 C ATOM 672 C TYR A 46 13.251 48.883 8.977 1.00 0.90 C ATOM 673 O TYR A 46 13.142 47.805 9.567 1.00 0.90 O ATOM 674 CB TYR A 46 11.690 50.873 9.265 1.00 0.90 C ATOM 675 CG TYR A 46 10.430 50.012 9.342 1.00 0.90 C ATOM 676 CD1 TYR A 46 9.839 49.792 10.603 1.00 0.90 C ATOM 677 CD2 TYR A 46 9.857 49.455 8.180 1.00 0.90 C ATOM 678 CE1 TYR A 46 8.665 49.009 10.701 1.00 0.90 C ATOM 679 CE2 TYR A 46 8.696 48.655 8.281 1.00 0.90 C ATOM 680 CZ TYR A 46 8.114 48.417 9.544 1.00 0.90 C ATOM 681 OH TYR A 46 7.037 47.590 9.626 1.00 0.90 O ATOM 682 H TYR A 46 14.117 51.776 8.910 1.00 0.00 H ATOM 683 HA TYR A 46 12.820 49.911 10.792 1.00 0.00 H ATOM 684 HB2 TYR A 46 11.520 51.753 9.883 1.00 0.00 H ATOM 685 HB3 TYR A 46 11.819 51.212 8.238 1.00 0.00 H ATOM 686 HD1 TYR A 46 10.299 50.190 11.493 1.00 0.00 H ATOM 687 HD2 TYR A 46 10.313 49.610 7.214 1.00 0.00 H ATOM 688 HE1 TYR A 46 8.221 48.831 11.665 1.00 0.00 H ATOM 689 HE2 TYR A 46 8.253 48.219 7.401 1.00 0.00 H ATOM 690 HH TYR A 46 6.982 47.035 8.843 1.00 0.00 H ATOM 691 N ALA A 47 13.675 48.954 7.710 1.00 0.96 N ATOM 692 CA ALA A 47 13.833 47.784 6.845 1.00 0.96 C ATOM 693 C ALA A 47 15.166 47.756 6.072 1.00 0.96 C ATOM 694 O ALA A 47 15.793 48.783 5.798 1.00 0.96 O ATOM 695 CB ALA A 47 12.613 47.674 5.920 1.00 0.96 C ATOM 696 H ALA A 47 13.756 49.871 7.267 1.00 0.00 H ATOM 697 HA ALA A 47 13.823 46.896 7.473 1.00 0.00 H ATOM 698 HB1 ALA A 47 11.706 47.561 6.516 1.00 0.00 H ATOM 699 HB2 ALA A 47 12.530 48.568 5.302 1.00 0.00 H ATOM 700 HB3 ALA A 47 12.712 46.802 5.271 1.00 0.00 H ATOM 701 N CYS A 48 15.637 46.534 5.802 1.00 0.95 N ATOM 702 CA CYS A 48 16.733 46.235 4.879 1.00 0.95 C ATOM 703 C CYS A 48 16.221 46.214 3.426 1.00 0.95 C ATOM 704 O CYS A 48 15.617 45.227 3.016 1.00 0.95 O ATOM 705 CB CYS A 48 17.296 44.864 5.297 1.00 0.95 C ATOM 706 SG CYS A 48 18.520 44.278 4.091 1.00 0.95 S ATOM 707 H CYS A 48 15.081 45.744 6.109 1.00 0.00 H ATOM 708 HA CYS A 48 17.518 46.990 4.957 1.00 0.00 H ATOM 709 HB2 CYS A 48 17.771 44.958 6.274 1.00 0.00 H ATOM 710 HB3 CYS A 48 16.481 44.136 5.365 1.00 0.00 H ATOM 711 HG CYS A 48 17.658 44.052 3.088 1.00 0.00 H ATOM 712 N TRP A 49 16.491 47.261 2.642 1.00 0.88 N ATOM 713 CA TRP A 49 16.174 47.321 1.208 1.00 0.88 C ATOM 714 C TRP A 49 17.342 46.781 0.367 1.00 0.88 C ATOM 715 O TRP A 49 18.450 47.302 0.529 1.00 0.88 O ATOM 716 CB TRP A 49 15.833 48.769 0.831 1.00 0.88 C ATOM 717 CG TRP A 49 14.620 49.265 1.549 1.00 0.88 C ATOM 718 CD1 TRP A 49 14.619 49.988 2.690 1.00 0.88 C ATOM 719 CD2 TRP A 49 13.229 48.906 1.301 1.00 0.88 C ATOM 720 NE1 TRP A 49 13.324 50.151 3.138 1.00 0.88 N ATOM 721 CE2 TRP A 49 12.430 49.477 2.339 1.00 0.88 C ATOM 722 CE3 TRP A 49 12.570 48.119 0.332 1.00 0.88 C ATOM 723 CZ2 TRP A 49 11.046 49.301 2.403 1.00 0.88 C ATOM 724 CZ3 TRP A 49 11.182 47.907 0.407 1.00 0.88 C ATOM 725 CH2 TRP A 49 10.428 48.504 1.429 1.00 0.88 C ATOM 726 H TRP A 49 17.012 48.044 3.022 1.00 0.00 H ATOM 727 HA TRP A 49 15.282 46.725 1.027 1.00 0.00 H ATOM 728 HB2 TRP A 49 16.677 49.417 1.063 1.00 0.00 H ATOM 729 HB3 TRP A 49 15.662 48.835 -0.244 1.00 0.00 H ATOM 730 HD1 TRP A 49 15.511 50.316 3.211 1.00 0.00 H ATOM 731 HE3 TRP A 49 13.142 47.648 -0.455 1.00 0.00 H ATOM 732 HZ2 TRP A 49 10.468 49.742 3.199 1.00 0.00 H ATOM 733 HZ3 TRP A 49 10.688 47.266 -0.312 1.00 0.00 H ATOM 734 HH2 TRP A 49 9.369 48.338 1.463 1.00 0.00 H ATOM 735 HE1 TRP A 49 13.093 50.633 4.009 1.00 0.00 H ATOM 736 N PRO A 50 17.119 45.803 -0.537 1.00 0.93 N ATOM 737 CA PRO A 50 18.095 45.418 -1.558 1.00 0.93 C ATOM 738 C PRO A 50 18.212 46.513 -2.632 1.00 0.93 C ATOM 739 O PRO A 50 17.484 47.509 -2.599 1.00 0.93 O ATOM 740 CB PRO A 50 17.551 44.105 -2.141 1.00 0.93 C ATOM 741 CG PRO A 50 16.040 44.307 -2.074 1.00 0.93 C ATOM 742 CD PRO A 50 15.864 45.095 -0.775 1.00 0.93 C ATOM 743 HA PRO A 50 19.076 45.244 -1.115 1.00 0.00 H ATOM 744 HB2 PRO A 50 17.837 43.272 -1.497 1.00 0.00 H ATOM 745 HB3 PRO A 50 17.885 43.920 -3.163 1.00 0.00 H ATOM 746 HG2 PRO A 50 15.505 43.356 -2.045 1.00 0.00 H ATOM 747 HG3 PRO A 50 15.710 44.907 -2.923 1.00 0.00 H ATOM 748 HD2 PRO A 50 15.690 44.400 0.046 1.00 0.00 H ATOM 749 HD3 PRO A 50 15.025 45.783 -0.882 1.00 0.00 H ATOM 750 N ASP A 51 19.069 46.284 -3.631 1.00 0.87 N ATOM 751 CA ASP A 51 18.986 47.037 -4.884 1.00 0.87 C ATOM 752 C ASP A 51 17.656 46.738 -5.620 1.00 0.87 C ATOM 753 O ASP A 51 17.106 45.640 -5.495 1.00 0.87 O ATOM 754 CB ASP A 51 20.205 46.756 -5.786 1.00 0.87 C ATOM 755 CG ASP A 51 21.582 46.999 -5.145 1.00 0.87 C ATOM 756 OD1 ASP A 51 21.732 47.879 -4.270 1.00 0.87 O ATOM 757 OD2 ASP A 51 22.492 46.182 -5.394 1.00 0.87 O ATOM 758 H ASP A 51 19.591 45.423 -3.642 1.00 0.00 H ATOM 759 HA ASP A 51 19.003 48.086 -4.611 1.00 0.00 H ATOM 760 HB2 ASP A 51 20.128 47.386 -6.673 1.00 0.00 H ATOM 761 HB3 ASP A 51 20.152 45.717 -6.115 1.00 0.00 H ATOM 762 N GLY A 52 17.119 47.700 -6.381 1.00 0.93 N ATOM 763 CA GLY A 52 15.862 47.564 -7.141 1.00 0.93 C ATOM 764 C GLY A 52 16.035 47.634 -8.661 1.00 0.93 C ATOM 765 O GLY A 52 16.754 48.507 -9.137 1.00 0.93 O ATOM 766 H GLY A 52 17.615 48.586 -6.423 1.00 0.00 H ATOM 767 HA2 GLY A 52 15.201 48.383 -6.864 1.00 0.00 H ATOM 768 HA3 GLY A 52 15.365 46.627 -6.886 1.00 0.00 H ATOM 769 N GLU A 53 15.260 46.858 -9.431 1.00 0.89 N ATOM 770 CA GLU A 53 15.207 46.997 -10.901 1.00 0.89 C ATOM 771 C GLU A 53 14.536 48.332 -11.318 1.00 0.89 C ATOM 772 O GLU A 53 13.438 48.630 -10.833 1.00 0.89 O ATOM 773 CB GLU A 53 14.439 45.829 -11.558 1.00 0.89 C ATOM 774 CG GLU A 53 15.133 44.461 -11.464 1.00 0.89 C ATOM 775 CD GLU A 53 14.437 43.357 -12.287 1.00 0.89 C ATOM 776 OE1 GLU A 53 13.302 43.581 -12.768 1.00 0.89 O ATOM 777 OE2 GLU A 53 15.075 42.293 -12.463 1.00 0.89 O ATOM 778 H GLU A 53 14.626 46.204 -8.997 1.00 0.00 H ATOM 779 HA GLU A 53 16.233 46.973 -11.270 1.00 0.00 H ATOM 780 HB2 GLU A 53 13.448 45.748 -11.111 1.00 0.00 H ATOM 781 HB3 GLU A 53 14.315 46.070 -12.615 1.00 0.00 H ATOM 782 HG2 GLU A 53 15.184 44.154 -10.416 1.00 0.00 H ATOM 783 HG3 GLU A 53 16.152 44.573 -11.835 1.00 0.00 H ATOM 784 N PRO A 54 15.077 49.105 -12.279 1.00 0.92 N ATOM 785 CA PRO A 54 14.467 50.359 -12.734 1.00 0.92 C ATOM 786 C PRO A 54 13.041 50.173 -13.281 1.00 0.92 C ATOM 787 O PRO A 54 12.818 49.454 -14.254 1.00 0.92 O ATOM 788 CB PRO A 54 15.419 50.934 -13.785 1.00 0.92 C ATOM 789 CG PRO A 54 16.222 49.717 -14.245 1.00 0.92 C ATOM 790 CD PRO A 54 16.321 48.864 -12.985 1.00 0.92 C ATOM 791 HA PRO A 54 14.426 51.059 -11.903 1.00 0.00 H ATOM 792 HB2 PRO A 54 14.885 51.396 -14.615 1.00 0.00 H ATOM 793 HB3 PRO A 54 16.075 51.664 -13.312 1.00 0.00 H ATOM 794 HG2 PRO A 54 15.651 49.173 -14.998 1.00 0.00 H ATOM 795 HG3 PRO A 54 17.207 49.995 -14.620 1.00 0.00 H ATOM 796 HD2 PRO A 54 17.155 49.203 -12.368 1.00 0.00 H ATOM 797 HD3 PRO A 54 16.441 47.812 -13.250 1.00 0.00 H ATOM 798 N GLY A 55 12.088 50.930 -12.724 1.00 0.96 N ATOM 799 CA GLY A 55 10.664 50.894 -13.081 1.00 0.96 C ATOM 800 C GLY A 55 9.813 49.841 -12.344 1.00 0.96 C ATOM 801 O GLY A 55 8.731 49.508 -12.828 1.00 0.96 O ATOM 802 H GLY A 55 12.346 51.505 -11.930 1.00 0.00 H ATOM 803 HA2 GLY A 55 10.564 50.722 -14.153 1.00 0.00 H ATOM 804 HA3 GLY A 55 10.238 51.870 -12.852 1.00 0.00 H ATOM 805 N SER A 56 10.273 49.308 -11.201 1.00 0.93 N ATOM 806 CA SER A 56 9.648 48.167 -10.496 1.00 0.93 C ATOM 807 C SER A 56 9.252 48.458 -9.036 1.00 0.93 C ATOM 808 O SER A 56 9.809 49.334 -8.373 1.00 0.93 O ATOM 809 CB SER A 56 10.571 46.943 -10.560 1.00 0.93 C ATOM 810 OG SER A 56 11.679 47.103 -9.699 1.00 0.93 O ATOM 811 H SER A 56 11.140 49.676 -10.831 1.00 0.00 H ATOM 812 HA SER A 56 8.735 47.895 -11.022 1.00 0.00 H ATOM 813 HB2 SER A 56 10.023 46.066 -10.219 1.00 0.00 H ATOM 814 HB3 SER A 56 10.899 46.784 -11.591 1.00 0.00 H ATOM 815 HG SER A 56 12.344 47.658 -10.165 1.00 0.00 H ATOM 816 N PHE A 57 8.314 47.671 -8.488 1.00 0.92 N ATOM 817 CA PHE A 57 8.113 47.597 -7.034 1.00 0.92 C ATOM 818 C PHE A 57 9.126 46.639 -6.403 1.00 0.92 C ATOM 819 O PHE A 57 9.152 45.452 -6.726 1.00 0.92 O ATOM 820 CB PHE A 57 6.680 47.178 -6.675 1.00 0.92 C ATOM 821 CG PHE A 57 5.666 48.275 -6.917 1.00 0.92 C ATOM 822 CD1 PHE A 57 5.412 49.228 -5.912 1.00 0.92 C ATOM 823 CD2 PHE A 57 5.023 48.380 -8.163 1.00 0.92 C ATOM 824 CE1 PHE A 57 4.526 50.291 -6.159 1.00 0.92 C ATOM 825 CE2 PHE A 57 4.140 49.446 -8.411 1.00 0.92 C ATOM 826 CZ PHE A 57 3.896 50.404 -7.411 1.00 0.92 C ATOM 827 H PHE A 57 7.952 46.911 -9.042 1.00 0.00 H ATOM 828 HA PHE A 57 8.274 48.585 -6.605 1.00 0.00 H ATOM 829 HB2 PHE A 57 6.403 46.285 -7.238 1.00 0.00 H ATOM 830 HB3 PHE A 57 6.648 46.918 -5.615 1.00 0.00 H ATOM 831 HD1 PHE A 57 5.903 49.148 -4.952 1.00 0.00 H ATOM 832 HD2 PHE A 57 5.220 47.651 -8.935 1.00 0.00 H ATOM 833 HE1 PHE A 57 4.332 51.023 -5.389 1.00 0.00 H ATOM 834 HE2 PHE A 57 3.656 49.532 -9.373 1.00 0.00 H ATOM 835 HZ PHE A 57 3.223 51.227 -7.603 1.00 0.00 H ATOM 836 N VAL A 58 9.814 47.118 -5.367 1.00 0.93 N ATOM 837 CA VAL A 58 10.682 46.305 -4.510 1.00 0.93 C ATOM 838 C VAL A 58 9.921 45.977 -3.231 1.00 0.93 C ATOM 839 O VAL A 58 9.477 46.889 -2.536 1.00 0.93 O ATOM 840 CB VAL A 58 12.002 47.042 -4.220 1.00 0.93 C ATOM 841 CG1 VAL A 58 12.922 46.257 -3.276 1.00 0.93 C ATOM 842 CG2 VAL A 58 12.763 47.295 -5.528 1.00 0.93 C ATOM 843 H VAL A 58 9.602 48.062 -5.057 1.00 0.00 H ATOM 844 HA VAL A 58 10.928 45.370 -5.018 1.00 0.00 H ATOM 845 HB VAL A 58 11.777 48.003 -3.756 1.00 0.00 H ATOM 846 HG11 VAL A 58 12.444 46.112 -2.307 1.00 0.00 H ATOM 847 HG12 VAL A 58 13.849 46.811 -3.121 1.00 0.00 H ATOM 848 HG13 VAL A 58 13.164 45.287 -3.710 1.00 0.00 H ATOM 849 HG21 VAL A 58 13.725 47.748 -5.309 1.00 0.00 H ATOM 850 HG22 VAL A 58 12.201 47.969 -6.176 1.00 0.00 H ATOM 851 HG23 VAL A 58 12.928 46.354 -6.055 1.00 0.00 H ATOM 852 N ASN A 59 9.767 44.689 -2.922 1.00 0.92 N ATOM 853 CA ASN A 59 9.180 44.209 -1.670 1.00 0.92 C ATOM 854 C ASN A 59 10.252 43.571 -0.776 1.00 0.92 C ATOM 855 O ASN A 59 11.194 42.959 -1.278 1.00 0.92 O ATOM 856 CB ASN A 59 8.016 43.247 -1.970 1.00 0.92 C ATOM 857 CG ASN A 59 8.444 41.926 -2.584 1.00 0.92 C ATOM 858 OD1 ASN A 59 8.835 40.992 -1.907 1.00 0.92 O ATOM 859 ND2 ASN A 59 8.327 41.783 -3.885 1.00 0.92 N ATOM 860 H ASN A 59 10.213 43.999 -3.509 1.00 0.00 H ATOM 861 HA ASN A 59 8.767 45.055 -1.119 1.00 0.00 H ATOM 862 HB2 ASN A 59 7.500 43.019 -1.042 1.00 0.00 H ATOM 863 HB3 ASN A 59 7.303 43.736 -2.630 1.00 0.00 H ATOM 864 HD21 ASN A 59 7.959 42.525 -4.450 1.00 0.00 H ATOM 865 HD22 ASN A 59 8.578 40.884 -4.253 1.00 0.00 H ATOM 866 N VAL A 60 10.057 43.648 0.541 1.00 0.94 N ATOM 867 CA VAL A 60 10.791 42.861 1.545 1.00 0.94 C ATOM 868 C VAL A 60 9.824 42.469 2.668 1.00 0.94 C ATOM 869 O VAL A 60 8.850 43.179 2.916 1.00 0.94 O ATOM 870 CB VAL A 60 12.054 43.584 2.081 1.00 0.94 C ATOM 871 CG1 VAL A 60 12.988 44.066 0.964 1.00 0.94 C ATOM 872 CG2 VAL A 60 11.780 44.800 2.970 1.00 0.94 C ATOM 873 H VAL A 60 9.270 44.197 0.877 1.00 0.00 H ATOM 874 HA VAL A 60 11.126 41.936 1.074 1.00 0.00 H ATOM 875 HB VAL A 60 12.609 42.864 2.682 1.00 0.00 H ATOM 876 HG11 VAL A 60 13.256 43.232 0.315 1.00 0.00 H ATOM 877 HG12 VAL A 60 13.893 44.478 1.398 1.00 0.00 H ATOM 878 HG13 VAL A 60 12.506 44.845 0.371 1.00 0.00 H ATOM 879 HG21 VAL A 60 12.723 45.196 3.348 1.00 0.00 H ATOM 880 HG22 VAL A 60 11.286 45.573 2.381 1.00 0.00 H ATOM 881 HG23 VAL A 60 11.159 44.516 3.817 1.00 0.00 H ATOM 882 N SER A 61 10.027 41.313 3.306 1.00 0.94 N ATOM 883 CA SER A 61 9.158 40.806 4.386 1.00 0.94 C ATOM 884 C SER A 61 8.996 41.828 5.524 1.00 0.94 C ATOM 885 O SER A 61 9.959 42.543 5.834 1.00 0.94 O ATOM 886 CB SER A 61 9.774 39.545 5.010 1.00 0.94 C ATOM 887 OG SER A 61 10.276 38.639 4.037 1.00 0.94 O ATOM 888 H SER A 61 10.776 40.710 3.006 1.00 0.00 H ATOM 889 HA SER A 61 8.174 40.568 3.974 1.00 0.00 H ATOM 890 HB2 SER A 61 10.597 39.840 5.658 1.00 0.00 H ATOM 891 HB3 SER A 61 9.016 39.047 5.618 1.00 0.00 H ATOM 892 HG SER A 61 9.867 37.783 4.197 1.00 0.00 H ATOM 893 N CYS A 62 7.939 41.689 6.341 1.00 0.94 N ATOM 894 CA CYS A 62 7.827 42.397 7.626 1.00 0.94 C ATOM 895 C CYS A 62 9.106 42.217 8.470 1.00 0.94 C ATOM 896 O CYS A 62 9.550 41.080 8.678 1.00 0.94 O ATOM 897 CB CYS A 62 6.616 41.903 8.435 1.00 0.94 C ATOM 898 SG CYS A 62 5.132 41.875 7.401 1.00 0.94 S ATOM 899 H CYS A 62 7.125 41.170 6.015 1.00 0.00 H ATOM 900 HA CYS A 62 7.671 43.448 7.399 1.00 0.00 H ATOM 901 HB2 CYS A 62 6.801 40.890 8.796 1.00 0.00 H ATOM 902 HB3 CYS A 62 6.457 42.561 9.291 1.00 0.00 H ATOM 903 HG CYS A 62 4.347 42.732 8.057 1.00 0.00 H ATOM 904 N PRO A 63 9.702 43.299 9.011 1.00 0.96 N ATOM 905 CA PRO A 63 10.920 43.169 9.795 1.00 0.96 C ATOM 906 C PRO A 63 10.723 42.267 11.021 1.00 0.96 C ATOM 907 O PRO A 63 10.000 42.592 11.956 1.00 0.96 O ATOM 908 CB PRO A 63 11.333 44.595 10.149 1.00 0.96 C ATOM 909 CG PRO A 63 10.769 45.430 9.002 1.00 0.96 C ATOM 910 CD PRO A 63 9.481 44.693 8.641 1.00 0.96 C ATOM 911 HA PRO A 63 11.680 42.741 9.142 1.00 0.00 H ATOM 912 HB2 PRO A 63 12.415 44.676 10.189 1.00 0.00 H ATOM 913 HB3 PRO A 63 10.874 44.911 11.087 1.00 0.00 H ATOM 914 HG2 PRO A 63 10.578 46.459 9.309 1.00 0.00 H ATOM 915 HG3 PRO A 63 11.458 45.403 8.156 1.00 0.00 H ATOM 916 HD2 PRO A 63 9.301 44.796 7.569 1.00 0.00 H ATOM 917 HD3 PRO A 63 8.645 45.101 9.209 1.00 0.00 H ATOM 918 N TRP A 64 11.444 41.137 11.052 1.00 0.91 N ATOM 919 CA TRP A 64 11.198 40.059 12.025 1.00 0.91 C ATOM 920 C TRP A 64 11.419 40.433 13.506 1.00 0.91 C ATOM 921 O TRP A 64 11.112 39.638 14.395 1.00 0.91 O ATOM 922 CB TRP A 64 12.042 38.843 11.610 1.00 0.91 C ATOM 923 CG TRP A 64 13.541 39.002 11.626 1.00 0.91 C ATOM 924 CD1 TRP A 64 14.316 39.043 10.517 1.00 0.91 C ATOM 925 CD2 TRP A 64 14.474 39.083 12.758 1.00 0.91 C ATOM 926 NE1 TRP A 64 15.645 39.160 10.871 1.00 0.91 N ATOM 927 CE2 TRP A 64 15.797 39.224 12.237 1.00 0.91 C ATOM 928 CE3 TRP A 64 14.359 39.023 14.167 1.00 0.91 C ATOM 929 CZ2 TRP A 64 16.927 39.355 13.055 1.00 0.91 C ATOM 930 CZ3 TRP A 64 15.487 39.143 15.001 1.00 0.91 C ATOM 931 CH2 TRP A 64 16.765 39.322 14.449 1.00 0.91 C ATOM 932 H TRP A 64 11.900 40.871 10.192 1.00 0.00 H ATOM 933 HA TRP A 64 10.147 39.774 11.944 1.00 0.00 H ATOM 934 HB2 TRP A 64 11.745 38.572 10.594 1.00 0.00 H ATOM 935 HB3 TRP A 64 11.775 37.997 12.246 1.00 0.00 H ATOM 936 HD1 TRP A 64 13.945 38.963 9.501 1.00 0.00 H ATOM 937 HE3 TRP A 64 13.392 38.853 14.612 1.00 0.00 H ATOM 938 HZ2 TRP A 64 17.906 39.457 12.611 1.00 0.00 H ATOM 939 HZ3 TRP A 64 15.375 39.076 16.072 1.00 0.00 H ATOM 940 HH2 TRP A 64 17.620 39.399 15.098 1.00 0.00 H ATOM 941 HE1 TRP A 64 16.410 39.119 10.205 1.00 0.00 H ATOM 942 N TYR A 65 11.937 41.632 13.798 1.00 0.91 N ATOM 943 CA TYR A 65 12.027 42.167 15.159 1.00 0.91 C ATOM 944 C TYR A 65 10.720 42.784 15.694 1.00 0.91 C ATOM 945 O TYR A 65 10.691 43.139 16.873 1.00 0.91 O ATOM 946 CB TYR A 65 13.183 43.174 15.235 1.00 0.91 C ATOM 947 CG TYR A 65 12.994 44.429 14.410 1.00 0.91 C ATOM 948 CD1 TYR A 65 12.209 45.486 14.905 1.00 0.91 C ATOM 949 CD2 TYR A 65 13.609 44.539 13.150 1.00 0.91 C ATOM 950 CE1 TYR A 65 12.001 46.627 14.111 1.00 0.91 C ATOM 951 CE2 TYR A 65 13.426 45.697 12.370 1.00 0.91 C ATOM 952 CZ TYR A 65 12.574 46.720 12.833 1.00 0.91 C ATOM 953 OH TYR A 65 12.328 47.822 12.088 1.00 0.91 O ATOM 954 H TYR A 65 12.063 42.278 13.031 1.00 0.00 H ATOM 955 HA TYR A 65 12.265 41.340 15.825 1.00 0.00 H ATOM 956 HB2 TYR A 65 13.313 43.474 16.274 1.00 0.00 H ATOM 957 HB3 TYR A 65 14.101 42.676 14.920 1.00 0.00 H ATOM 958 HD1 TYR A 65 11.740 45.415 15.878 1.00 0.00 H ATOM 959 HD2 TYR A 65 14.206 43.725 12.773 1.00 0.00 H ATOM 960 HE1 TYR A 65 11.403 47.447 14.459 1.00 0.00 H ATOM 961 HE2 TYR A 65 13.905 45.794 11.406 1.00 0.00 H ATOM 962 HH TYR A 65 12.615 47.713 11.163 1.00 0.00 H ATOM 963 N LEU A 66 9.678 42.972 14.869 1.00 0.92 N ATOM 964 CA LEU A 66 8.403 43.559 15.306 1.00 0.92 C ATOM 965 C LEU A 66 7.775 42.722 16.448 1.00 0.92 C ATOM 966 O LEU A 66 7.712 41.496 16.322 1.00 0.92 O ATOM 967 CB LEU A 66 7.420 43.684 14.120 1.00 0.92 C ATOM 968 CG LEU A 66 7.807 44.700 13.027 1.00 0.92 C ATOM 969 CD1 LEU A 66 6.895 44.538 11.811 1.00 0.92 C ATOM 970 CD2 LEU A 66 7.703 46.142 13.506 1.00 0.92 C ATOM 971 H LEU A 66 9.758 42.679 13.900 1.00 0.00 H ATOM 972 HA LEU A 66 8.617 44.558 15.675 1.00 0.00 H ATOM 973 HB2 LEU A 66 7.320 42.705 13.654 1.00 0.00 H ATOM 974 HB3 LEU A 66 6.435 43.957 14.503 1.00 0.00 H ATOM 975 HG LEU A 66 8.834 44.542 12.716 1.00 0.00 H ATOM 976 HD11 LEU A 66 7.190 45.237 11.032 1.00 0.00 H ATOM 977 HD12 LEU A 66 6.979 43.523 11.425 1.00 0.00 H ATOM 978 HD13 LEU A 66 5.857 44.731 12.090 1.00 0.00 H ATOM 979 HD21 LEU A 66 8.407 46.311 14.314 1.00 0.00 H ATOM 980 HD22 LEU A 66 7.949 46.809 12.682 1.00 0.00 H ATOM 981 HD23 LEU A 66 6.689 46.343 13.847 1.00 0.00 H ATOM 982 N PRO A 67 7.184 43.344 17.491 1.00 0.94 N ATOM 983 CA PRO A 67 6.517 42.620 18.581 1.00 0.94 C ATOM 984 C PRO A 67 5.379 41.696 18.116 1.00 0.94 C ATOM 985 O PRO A 67 5.178 40.633 18.697 1.00 0.94 O ATOM 986 CB PRO A 67 5.998 43.705 19.533 1.00 0.94 C ATOM 987 CG PRO A 67 6.944 44.879 19.297 1.00 0.94 C ATOM 988 CD PRO A 67 7.275 44.761 17.812 1.00 0.94 C ATOM 989 HA PRO A 67 7.260 42.015 19.099 1.00 0.00 H ATOM 990 HB2 PRO A 67 4.985 43.997 19.259 1.00 0.00 H ATOM 991 HB3 PRO A 67 6.019 43.375 20.569 1.00 0.00 H ATOM 992 HG2 PRO A 67 6.474 45.835 19.530 1.00 0.00 H ATOM 993 HG3 PRO A 67 7.851 44.741 19.886 1.00 0.00 H ATOM 994 HD2 PRO A 67 8.279 45.146 17.640 1.00 0.00 H ATOM 995 HD3 PRO A 67 6.548 45.313 17.217 1.00 0.00 H ATOM 996 N TRP A 68 4.718 42.060 17.014 1.00 0.88 N ATOM 997 CA TRP A 68 3.646 41.312 16.351 1.00 0.88 C ATOM 998 C TRP A 68 4.092 40.557 15.080 1.00 0.88 C ATOM 999 O TRP A 68 3.240 40.117 14.314 1.00 0.88 O ATOM 1000 CB TRP A 68 2.507 42.293 16.038 1.00 0.88 C ATOM 1001 CG TRP A 68 2.919 43.486 15.230 1.00 0.88 C ATOM 1002 CD1 TRP A 68 2.825 43.583 13.889 1.00 0.88 C ATOM 1003 CD2 TRP A 68 3.455 44.771 15.680 1.00 0.88 C ATOM 1004 NE1 TRP A 68 3.278 44.817 13.474 1.00 0.88 N ATOM 1005 CE2 TRP A 68 3.676 45.593 14.536 1.00 0.88 C ATOM 1006 CE3 TRP A 68 3.722 45.345 16.941 1.00 0.88 C ATOM 1007 CZ2 TRP A 68 4.157 46.907 14.632 1.00 0.88 C ATOM 1008 CZ3 TRP A 68 4.210 46.663 17.051 1.00 0.88 C ATOM 1009 CH2 TRP A 68 4.428 47.443 15.902 1.00 0.88 C ATOM 1010 H TRP A 68 4.913 42.974 16.632 1.00 0.00 H ATOM 1011 HA TRP A 68 3.256 40.562 17.039 1.00 0.00 H ATOM 1012 HB2 TRP A 68 1.710 41.770 15.507 1.00 0.00 H ATOM 1013 HB3 TRP A 68 2.079 42.647 16.977 1.00 0.00 H ATOM 1014 HD1 TRP A 68 2.377 42.841 13.236 1.00 0.00 H ATOM 1015 HE3 TRP A 68 3.461 44.784 17.825 1.00 0.00 H ATOM 1016 HZ2 TRP A 68 4.279 47.496 13.737 1.00 0.00 H ATOM 1017 HZ3 TRP A 68 4.366 47.099 18.024 1.00 0.00 H ATOM 1018 HH2 TRP A 68 4.755 48.468 15.999 1.00 0.00 H ATOM 1019 HE1 TRP A 68 3.033 45.175 12.549 1.00 0.00 H ATOM 1020 N ALA A 69 5.395 40.331 14.840 1.00 0.93 N ATOM 1021 CA ALA A 69 5.888 39.696 13.600 1.00 0.93 C ATOM 1022 C ALA A 69 5.254 38.316 13.289 1.00 0.93 C ATOM 1023 O ALA A 69 5.123 37.939 12.125 1.00 0.93 O ATOM 1024 CB ALA A 69 7.417 39.568 13.686 1.00 0.93 C ATOM 1025 H ALA A 69 6.082 40.714 15.481 1.00 0.00 H ATOM 1026 HA ALA A 69 5.650 40.350 12.762 1.00 0.00 H ATOM 1027 HB1 ALA A 69 7.873 40.549 13.809 1.00 0.00 H ATOM 1028 HB2 ALA A 69 7.796 39.125 12.765 1.00 0.00 H ATOM 1029 HB3 ALA A 69 7.696 38.937 14.531 1.00 0.00 H ATOM 1030 N SER A 70 4.800 37.583 14.313 1.00 0.90 N ATOM 1031 CA SER A 70 4.065 36.312 14.191 1.00 0.90 C ATOM 1032 C SER A 70 2.613 36.453 13.699 1.00 0.90 C ATOM 1033 O SER A 70 2.053 35.461 13.234 1.00 0.90 O ATOM 1034 CB SER A 70 4.110 35.576 15.538 1.00 0.90 C ATOM 1035 OG SER A 70 3.784 36.424 16.633 1.00 0.90 O ATOM 1036 H SER A 70 4.874 37.975 15.241 1.00 0.00 H ATOM 1037 HA SER A 70 4.572 35.693 13.455 1.00 0.00 H ATOM 1038 HB2 SER A 70 3.420 34.731 15.512 1.00 0.00 H ATOM 1039 HB3 SER A 70 5.117 35.198 15.686 1.00 0.00 H ATOM 1040 HG SER A 70 2.973 36.100 17.040 1.00 0.00 H ATOM 1041 N SER A 71 2.019 37.649 13.764 1.00 0.91 N ATOM 1042 CA SER A 71 0.701 37.985 13.200 1.00 0.91 C ATOM 1043 C SER A 71 0.760 38.434 11.732 1.00 0.91 C ATOM 1044 O SER A 71 -0.212 38.239 11.010 1.00 0.91 O ATOM 1045 CB SER A 71 0.047 39.098 14.027 1.00 0.91 C ATOM 1046 OG SER A 71 -0.058 38.721 15.391 1.00 0.91 O ATOM 1047 H SER A 71 2.528 38.413 14.191 1.00 0.00 H ATOM 1048 HA SER A 71 0.055 37.108 13.247 1.00 0.00 H ATOM 1049 HB2 SER A 71 -0.950 39.301 13.633 1.00 0.00 H ATOM 1050 HB3 SER A 71 0.640 40.011 13.949 1.00 0.00 H ATOM 1051 HG SER A 71 -0.504 39.445 15.845 1.00 0.00 H ATOM 1052 N VAL A 72 1.937 38.863 11.248 1.00 0.92 N ATOM 1053 CA VAL A 72 2.178 39.321 9.860 1.00 0.92 C ATOM 1054 C VAL A 72 3.187 38.421 9.093 1.00 0.92 C ATOM 1055 O VAL A 72 4.087 38.923 8.424 1.00 0.92 O ATOM 1056 CB VAL A 72 2.543 40.831 9.839 1.00 0.92 C ATOM 1057 CG1 VAL A 72 1.395 41.707 10.357 1.00 0.92 C ATOM 1058 CG2 VAL A 72 3.777 41.181 10.686 1.00 0.92 C ATOM 1059 H VAL A 72 2.713 38.926 11.891 1.00 0.00 H ATOM 1060 HA VAL A 72 1.245 39.238 9.302 1.00 0.00 H ATOM 1061 HB VAL A 72 2.730 41.124 8.807 1.00 0.00 H ATOM 1062 HG11 VAL A 72 1.657 42.761 10.253 1.00 0.00 H ATOM 1063 HG12 VAL A 72 0.494 41.531 9.768 1.00 0.00 H ATOM 1064 HG13 VAL A 72 1.186 41.503 11.406 1.00 0.00 H ATOM 1065 HG21 VAL A 72 4.630 40.584 10.371 1.00 0.00 H ATOM 1066 HG22 VAL A 72 4.014 42.237 10.553 1.00 0.00 H ATOM 1067 HG23 VAL A 72 3.570 41.001 11.740 1.00 0.00 H ATOM 1068 N PRO A 73 3.100 37.071 9.158 1.00 0.90 N ATOM 1069 CA PRO A 73 4.156 36.161 8.687 1.00 0.90 C ATOM 1070 C PRO A 73 4.350 36.100 7.162 1.00 0.90 C ATOM 1071 O PRO A 73 5.280 35.437 6.712 1.00 0.90 O ATOM 1072 CB PRO A 73 3.742 34.780 9.211 1.00 0.90 C ATOM 1073 CG PRO A 73 2.218 34.860 9.194 1.00 0.90 C ATOM 1074 CD PRO A 73 1.989 36.288 9.677 1.00 0.90 C ATOM 1075 HA PRO A 73 5.110 36.449 9.130 1.00 0.00 H ATOM 1076 HB2 PRO A 73 4.109 33.963 8.587 1.00 0.00 H ATOM 1077 HB3 PRO A 73 4.092 34.657 10.237 1.00 0.00 H ATOM 1078 HG2 PRO A 73 1.762 34.129 9.861 1.00 0.00 H ATOM 1079 HG3 PRO A 73 1.844 34.748 8.175 1.00 0.00 H ATOM 1080 HD2 PRO A 73 2.026 36.292 10.765 1.00 0.00 H ATOM 1081 HD3 PRO A 73 1.029 36.664 9.319 1.00 0.00 H ATOM 1082 N GLN A 74 3.384 36.606 6.384 1.00 0.86 N ATOM 1083 CA GLN A 74 3.431 36.668 4.913 1.00 0.86 C ATOM 1084 C GLN A 74 3.282 38.103 4.381 1.00 0.86 C ATOM 1085 O GLN A 74 2.952 38.262 3.212 1.00 0.86 O ATOM 1086 CB GLN A 74 2.346 35.767 4.280 1.00 0.86 C ATOM 1087 CG GLN A 74 2.359 34.294 4.704 1.00 0.86 C ATOM 1088 CD GLN A 74 3.707 33.621 4.470 1.00 0.86 C ATOM 1089 OE1 GLN A 74 4.246 33.578 3.380 1.00 0.86 O ATOM 1090 NE2 GLN A 74 4.263 32.975 5.470 1.00 0.86 N ATOM 1091 H GLN A 74 2.648 37.126 6.837 1.00 0.00 H ATOM 1092 HA GLN A 74 4.407 36.326 4.565 1.00 0.00 H ATOM 1093 HB2 GLN A 74 1.364 36.186 4.513 1.00 0.00 H ATOM 1094 HB3 GLN A 74 2.464 35.793 3.195 1.00 0.00 H ATOM 1095 HG2 GLN A 74 2.078 34.221 5.754 1.00 0.00 H ATOM 1096 HG3 GLN A 74 1.608 33.763 4.119 1.00 0.00 H ATOM 1097 HE21 GLN A 74 3.935 33.174 6.394 1.00 0.00 H ATOM 1098 HE22 GLN A 74 5.228 32.759 5.300 1.00 0.00 H ATOM 1099 N GLY A 75 3.333 39.112 5.258 1.00 0.93 N ATOM 1100 CA GLY A 75 3.238 40.501 4.825 1.00 0.93 C ATOM 1101 C GLY A 75 4.542 40.989 4.194 1.00 0.93 C ATOM 1102 O GLY A 75 5.642 40.560 4.583 1.00 0.93 O ATOM 1103 H GLY A 75 3.677 38.948 6.193 1.00 0.00 H ATOM 1104 HA2 GLY A 75 2.432 40.602 4.097 1.00 0.00 H ATOM 1105 HA3 GLY A 75 3.006 41.147 5.671 1.00 0.00 H ATOM 1106 N HIS A 76 4.422 42.056 3.412 1.00 0.92 N ATOM 1107 CA HIS A 76 5.548 42.751 2.803 1.00 0.92 C ATOM 1108 C HIS A 76 5.446 44.273 2.943 1.00 0.92 C ATOM 1109 O HIS A 76 4.374 44.871 2.960 1.00 0.92 O ATOM 1110 CB HIS A 76 5.706 42.306 1.344 1.00 0.92 C ATOM 1111 CG HIS A 76 6.073 40.849 1.185 1.00 0.92 C ATOM 1112 ND1 HIS A 76 5.195 39.770 1.269 1.00 0.92 N ATOM 1113 CD2 HIS A 76 7.331 40.363 0.977 1.00 0.92 C ATOM 1114 CE1 HIS A 76 5.931 38.665 1.122 1.00 0.92 C ATOM 1115 NE2 HIS A 76 7.223 38.990 0.940 1.00 0.92 N ATOM 1116 H HIS A 76 3.484 42.282 3.069 1.00 0.00 H ATOM 1117 HA HIS A 76 6.453 42.453 3.327 1.00 0.00 H ATOM 1118 HB2 HIS A 76 6.490 42.908 0.892 1.00 0.00 H ATOM 1119 HB3 HIS A 76 4.775 42.492 0.807 1.00 0.00 H ATOM 1120 HD2 HIS A 76 8.224 40.954 0.848 1.00 0.00 H ATOM 1121 HE1 HIS A 76 5.525 37.662 1.136 1.00 0.00 H ATOM 1122 HE2 HIS A 76 7.970 38.342 0.754 1.00 0.00 H ATOM 1123 N VAL A 77 6.607 44.916 3.055 1.00 0.94 N ATOM 1124 CA VAL A 77 6.769 46.369 2.948 1.00 0.94 C ATOM 1125 C VAL A 77 7.327 46.694 1.563 1.00 0.94 C ATOM 1126 O VAL A 77 8.282 46.054 1.112 1.00 0.94 O ATOM 1127 CB VAL A 77 7.612 46.919 4.121 1.00 0.94 C ATOM 1128 CG1 VAL A 77 9.003 46.310 4.285 1.00 0.94 C ATOM 1129 CG2 VAL A 77 7.774 48.435 4.102 1.00 0.94 C ATOM 1130 H VAL A 77 7.448 44.354 2.981 1.00 0.00 H ATOM 1131 HA VAL A 77 5.783 46.833 3.018 1.00 0.00 H ATOM 1132 HB VAL A 77 7.081 46.698 5.036 1.00 0.00 H ATOM 1133 HG11 VAL A 77 8.919 45.231 4.415 1.00 0.00 H ATOM 1134 HG12 VAL A 77 9.599 46.535 3.404 1.00 0.00 H ATOM 1135 HG13 VAL A 77 9.491 46.715 5.170 1.00 0.00 H ATOM 1136 HG21 VAL A 77 8.082 48.795 3.125 1.00 0.00 H ATOM 1137 HG22 VAL A 77 8.496 48.746 4.854 1.00 0.00 H ATOM 1138 HG23 VAL A 77 6.811 48.866 4.336 1.00 0.00 H ATOM 1139 N TYR A 78 6.781 47.724 0.912 1.00 0.91 N ATOM 1140 CA TYR A 78 7.106 48.080 -0.475 1.00 0.91 C ATOM 1141 C TYR A 78 7.848 49.418 -0.605 1.00 0.91 C ATOM 1142 O TYR A 78 7.503 50.396 0.060 1.00 0.91 O ATOM 1143 CB TYR A 78 5.830 48.090 -1.328 1.00 0.91 C ATOM 1144 CG TYR A 78 5.020 46.810 -1.246 1.00 0.91 C ATOM 1145 CD1 TYR A 78 5.303 45.733 -2.108 1.00 0.91 C ATOM 1146 CD2 TYR A 78 3.999 46.691 -0.284 1.00 0.91 C ATOM 1147 CE1 TYR A 78 4.562 44.537 -2.005 1.00 0.91 C ATOM 1148 CE2 TYR A 78 3.261 45.499 -0.181 1.00 0.91 C ATOM 1149 CZ TYR A 78 3.537 44.416 -1.041 1.00 0.91 C ATOM 1150 OH TYR A 78 2.823 43.264 -0.961 1.00 0.91 O ATOM 1151 H TYR A 78 5.982 48.181 1.345 1.00 0.00 H ATOM 1152 HA TYR A 78 7.749 47.304 -0.884 1.00 0.00 H ATOM 1153 HB2 TYR A 78 5.200 48.924 -1.017 1.00 0.00 H ATOM 1154 HB3 TYR A 78 6.106 48.262 -2.370 1.00 0.00 H ATOM 1155 HD1 TYR A 78 6.085 45.825 -2.847 1.00 0.00 H ATOM 1156 HD2 TYR A 78 3.776 47.504 0.391 1.00 0.00 H ATOM 1157 HE1 TYR A 78 4.755 43.700 -2.656 1.00 0.00 H ATOM 1158 HE2 TYR A 78 2.482 45.408 0.561 1.00 0.00 H ATOM 1159 HH TYR A 78 2.135 43.306 -0.254 1.00 0.00 H ATOM 1160 N ARG A 79 8.714 49.508 -1.620 1.00 0.88 N ATOM 1161 CA ARG A 79 9.169 50.743 -2.288 1.00 0.88 C ATOM 1162 C ARG A 79 8.883 50.657 -3.788 1.00 0.88 C ATOM 1163 O ARG A 79 8.679 49.567 -4.317 1.00 0.88 O ATOM 1164 CB ARG A 79 10.673 50.963 -2.055 1.00 0.88 C ATOM 1165 CG ARG A 79 10.990 51.527 -0.671 1.00 0.88 C ATOM 1166 CD ARG A 79 12.496 51.794 -0.581 1.00 0.88 C ATOM 1167 NE ARG A 79 12.892 52.241 0.765 1.00 0.88 N ATOM 1168 CZ ARG A 79 13.933 52.995 1.055 1.00 0.88 C ATOM 1169 NH1 ARG A 79 14.177 53.322 2.289 1.00 0.88 N ATOM 1170 NH2 ARG A 79 14.734 53.468 0.144 1.00 0.88 N ATOM 1171 H ARG A 79 8.923 48.634 -2.101 1.00 0.00 H ATOM 1172 HA ARG A 79 8.613 51.599 -1.901 1.00 0.00 H ATOM 1173 HB2 ARG A 79 11.041 51.683 -2.785 1.00 0.00 H ATOM 1174 HB3 ARG A 79 11.211 50.024 -2.204 1.00 0.00 H ATOM 1175 HG2 ARG A 79 10.452 52.463 -0.533 1.00 0.00 H ATOM 1176 HG3 ARG A 79 10.680 50.820 0.095 1.00 0.00 H ATOM 1177 HD2 ARG A 79 13.039 50.879 -0.828 1.00 0.00 H ATOM 1178 HD3 ARG A 79 12.745 52.561 -1.315 1.00 0.00 H ATOM 1179 HE ARG A 79 12.450 51.773 1.541 1.00 0.00 H ATOM 1180 HH11 ARG A 79 13.602 52.938 3.042 1.00 0.00 H ATOM 1181 HH12 ARG A 79 14.983 53.862 2.523 1.00 0.00 H ATOM 1182 HH21 ARG A 79 14.620 53.152 -0.809 1.00 0.00 H ATOM 1183 HH22 ARG A 79 15.565 53.961 0.398 1.00 0.00 H ATOM 1184 N PHE A 80 9.017 51.779 -4.493 1.00 0.91 N ATOM 1185 CA PHE A 80 9.068 51.792 -5.955 1.00 0.91 C ATOM 1186 C PHE A 80 10.403 52.355 -6.436 1.00 0.91 C ATOM 1187 O PHE A 80 10.863 53.399 -5.965 1.00 0.91 O ATOM 1188 CB PHE A 80 7.867 52.536 -6.543 1.00 0.91 C ATOM 1189 CG PHE A 80 7.802 52.464 -8.060 1.00 0.91 C ATOM 1190 CD1 PHE A 80 7.344 51.286 -8.677 1.00 0.91 C ATOM 1191 CD2 PHE A 80 8.221 53.545 -8.861 1.00 0.91 C ATOM 1192 CE1 PHE A 80 7.308 51.185 -10.079 1.00 0.91 C ATOM 1193 CE2 PHE A 80 8.168 53.452 -10.263 1.00 0.91 C ATOM 1194 CZ PHE A 80 7.717 52.268 -10.872 1.00 0.91 C ATOM 1195 H PHE A 80 9.308 52.616 -4.014 1.00 0.00 H ATOM 1196 HA PHE A 80 9.008 50.768 -6.328 1.00 0.00 H ATOM 1197 HB2 PHE A 80 6.957 52.093 -6.139 1.00 0.00 H ATOM 1198 HB3 PHE A 80 7.900 53.577 -6.226 1.00 0.00 H ATOM 1199 HD1 PHE A 80 7.038 50.446 -8.073 1.00 0.00 H ATOM 1200 HD2 PHE A 80 8.590 54.449 -8.407 1.00 0.00 H ATOM 1201 HE1 PHE A 80 6.978 50.269 -10.549 1.00 0.00 H ATOM 1202 HE2 PHE A 80 8.482 54.284 -10.875 1.00 0.00 H ATOM 1203 HZ PHE A 80 7.693 52.183 -11.950 1.00 0.00 H ATOM 1204 N CYS A 81 11.067 51.575 -7.275 1.00 0.94 N ATOM 1205 CA CYS A 81 12.297 51.914 -7.963 1.00 0.94 C ATOM 1206 C CYS A 81 11.948 52.580 -9.307 1.00 0.94 C ATOM 1207 O CYS A 81 11.368 51.932 -10.178 1.00 0.94 O ATOM 1208 CB CYS A 81 13.073 50.600 -8.113 1.00 0.94 C ATOM 1209 SG CYS A 81 14.495 50.903 -9.169 1.00 0.94 S ATOM 1210 H CYS A 81 10.581 50.758 -7.635 1.00 0.00 H ATOM 1211 HA CYS A 81 12.894 52.606 -7.367 1.00 0.00 H ATOM 1212 HB2 CYS A 81 13.430 50.260 -7.142 1.00 0.00 H ATOM 1213 HB3 CYS A 81 12.439 49.831 -8.568 1.00 0.00 H ATOM 1214 HG CYS A 81 13.765 50.691 -10.277 1.00 0.00 H ATOM 1215 N THR A 82 12.224 53.881 -9.465 1.00 0.91 N ATOM 1216 CA THR A 82 11.928 54.630 -10.712 1.00 0.91 C ATOM 1217 C THR A 82 12.842 54.215 -11.877 1.00 0.91 C ATOM 1218 O THR A 82 13.799 53.464 -11.685 1.00 0.91 O ATOM 1219 CB THR A 82 11.957 56.163 -10.517 1.00 0.91 C ATOM 1220 OG1 THR A 82 13.228 56.652 -10.172 1.00 0.91 O ATOM 1221 CG2 THR A 82 10.981 56.661 -9.446 1.00 0.91 C ATOM 1222 H THR A 82 12.787 54.337 -8.759 1.00 0.00 H ATOM 1223 HA THR A 82 10.916 54.369 -11.016 1.00 0.00 H ATOM 1224 HB THR A 82 11.681 56.623 -11.460 1.00 0.00 H ATOM 1225 HG1 THR A 82 13.378 56.387 -9.244 1.00 0.00 H ATOM 1226 HG21 THR A 82 11.008 57.751 -9.447 1.00 0.00 H ATOM 1227 HG22 THR A 82 11.260 56.302 -8.452 1.00 0.00 H ATOM 1228 HG23 THR A 82 9.972 56.329 -9.681 1.00 0.00 H ATOM 1229 N ALA A 83 12.503 54.599 -13.114 1.00 0.93 N ATOM 1230 CA ALA A 83 13.310 54.242 -14.292 1.00 0.93 C ATOM 1231 C ALA A 83 14.694 54.933 -14.300 1.00 0.93 C ATOM 1232 O ALA A 83 15.647 54.440 -14.897 1.00 0.93 O ATOM 1233 CB ALA A 83 12.493 54.563 -15.550 1.00 0.93 C ATOM 1234 H ALA A 83 11.829 55.346 -13.229 1.00 0.00 H ATOM 1235 HA ALA A 83 13.492 53.169 -14.272 1.00 0.00 H ATOM 1236 HB1 ALA A 83 13.065 54.283 -16.435 1.00 0.00 H ATOM 1237 HB2 ALA A 83 12.267 55.631 -15.594 1.00 0.00 H ATOM 1238 HB3 ALA A 83 11.563 53.994 -15.538 1.00 0.00 H ATOM 1239 N GLU A 84 14.813 56.023 -13.543 1.00 0.85 N ATOM 1240 CA GLU A 84 15.993 56.858 -13.334 1.00 0.85 C ATOM 1241 C GLU A 84 16.981 56.308 -12.275 1.00 0.85 C ATOM 1242 O GLU A 84 17.938 56.999 -11.924 1.00 0.85 O ATOM 1243 CB GLU A 84 15.494 58.267 -12.936 1.00 0.85 C ATOM 1244 CG GLU A 84 14.642 59.014 -13.987 1.00 0.85 C ATOM 1245 CD GLU A 84 13.201 58.508 -14.245 1.00 0.85 C ATOM 1246 OE1 GLU A 84 12.664 57.700 -13.444 1.00 0.85 O ATOM 1247 OE2 GLU A 84 12.627 58.947 -15.264 1.00 0.85 O ATOM 1248 H GLU A 84 13.937 56.416 -13.198 1.00 0.00 H ATOM 1249 HA GLU A 84 16.544 56.932 -14.272 1.00 0.00 H ATOM 1250 HB2 GLU A 84 16.372 58.889 -12.753 1.00 0.00 H ATOM 1251 HB3 GLU A 84 14.945 58.209 -11.994 1.00 0.00 H ATOM 1252 HG2 GLU A 84 14.571 60.055 -13.662 1.00 0.00 H ATOM 1253 HG3 GLU A 84 15.196 59.015 -14.929 1.00 0.00 H ATOM 1254 N GLY A 85 16.696 55.153 -11.650 1.00 0.91 N ATOM 1255 CA GLY A 85 17.483 54.604 -10.531 1.00 0.91 C ATOM 1256 C GLY A 85 17.306 55.338 -9.191 1.00 0.91 C ATOM 1257 O GLY A 85 18.035 55.073 -8.233 1.00 0.91 O ATOM 1258 H GLY A 85 15.914 54.606 -11.988 1.00 0.00 H ATOM 1259 HA2 GLY A 85 18.544 54.608 -10.787 1.00 0.00 H ATOM 1260 HA3 GLY A 85 17.180 53.567 -10.378 1.00 0.00 H ATOM 1261 N LEU A 86 16.306 56.223 -9.068 1.00 0.87 N ATOM 1262 CA LEU A 86 15.942 56.872 -7.801 1.00 0.87 C ATOM 1263 C LEU A 86 14.757 56.177 -7.112 1.00 0.87 C ATOM 1264 O LEU A 86 13.763 55.833 -7.760 1.00 0.87 O ATOM 1265 CB LEU A 86 15.666 58.367 -8.031 1.00 0.87 C ATOM 1266 CG LEU A 86 16.871 59.170 -8.559 1.00 0.87 C ATOM 1267 CD1 LEU A 86 16.406 60.596 -8.862 1.00 0.87 C ATOM 1268 CD2 LEU A 86 18.011 59.251 -7.536 1.00 0.87 C ATOM 1269 H LEU A 86 15.746 56.405 -9.891 1.00 0.00 H ATOM 1270 HA LEU A 86 16.784 56.798 -7.119 1.00 0.00 H ATOM 1271 HB2 LEU A 86 14.845 58.462 -8.744 1.00 0.00 H ATOM 1272 HB3 LEU A 86 15.342 58.809 -7.087 1.00 0.00 H ATOM 1273 HG LEU A 86 17.249 58.729 -9.481 1.00 0.00 H ATOM 1274 HD21 LEU A 86 18.432 58.259 -7.375 1.00 0.00 H ATOM 1275 HD22 LEU A 86 18.805 59.890 -7.925 1.00 0.00 H ATOM 1276 HD23 LEU A 86 17.647 59.657 -6.593 1.00 0.00 H ATOM 1277 HD11 LEU A 86 17.236 61.177 -9.262 1.00 0.00 H ATOM 1278 HD12 LEU A 86 15.616 60.560 -9.614 1.00 0.00 H ATOM 1279 HD13 LEU A 86 16.026 61.067 -7.956 1.00 0.00 H ATOM 1280 N TRP A 87 14.802 56.040 -5.781 1.00 0.84 N ATOM 1281 CA TRP A 87 13.607 55.586 -5.070 1.00 0.84 C ATOM 1282 C TRP A 87 12.506 56.639 -5.243 1.00 0.84 C ATOM 1283 O TRP A 87 12.784 57.835 -5.129 1.00 0.84 O ATOM 1284 CB TRP A 87 13.911 55.330 -3.592 1.00 0.84 C ATOM 1285 CG TRP A 87 14.821 54.171 -3.292 1.00 0.84 C ATOM 1286 CD1 TRP A 87 16.086 54.276 -2.820 1.00 0.84 C ATOM 1287 CD2 TRP A 87 14.589 52.735 -3.478 1.00 0.84 C ATOM 1288 NE1 TRP A 87 16.630 53.016 -2.658 1.00 0.84 N ATOM 1289 CE2 TRP A 87 15.750 52.034 -3.036 1.00 0.84 C ATOM 1290 CE3 TRP A 87 13.539 51.946 -3.999 1.00 0.84 C ATOM 1291 CZ2 TRP A 87 15.874 50.642 -3.102 1.00 0.84 C ATOM 1292 CZ3 TRP A 87 13.653 50.542 -4.078 1.00 0.84 C ATOM 1293 CH2 TRP A 87 14.818 49.891 -3.631 1.00 0.84 C ATOM 1294 H TRP A 87 15.610 56.346 -5.258 1.00 0.00 H ATOM 1295 HA TRP A 87 13.258 54.656 -5.524 1.00 0.00 H ATOM 1296 HB2 TRP A 87 14.356 56.240 -3.186 1.00 0.00 H ATOM 1297 HB3 TRP A 87 12.965 55.162 -3.072 1.00 0.00 H ATOM 1298 HD1 TRP A 87 16.600 55.210 -2.633 1.00 0.00 H ATOM 1299 HE3 TRP A 87 12.658 52.431 -4.390 1.00 0.00 H ATOM 1300 HZ2 TRP A 87 16.796 50.155 -2.808 1.00 0.00 H ATOM 1301 HZ3 TRP A 87 12.856 49.963 -4.521 1.00 0.00 H ATOM 1302 HH2 TRP A 87 14.934 48.819 -3.725 1.00 0.00 H ATOM 1303 HE1 TRP A 87 17.622 52.821 -2.497 1.00 0.00 H ATOM 1304 N LEU A 88 11.269 56.216 -5.517 1.00 0.87 N ATOM 1305 CA LEU A 88 10.126 57.126 -5.567 1.00 0.87 C ATOM 1306 C LEU A 88 10.059 57.921 -4.260 1.00 0.87 C ATOM 1307 O LEU A 88 10.177 57.334 -3.188 1.00 0.87 O ATOM 1308 CB LEU A 88 8.843 56.314 -5.797 1.00 0.87 C ATOM 1309 CG LEU A 88 7.568 57.170 -5.914 1.00 0.87 C ATOM 1310 CD1 LEU A 88 7.550 57.983 -7.210 1.00 0.87 C ATOM 1311 CD2 LEU A 88 6.339 56.268 -5.913 1.00 0.87 C ATOM 1312 H LEU A 88 11.107 55.224 -5.661 1.00 0.00 H ATOM 1313 HA LEU A 88 10.275 57.818 -6.396 1.00 0.00 H ATOM 1314 HB2 LEU A 88 8.724 55.622 -4.961 1.00 0.00 H ATOM 1315 HB3 LEU A 88 8.963 55.729 -6.705 1.00 0.00 H ATOM 1316 HG LEU A 88 7.495 57.846 -5.063 1.00 0.00 H ATOM 1317 HD11 LEU A 88 8.380 58.685 -7.235 1.00 0.00 H ATOM 1318 HD12 LEU A 88 7.611 57.317 -8.071 1.00 0.00 H ATOM 1319 HD13 LEU A 88 6.621 58.553 -7.266 1.00 0.00 H ATOM 1320 HD21 LEU A 88 5.441 56.884 -5.975 1.00 0.00 H ATOM 1321 HD22 LEU A 88 6.369 55.587 -6.763 1.00 0.00 H ATOM 1322 HD23 LEU A 88 6.301 55.692 -4.988 1.00 0.00 H ATOM 1323 N GLN A 89 9.948 59.245 -4.342 1.00 0.79 N ATOM 1324 CA GLN A 89 9.935 60.135 -3.178 1.00 0.79 C ATOM 1325 C GLN A 89 8.499 60.495 -2.782 1.00 0.79 C ATOM 1326 O GLN A 89 7.588 60.469 -3.608 1.00 0.79 O ATOM 1327 CB GLN A 89 10.802 61.379 -3.448 1.00 0.79 C ATOM 1328 CG GLN A 89 12.282 61.004 -3.648 1.00 0.79 C ATOM 1329 CD GLN A 89 13.115 62.150 -4.210 1.00 0.79 C ATOM 1330 OE1 GLN A 89 13.382 63.148 -3.566 1.00 0.79 O ATOM 1331 NE2 GLN A 89 13.628 62.025 -5.415 1.00 0.79 N ATOM 1332 H GLN A 89 9.829 59.662 -5.251 1.00 0.00 H ATOM 1333 HA GLN A 89 10.377 59.618 -2.328 1.00 0.00 H ATOM 1334 HB2 GLN A 89 10.429 61.885 -4.340 1.00 0.00 H ATOM 1335 HB3 GLN A 89 10.727 62.067 -2.604 1.00 0.00 H ATOM 1336 HG2 GLN A 89 12.710 60.684 -2.698 1.00 0.00 H ATOM 1337 HG3 GLN A 89 12.357 60.173 -4.344 1.00 0.00 H ATOM 1338 HE21 GLN A 89 13.466 61.193 -5.954 1.00 0.00 H ATOM 1339 HE22 GLN A 89 14.196 62.789 -5.730 1.00 0.00 H ATOM 1340 N LYS A 90 8.293 60.828 -1.505 1.00 0.63 N ATOM 1341 CA LYS A 90 7.067 61.496 -1.048 1.00 0.63 C ATOM 1342 C LYS A 90 7.061 62.946 -1.540 1.00 0.63 C ATOM 1343 O LYS A 90 8.095 63.607 -1.463 1.00 0.63 O ATOM 1344 CB LYS A 90 6.974 61.472 0.484 1.00 0.63 C ATOM 1345 CG LYS A 90 6.985 60.060 1.094 1.00 0.63 C ATOM 1346 CD LYS A 90 6.435 60.051 2.528 1.00 0.63 C ATOM 1347 CE LYS A 90 7.194 61.020 3.445 1.00 0.63 C ATOM 1348 NZ LYS A 90 6.539 61.136 4.772 1.00 0.63 N ATOM 1349 H LYS A 90 9.110 60.857 -0.902 1.00 0.00 H ATOM 1350 HA LYS A 90 6.202 60.990 -1.482 1.00 0.00 H ATOM 1351 HB2 LYS A 90 6.049 61.976 0.770 1.00 0.00 H ATOM 1352 HB3 LYS A 90 7.813 62.038 0.894 1.00 0.00 H ATOM 1353 HG2 LYS A 90 6.368 59.399 0.485 1.00 0.00 H ATOM 1354 HG3 LYS A 90 8.006 59.678 1.099 1.00 0.00 H ATOM 1355 HD2 LYS A 90 6.513 59.036 2.924 1.00 0.00 H ATOM 1356 HD3 LYS A 90 5.380 60.329 2.492 1.00 0.00 H ATOM 1357 HE2 LYS A 90 7.220 62.003 2.964 1.00 0.00 H ATOM 1358 HE3 LYS A 90 8.224 60.665 3.549 1.00 0.00 H ATOM 1359 HZ1 LYS A 90 7.044 61.780 5.367 1.00 0.00 H ATOM 1360 HZ2 LYS A 90 5.591 61.477 4.661 1.00 0.00 H ATOM 1361 HZ3 LYS A 90 6.501 60.232 5.226 1.00 0.00 H ATOM 1362 N ASP A 91 5.870 63.513 -1.715 1.00 0.66 N ATOM 1363 CA ASP A 91 5.713 64.943 -2.002 1.00 0.66 C ATOM 1364 C ASP A 91 6.361 65.852 -0.943 1.00 0.66 C ATOM 1365 O ASP A 91 6.382 65.548 0.255 1.00 0.66 O ATOM 1366 CB ASP A 91 4.230 65.313 -2.153 1.00 0.66 C ATOM 1367 CG ASP A 91 3.469 64.374 -3.087 1.00 0.66 C ATOM 1368 OD1 ASP A 91 4.053 64.034 -4.136 1.00 0.66 O ATOM 1369 OD2 ASP A 91 2.466 63.807 -2.602 1.00 0.66 O ATOM 1370 H ASP A 91 5.072 62.919 -1.894 1.00 0.00 H ATOM 1371 HA ASP A 91 6.200 65.129 -2.962 1.00 0.00 H ATOM 1372 HB2 ASP A 91 3.764 65.297 -1.166 1.00 0.00 H ATOM 1373 HB3 ASP A 91 4.163 66.330 -2.543 1.00 0.00 H ATOM 1374 N ASN A 92 6.820 67.027 -1.392 1.00 0.60 N ATOM 1375 CA ASN A 92 7.456 68.062 -0.563 1.00 0.60 C ATOM 1376 C ASN A 92 8.663 67.560 0.268 1.00 0.60 C ATOM 1377 O ASN A 92 8.921 68.072 1.358 1.00 0.60 O ATOM 1378 CB ASN A 92 6.385 68.797 0.272 1.00 0.60 C ATOM 1379 CG ASN A 92 5.214 69.290 -0.559 1.00 0.60 C ATOM 1380 OD1 ASN A 92 5.375 69.984 -1.547 1.00 0.60 O ATOM 1381 ND2 ASN A 92 3.998 68.970 -0.179 1.00 0.60 N ATOM 1382 H ASN A 92 6.701 67.224 -2.376 1.00 0.00 H ATOM 1383 HA ASN A 92 7.872 68.795 -1.254 1.00 0.00 H ATOM 1384 HB2 ASN A 92 6.837 69.662 0.755 1.00 0.00 H ATOM 1385 HB3 ASN A 92 6.023 68.128 1.053 1.00 0.00 H ATOM 1386 HD21 ASN A 92 3.862 68.328 0.579 1.00 0.00 H ATOM 1387 HD22 ASN A 92 3.258 69.254 -0.795 1.00 0.00 H ATOM 1388 N SER A 93 9.364 66.514 -0.200 1.00 0.57 N ATOM 1389 CA SER A 93 10.333 65.765 0.607 1.00 0.57 C ATOM 1390 C SER A 93 11.441 65.099 -0.223 1.00 0.57 C ATOM 1391 O SER A 93 11.242 64.792 -1.390 1.00 0.57 O ATOM 1392 CB SER A 93 9.557 64.700 1.380 1.00 0.57 C ATOM 1393 OG SER A 93 10.373 64.083 2.357 1.00 0.57 O ATOM 1394 H SER A 93 9.062 66.071 -1.061 1.00 0.00 H ATOM 1395 HA SER A 93 10.801 66.442 1.321 1.00 0.00 H ATOM 1396 HB2 SER A 93 9.188 63.945 0.686 1.00 0.00 H ATOM 1397 HB3 SER A 93 8.704 65.166 1.876 1.00 0.00 H ATOM 1398 HG SER A 93 9.783 63.718 3.017 1.00 0.00 H ATOM 1399 N SER A 94 12.565 64.776 0.430 1.00 0.68 N ATOM 1400 CA SER A 94 13.614 63.864 -0.082 1.00 0.68 C ATOM 1401 C SER A 94 13.400 62.397 0.362 1.00 0.68 C ATOM 1402 O SER A 94 14.185 61.500 0.063 1.00 0.68 O ATOM 1403 CB SER A 94 14.982 64.398 0.375 1.00 0.68 C ATOM 1404 OG SER A 94 16.061 63.754 -0.268 1.00 0.68 O ATOM 1405 H SER A 94 12.600 65.022 1.406 1.00 0.00 H ATOM 1406 HA SER A 94 13.596 63.877 -1.172 1.00 0.00 H ATOM 1407 HB2 SER A 94 15.078 64.261 1.453 1.00 0.00 H ATOM 1408 HB3 SER A 94 15.038 65.464 0.151 1.00 0.00 H ATOM 1409 HG SER A 94 16.888 64.177 -0.030 1.00 0.00 H ATOM 1410 N LEU A 95 12.415 62.152 1.236 1.00 0.71 N ATOM 1411 CA LEU A 95 12.172 60.833 1.827 1.00 0.71 C ATOM 1412 C LEU A 95 11.514 59.891 0.807 1.00 0.71 C ATOM 1413 O LEU A 95 10.529 60.298 0.185 1.00 0.71 O ATOM 1414 CB LEU A 95 11.297 60.964 3.086 1.00 0.71 C ATOM 1415 CG LEU A 95 11.943 61.771 4.228 1.00 0.71 C ATOM 1416 CD1 LEU A 95 10.900 62.015 5.321 1.00 0.71 C ATOM 1417 CD2 LEU A 95 13.126 61.035 4.858 1.00 0.71 C ATOM 1418 H LEU A 95 11.747 62.891 1.411 1.00 0.00 H ATOM 1419 HA LEU A 95 13.137 60.414 2.106 1.00 0.00 H ATOM 1420 HB2 LEU A 95 11.057 59.965 3.453 1.00 0.00 H ATOM 1421 HB3 LEU A 95 10.360 61.438 2.794 1.00 0.00 H ATOM 1422 HG LEU A 95 12.284 62.737 3.859 1.00 0.00 H ATOM 1423 HD11 LEU A 95 10.062 62.577 4.918 1.00 0.00 H ATOM 1424 HD12 LEU A 95 11.355 62.597 6.124 1.00 0.00 H ATOM 1425 HD13 LEU A 95 10.559 61.062 5.727 1.00 0.00 H ATOM 1426 HD21 LEU A 95 13.517 61.617 5.693 1.00 0.00 H ATOM 1427 HD22 LEU A 95 13.925 60.913 4.127 1.00 0.00 H ATOM 1428 HD23 LEU A 95 12.814 60.056 5.222 1.00 0.00 H ATOM 1429 N PRO A 96 11.890 58.597 0.773 1.00 0.85 N ATOM 1430 CA PRO A 96 11.258 57.629 -0.110 1.00 0.85 C ATOM 1431 C PRO A 96 9.791 57.405 0.277 1.00 0.85 C ATOM 1432 O PRO A 96 9.439 57.319 1.460 1.00 0.85 O ATOM 1433 CB PRO A 96 12.096 56.349 -0.014 1.00 0.85 C ATOM 1434 CG PRO A 96 12.716 56.443 1.379 1.00 0.85 C ATOM 1435 CD PRO A 96 12.901 57.947 1.592 1.00 0.85 C ATOM 1436 HA PRO A 96 11.308 57.999 -1.132 1.00 0.00 H ATOM 1437 HB2 PRO A 96 11.494 55.446 -0.132 1.00 0.00 H ATOM 1438 HB3 PRO A 96 12.887 56.376 -0.766 1.00 0.00 H ATOM 1439 HG2 PRO A 96 12.017 56.045 2.117 1.00 0.00 H ATOM 1440 HG3 PRO A 96 13.670 55.922 1.430 1.00 0.00 H ATOM 1441 HD2 PRO A 96 12.772 58.188 2.648 1.00 0.00 H ATOM 1442 HD3 PRO A 96 13.891 58.251 1.250 1.00 0.00 H ATOM 1443 N TRP A 97 8.950 57.217 -0.736 1.00 0.81 N ATOM 1444 CA TRP A 97 7.660 56.565 -0.594 1.00 0.81 C ATOM 1445 C TRP A 97 7.865 55.124 -0.120 1.00 0.81 C ATOM 1446 O TRP A 97 8.777 54.428 -0.573 1.00 0.81 O ATOM 1447 CB TRP A 97 6.882 56.621 -1.917 1.00 0.81 C ATOM 1448 CG TRP A 97 5.614 55.818 -1.913 1.00 0.81 C ATOM 1449 CD1 TRP A 97 4.411 56.291 -1.518 1.00 0.81 C ATOM 1450 CD2 TRP A 97 5.400 54.399 -2.231 1.00 0.81 C ATOM 1451 NE1 TRP A 97 3.480 55.274 -1.542 1.00 0.81 N ATOM 1452 CE2 TRP A 97 4.031 54.090 -1.971 1.00 0.81 C ATOM 1453 CE3 TRP A 97 6.206 53.338 -2.710 1.00 0.81 C ATOM 1454 CZ2 TRP A 97 3.489 52.814 -2.165 1.00 0.81 C ATOM 1455 CZ3 TRP A 97 5.665 52.049 -2.918 1.00 0.81 C ATOM 1456 CH2 TRP A 97 4.313 51.786 -2.641 1.00 0.81 C ATOM 1457 H TRP A 97 9.352 57.224 -1.667 1.00 0.00 H ATOM 1458 HA TRP A 97 7.085 57.096 0.161 1.00 0.00 H ATOM 1459 HB2 TRP A 97 7.517 56.260 -2.728 1.00 0.00 H ATOM 1460 HB3 TRP A 97 6.636 57.663 -2.132 1.00 0.00 H ATOM 1461 HD1 TRP A 97 4.216 57.311 -1.211 1.00 0.00 H ATOM 1462 HE3 TRP A 97 7.246 53.526 -2.924 1.00 0.00 H ATOM 1463 HZ2 TRP A 97 2.446 52.624 -1.949 1.00 0.00 H ATOM 1464 HZ3 TRP A 97 6.280 51.247 -3.297 1.00 0.00 H ATOM 1465 HH2 TRP A 97 3.901 50.796 -2.795 1.00 0.00 H ATOM 1466 HE1 TRP A 97 2.510 55.384 -1.281 1.00 0.00 H ATOM 1467 N ARG A 98 7.026 54.698 0.824 1.00 0.81 N ATOM 1468 CA ARG A 98 6.954 53.318 1.301 1.00 0.81 C ATOM 1469 C ARG A 98 5.504 53.000 1.634 1.00 0.81 C ATOM 1470 O ARG A 98 4.885 53.797 2.340 1.00 0.81 O ATOM 1471 CB ARG A 98 7.827 53.084 2.551 1.00 0.81 C ATOM 1472 CG ARG A 98 9.310 53.481 2.447 1.00 0.81 C ATOM 1473 CD ARG A 98 10.080 53.230 3.756 1.00 0.81 C ATOM 1474 NE ARG A 98 9.531 53.998 4.892 1.00 0.81 N ATOM 1475 CZ ARG A 98 10.015 54.069 6.121 1.00 0.81 C ATOM 1476 NH1 ARG A 98 11.109 53.467 6.490 1.00 0.81 N ATOM 1477 NH2 ARG A 98 9.369 54.771 7.010 1.00 0.81 N ATOM 1478 H ARG A 98 6.259 55.301 1.086 1.00 0.00 H ATOM 1479 HA ARG A 98 7.273 52.657 0.497 1.00 0.00 H ATOM 1480 HB2 ARG A 98 7.377 53.635 3.377 1.00 0.00 H ATOM 1481 HB3 ARG A 98 7.783 52.020 2.784 1.00 0.00 H ATOM 1482 HG2 ARG A 98 9.397 54.538 2.196 1.00 0.00 H ATOM 1483 HG3 ARG A 98 9.776 52.896 1.656 1.00 0.00 H ATOM 1484 HD2 ARG A 98 11.112 53.536 3.589 1.00 0.00 H ATOM 1485 HD3 ARG A 98 10.059 52.163 3.989 1.00 0.00 H ATOM 1486 HE ARG A 98 8.680 54.500 4.708 1.00 0.00 H ATOM 1487 HH11 ARG A 98 11.663 52.961 5.796 1.00 0.00 H ATOM 1488 HH12 ARG A 98 11.470 53.540 7.425 1.00 0.00 H ATOM 1489 HH21 ARG A 98 8.502 55.211 6.778 1.00 0.00 H ATOM 1490 HH22 ARG A 98 9.762 54.956 7.928 1.00 0.00 H ATOM 1491 N ASP A 99 5.064 51.788 1.331 1.00 0.90 N ATOM 1492 CA ASP A 99 3.848 51.214 1.912 1.00 0.90 C ATOM 1493 C ASP A 99 4.241 50.164 2.959 1.00 0.90 C ATOM 1494 O ASP A 99 4.999 49.244 2.648 1.00 0.90 O ATOM 1495 CB ASP A 99 2.933 50.673 0.801 1.00 0.90 C ATOM 1496 CG ASP A 99 1.554 50.258 1.315 1.00 0.90 C ATOM 1497 OD1 ASP A 99 1.447 50.034 2.543 1.00 0.90 O ATOM 1498 OD2 ASP A 99 0.585 50.480 0.564 1.00 0.90 O ATOM 1499 H ASP A 99 5.687 51.159 0.836 1.00 0.00 H ATOM 1500 HA ASP A 99 3.280 51.994 2.421 1.00 0.00 H ATOM 1501 HB2 ASP A 99 3.402 49.818 0.316 1.00 0.00 H ATOM 1502 HB3 ASP A 99 2.798 51.460 0.061 1.00 0.00 H ATOM 1503 N LEU A 100 3.919 50.439 4.233 1.00 0.89 N ATOM 1504 CA LEU A 100 4.176 49.521 5.352 1.00 0.89 C ATOM 1505 C LEU A 100 2.919 48.771 5.829 1.00 0.89 C ATOM 1506 O LEU A 100 2.986 48.156 6.891 1.00 0.89 O ATOM 1507 CB LEU A 100 4.840 50.213 6.573 1.00 0.89 C ATOM 1508 CG LEU A 100 5.731 51.460 6.429 1.00 0.89 C ATOM 1509 CD1 LEU A 100 6.279 51.815 7.818 1.00 0.89 C ATOM 1510 CD2 LEU A 100 6.957 51.304 5.541 1.00 0.89 C ATOM 1511 H LEU A 100 3.244 51.178 4.376 1.00 0.00 H ATOM 1512 HA LEU A 100 4.841 48.735 5.002 1.00 0.00 H ATOM 1513 HB2 LEU A 100 5.411 49.440 7.089 1.00 0.00 H ATOM 1514 HB3 LEU A 100 4.034 50.507 7.249 1.00 0.00 H ATOM 1515 HG LEU A 100 5.133 52.293 6.062 1.00 0.00 H ATOM 1516 HD11 LEU A 100 5.447 51.995 8.498 1.00 0.00 H ATOM 1517 HD12 LEU A 100 6.884 50.991 8.197 1.00 0.00 H ATOM 1518 HD13 LEU A 100 6.892 52.713 7.760 1.00 0.00 H ATOM 1519 HD21 LEU A 100 7.517 52.235 5.521 1.00 0.00 H ATOM 1520 HD22 LEU A 100 6.634 51.071 4.528 1.00 0.00 H ATOM 1521 HD23 LEU A 100 7.594 50.512 5.926 1.00 0.00 H ATOM 1522 N SER A 101 1.766 48.970 5.185 1.00 0.94 N ATOM 1523 CA SER A 101 0.430 48.670 5.730 1.00 0.94 C ATOM 1524 C SER A 101 0.214 47.187 6.096 1.00 0.94 C ATOM 1525 O SER A 101 -0.155 46.902 7.234 1.00 0.94 O ATOM 1526 CB SER A 101 -0.621 49.183 4.740 1.00 0.94 C ATOM 1527 OG SER A 101 -0.423 48.600 3.471 1.00 0.94 O ATOM 1528 H SER A 101 1.787 49.452 4.287 1.00 0.00 H ATOM 1529 HA SER A 101 0.293 49.243 6.644 1.00 0.00 H ATOM 1530 HB2 SER A 101 -0.518 50.268 4.653 1.00 0.00 H ATOM 1531 HB3 SER A 101 -1.623 48.946 5.092 1.00 0.00 H ATOM 1532 HG SER A 101 0.268 49.151 3.010 1.00 0.00 H ATOM 1533 N GLU A 102 0.762 46.248 5.309 1.00 0.90 N ATOM 1534 CA GLU A 102 0.833 44.813 5.673 1.00 0.90 C ATOM 1535 C GLU A 102 1.714 44.499 6.909 1.00 0.90 C ATOM 1536 O GLU A 102 1.671 43.388 7.438 1.00 0.90 O ATOM 1537 CB GLU A 102 1.360 43.979 4.493 1.00 0.90 C ATOM 1538 CG GLU A 102 0.655 44.218 3.145 1.00 0.90 C ATOM 1539 CD GLU A 102 1.151 43.264 2.043 1.00 0.90 C ATOM 1540 OE1 GLU A 102 1.816 42.262 2.377 1.00 0.90 O ATOM 1541 OE2 GLU A 102 0.906 43.551 0.849 1.00 0.90 O ATOM 1542 H GLU A 102 0.985 46.513 4.357 1.00 0.00 H ATOM 1543 HA GLU A 102 -0.175 44.465 5.903 1.00 0.00 H ATOM 1544 HB2 GLU A 102 2.424 44.180 4.378 1.00 0.00 H ATOM 1545 HB3 GLU A 102 1.245 42.929 4.766 1.00 0.00 H ATOM 1546 HG2 GLU A 102 -0.419 44.078 3.284 1.00 0.00 H ATOM 1547 HG3 GLU A 102 0.831 45.249 2.830 1.00 0.00 H ATOM 1548 N CYS A 103 2.539 45.447 7.370 1.00 0.93 N ATOM 1549 CA CYS A 103 3.379 45.324 8.568 1.00 0.93 C ATOM 1550 C CYS A 103 2.783 45.954 9.844 1.00 0.93 C ATOM 1551 O CYS A 103 3.531 46.136 10.814 1.00 0.93 O ATOM 1552 CB CYS A 103 4.762 45.955 8.331 1.00 0.93 C ATOM 1553 SG CYS A 103 5.491 45.522 6.739 1.00 0.93 S ATOM 1554 H CYS A 103 2.487 46.356 6.925 1.00 0.00 H ATOM 1555 HA CYS A 103 3.513 44.261 8.779 1.00 0.00 H ATOM 1556 HB2 CYS A 103 5.423 45.609 9.131 1.00 0.00 H ATOM 1557 HB3 CYS A 103 4.664 47.040 8.394 1.00 0.00 H ATOM 1558 HG CYS A 103 4.608 46.161 5.963 1.00 0.00 H ATOM 1559 N GLU A 104 1.599 46.566 9.794 1.00 0.82 N ATOM 1560 CA GLU A 104 0.956 47.162 10.988 1.00 0.82 C ATOM 1561 C GLU A 104 0.508 46.089 12.014 1.00 0.82 C ATOM 1562 O GLU A 104 0.925 44.940 11.875 1.00 0.82 O ATOM 1563 CB GLU A 104 -0.109 48.185 10.539 1.00 0.82 C ATOM 1564 CG GLU A 104 0.610 49.314 9.765 1.00 0.82 C ATOM 1565 CD GLU A 104 -0.145 50.650 9.719 1.00 0.82 C ATOM 1566 OE1 GLU A 104 -0.541 51.021 8.590 1.00 0.82 O ATOM 1567 OE2 GLU A 104 0.190 51.453 10.628 1.00 0.82 O ATOM 1568 H GLU A 104 1.040 46.479 8.946 1.00 0.00 H ATOM 1569 HA GLU A 104 1.709 47.733 11.524 1.00 0.00 H ATOM 1570 HB2 GLU A 104 -0.861 47.707 9.905 1.00 0.00 H ATOM 1571 HB3 GLU A 104 -0.601 48.600 11.422 1.00 0.00 H ATOM 1572 HG2 GLU A 104 0.849 48.973 8.759 1.00 0.00 H ATOM 1573 HG3 GLU A 104 1.562 49.511 10.263 1.00 0.00 H ATOM 1574 N GLU A 105 0.056 46.534 13.210 1.00 0.79 N ATOM 1575 CA GLU A 105 -0.325 45.594 14.296 1.00 0.79 C ATOM 1576 C GLU A 105 -1.801 45.173 14.215 1.00 0.79 C ATOM 1577 O GLU A 105 -2.650 46.098 14.187 1.00 0.79 O ATOM 1578 CB GLU A 105 0.000 46.151 15.696 1.00 0.79 C ATOM 1579 CG GLU A 105 -0.267 45.085 16.787 1.00 0.79 C ATOM 1580 CD GLU A 105 0.395 45.467 18.119 1.00 0.79 C ATOM 1581 OE1 GLU A 105 0.639 46.666 18.388 1.00 0.79 O ATOM 1582 OE2 GLU A 105 0.628 44.612 19.014 1.00 0.79 O ATOM 1583 OXT GLU A 105 -2.046 43.959 14.418 1.00 0.79 O ATOM 1584 H GLU A 105 -0.404 47.435 13.235 1.00 0.00 H ATOM 1585 HA GLU A 105 0.244 44.678 14.187 1.00 0.00 H ATOM 1586 HB2 GLU A 105 1.050 46.452 15.735 1.00 0.00 H ATOM 1587 HB3 GLU A 105 -0.607 47.039 15.908 1.00 0.00 H ATOM 1588 HG2 GLU A 105 0.128 44.114 16.458 1.00 0.00 H ATOM 1589 HG3 GLU A 105 -1.346 44.992 16.957 1.00 0.00 H TER 1590 GLU A 105 ATOM 1591 N GLY B 4 -13.783 42.980 33.275 1.00 0.43 N ATOM 1592 CA GLY B 4 -13.390 44.391 33.461 1.00 0.43 C ATOM 1593 C GLY B 4 -11.892 44.495 33.280 1.00 0.43 C ATOM 1594 O GLY B 4 -11.301 43.492 32.905 1.00 0.43 O ATOM 1595 HA2 GLY B 4 -13.878 45.017 32.713 1.00 0.00 H ATOM 1596 HA3 GLY B 4 -13.652 44.731 34.462 1.00 0.00 H ATOM 1597 H1 GLY B 4 -14.785 42.870 33.338 1.00 0.00 H ATOM 1598 H2 GLY B 4 -13.323 42.415 33.976 1.00 0.00 H ATOM 1599 H3 GLY B 4 -13.452 42.665 32.372 1.00 0.00 H ATOM 1600 N THR B 5 -11.303 45.652 33.577 1.00 0.68 N ATOM 1601 CA THR B 5 -9.849 45.883 33.453 1.00 0.68 C ATOM 1602 C THR B 5 -9.221 45.987 34.845 1.00 0.68 C ATOM 1603 O THR B 5 -9.848 46.535 35.755 1.00 0.68 O ATOM 1604 CB THR B 5 -9.569 47.158 32.637 1.00 0.68 C ATOM 1605 OG1 THR B 5 -10.364 47.162 31.467 1.00 0.68 O ATOM 1606 CG2 THR B 5 -8.118 47.313 32.190 1.00 0.68 C ATOM 1607 H THR B 5 -11.838 46.409 33.973 1.00 0.00 H ATOM 1608 HA THR B 5 -9.380 45.044 32.933 1.00 0.00 H ATOM 1609 HB THR B 5 -9.842 48.027 33.235 1.00 0.00 H ATOM 1610 HG1 THR B 5 -11.151 47.679 31.638 1.00 0.00 H ATOM 1611 HG21 THR B 5 -8.020 48.212 31.580 1.00 0.00 H ATOM 1612 HG22 THR B 5 -7.817 46.448 31.595 1.00 0.00 H ATOM 1613 HG23 THR B 5 -7.464 47.407 33.055 1.00 0.00 H ATOM 1614 N PHE B 6 -8.006 45.476 35.012 1.00 0.89 N ATOM 1615 CA PHE B 6 -7.240 45.449 36.260 1.00 0.89 C ATOM 1616 C PHE B 6 -5.952 46.282 36.146 1.00 0.89 C ATOM 1617 O PHE B 6 -5.509 46.646 35.059 1.00 0.89 O ATOM 1618 CB PHE B 6 -6.946 43.985 36.630 1.00 0.89 C ATOM 1619 CG PHE B 6 -8.193 43.154 36.882 1.00 0.89 C ATOM 1620 CD1 PHE B 6 -8.729 43.055 38.181 1.00 0.89 C ATOM 1621 CD2 PHE B 6 -8.830 42.494 35.814 1.00 0.89 C ATOM 1622 CE1 PHE B 6 -9.898 42.305 38.410 1.00 0.89 C ATOM 1623 CE2 PHE B 6 -9.999 41.746 36.042 1.00 0.89 C ATOM 1624 CZ PHE B 6 -10.535 41.652 37.339 1.00 0.89 C ATOM 1625 H PHE B 6 -7.586 44.998 34.211 1.00 0.00 H ATOM 1626 HA PHE B 6 -7.843 45.882 37.059 1.00 0.00 H ATOM 1627 HB2 PHE B 6 -6.372 43.525 35.823 1.00 0.00 H ATOM 1628 HB3 PHE B 6 -6.325 43.958 37.525 1.00 0.00 H ATOM 1629 HD1 PHE B 6 -8.239 43.549 39.008 1.00 0.00 H ATOM 1630 HD2 PHE B 6 -8.415 42.561 34.814 1.00 0.00 H ATOM 1631 HE1 PHE B 6 -10.298 42.224 39.410 1.00 0.00 H ATOM 1632 HE2 PHE B 6 -10.466 41.230 35.216 1.00 0.00 H ATOM 1633 HZ PHE B 6 -11.423 41.064 37.520 1.00 0.00 H ATOM 1634 N THR B 7 -5.295 46.555 37.279 1.00 0.83 N ATOM 1635 CA THR B 7 -4.029 47.318 37.298 1.00 0.83 C ATOM 1636 C THR B 7 -2.887 46.622 36.536 1.00 0.83 C ATOM 1637 O THR B 7 -2.114 47.295 35.856 1.00 0.83 O ATOM 1638 CB THR B 7 -3.629 47.656 38.746 1.00 0.83 C ATOM 1639 OG1 THR B 7 -2.488 48.474 38.787 1.00 0.83 O ATOM 1640 CG2 THR B 7 -3.306 46.436 39.614 1.00 0.83 C ATOM 1641 H THR B 7 -5.671 46.216 38.150 1.00 0.00 H ATOM 1642 HA THR B 7 -4.207 48.262 36.783 1.00 0.00 H ATOM 1643 HB THR B 7 -4.455 48.198 39.211 1.00 0.00 H ATOM 1644 HG1 THR B 7 -2.597 49.212 38.181 1.00 0.00 H ATOM 1645 HG21 THR B 7 -3.103 46.768 40.633 1.00 0.00 H ATOM 1646 HG22 THR B 7 -4.145 45.743 39.633 1.00 0.00 H ATOM 1647 HG23 THR B 7 -2.418 45.927 39.235 1.00 0.00 H ATOM 1648 N SER B 8 -2.913 45.285 36.472 1.00 0.79 N ATOM 1649 CA SER B 8 -1.957 44.439 35.741 1.00 0.79 C ATOM 1650 C SER B 8 -2.123 44.468 34.214 1.00 0.79 C ATOM 1651 O SER B 8 -1.127 44.358 33.490 1.00 0.79 O ATOM 1652 CB SER B 8 -2.055 43.001 36.261 1.00 0.79 C ATOM 1653 OG SER B 8 -3.405 42.609 36.483 1.00 0.79 O ATOM 1654 H SER B 8 -3.653 44.791 36.947 1.00 0.00 H ATOM 1655 HA SER B 8 -0.958 44.794 35.965 1.00 0.00 H ATOM 1656 HB2 SER B 8 -1.516 42.936 37.203 1.00 0.00 H ATOM 1657 HB3 SER B 8 -1.585 42.326 35.544 1.00 0.00 H ATOM 1658 HG SER B 8 -3.567 41.787 36.002 1.00 0.00 H ATOM 1659 N ASP B 9 -3.336 44.749 33.730 1.00 0.82 N ATOM 1660 CA ASP B 9 -3.614 45.038 32.320 1.00 0.82 C ATOM 1661 C ASP B 9 -3.000 46.393 31.923 1.00 0.82 C ATOM 1662 O ASP B 9 -2.235 46.464 30.964 1.00 0.82 O ATOM 1663 CB ASP B 9 -5.131 45.047 32.053 1.00 0.82 C ATOM 1664 CG ASP B 9 -5.889 43.781 32.486 1.00 0.82 C ATOM 1665 OD1 ASP B 9 -5.262 42.704 32.590 1.00 0.82 O ATOM 1666 OD2 ASP B 9 -7.058 43.957 32.909 1.00 0.82 O ATOM 1667 H ASP B 9 -4.111 44.798 34.371 1.00 0.00 H ATOM 1668 HA ASP B 9 -3.161 44.261 31.701 1.00 0.00 H ATOM 1669 HB2 ASP B 9 -5.293 45.204 30.987 1.00 0.00 H ATOM 1670 HB3 ASP B 9 -5.560 45.899 32.576 1.00 0.00 H ATOM 1671 N VAL B 10 -3.160 47.425 32.770 1.00 0.82 N ATOM 1672 CA VAL B 10 -2.583 48.770 32.550 1.00 0.82 C ATOM 1673 C VAL B 10 -1.049 48.757 32.575 1.00 0.82 C ATOM 1674 O VAL B 10 -0.425 49.359 31.702 1.00 0.82 O ATOM 1675 CB VAL B 10 -3.133 49.801 33.562 1.00 0.82 C ATOM 1676 CG1 VAL B 10 -2.506 51.195 33.400 1.00 0.82 C ATOM 1677 CG2 VAL B 10 -4.650 49.979 33.414 1.00 0.82 C ATOM 1678 H VAL B 10 -3.749 47.272 33.580 1.00 0.00 H ATOM 1679 HA VAL B 10 -2.871 49.099 31.552 1.00 0.00 H ATOM 1680 HB VAL B 10 -2.928 49.457 34.575 1.00 0.00 H ATOM 1681 HG11 VAL B 10 -1.442 51.167 33.638 1.00 0.00 H ATOM 1682 HG12 VAL B 10 -2.633 51.546 32.375 1.00 0.00 H ATOM 1683 HG13 VAL B 10 -2.981 51.902 34.081 1.00 0.00 H ATOM 1684 HG21 VAL B 10 -5.008 50.721 34.129 1.00 0.00 H ATOM 1685 HG22 VAL B 10 -5.164 49.038 33.609 1.00 0.00 H ATOM 1686 HG23 VAL B 10 -4.887 50.316 32.404 1.00 0.00 H ATOM 1687 N SER B 11 -0.420 48.007 33.488 1.00 0.80 N ATOM 1688 CA SER B 11 1.045 47.862 33.504 1.00 0.80 C ATOM 1689 C SER B 11 1.564 47.065 32.302 1.00 0.80 C ATOM 1690 O SER B 11 2.534 47.486 31.679 1.00 0.80 O ATOM 1691 CB SER B 11 1.519 47.225 34.817 1.00 0.80 C ATOM 1692 OG SER B 11 0.897 45.974 35.053 1.00 0.80 O ATOM 1693 H SER B 11 -0.966 47.515 34.190 1.00 0.00 H ATOM 1694 HA SER B 11 1.490 48.853 33.438 1.00 0.00 H ATOM 1695 HB2 SER B 11 2.599 47.080 34.777 1.00 0.00 H ATOM 1696 HB3 SER B 11 1.279 47.895 35.639 1.00 0.00 H ATOM 1697 HG SER B 11 1.229 45.332 34.416 1.00 0.00 H ATOM 1698 N SER B 12 0.842 46.021 31.869 1.00 0.78 N ATOM 1699 CA SER B 12 1.194 45.279 30.645 1.00 0.78 C ATOM 1700 C SER B 12 1.030 46.133 29.386 1.00 0.78 C ATOM 1701 O SER B 12 1.837 46.031 28.461 1.00 0.78 O ATOM 1702 CB SER B 12 0.331 44.022 30.504 1.00 0.78 C ATOM 1703 OG SER B 12 0.543 43.175 31.616 1.00 0.78 O ATOM 1704 H SER B 12 -0.020 45.787 32.348 1.00 0.00 H ATOM 1705 HA SER B 12 2.240 44.972 30.703 1.00 0.00 H ATOM 1706 HB2 SER B 12 0.613 43.492 29.595 1.00 0.00 H ATOM 1707 HB3 SER B 12 -0.725 44.297 30.446 1.00 0.00 H ATOM 1708 HG SER B 12 0.098 43.587 32.378 1.00 0.00 H ATOM 1709 N TYR B 13 0.032 47.020 29.370 1.00 0.79 N ATOM 1710 CA TYR B 13 -0.191 47.974 28.291 1.00 0.79 C ATOM 1711 C TYR B 13 0.945 49.002 28.191 1.00 0.79 C ATOM 1712 O TYR B 13 1.537 49.124 27.124 1.00 0.79 O ATOM 1713 CB TYR B 13 -1.568 48.632 28.468 1.00 0.79 C ATOM 1714 CG TYR B 13 -1.871 49.649 27.387 1.00 0.79 C ATOM 1715 CD1 TYR B 13 -2.239 49.196 26.107 1.00 0.79 C ATOM 1716 CD2 TYR B 13 -1.687 51.026 27.635 1.00 0.79 C ATOM 1717 CE1 TYR B 13 -2.384 50.113 25.053 1.00 0.79 C ATOM 1718 CE2 TYR B 13 -1.845 51.949 26.577 1.00 0.79 C ATOM 1719 CZ TYR B 13 -2.182 51.491 25.289 1.00 0.79 C ATOM 1720 OH TYR B 13 -2.289 52.363 24.257 1.00 0.79 O ATOM 1721 H TYR B 13 -0.631 47.015 30.140 1.00 0.00 H ATOM 1722 HA TYR B 13 -0.203 47.427 27.348 1.00 0.00 H ATOM 1723 HB2 TYR B 13 -1.627 49.117 29.440 1.00 0.00 H ATOM 1724 HB3 TYR B 13 -2.336 47.858 28.437 1.00 0.00 H ATOM 1725 HD1 TYR B 13 -2.373 48.141 25.921 1.00 0.00 H ATOM 1726 HD2 TYR B 13 -1.399 51.373 28.614 1.00 0.00 H ATOM 1727 HE1 TYR B 13 -2.623 49.769 24.059 1.00 0.00 H ATOM 1728 HE2 TYR B 13 -1.680 53.004 26.733 1.00 0.00 H ATOM 1729 HH TYR B 13 -2.229 51.894 23.422 1.00 0.00 H ATOM 1730 N LEU B 14 1.401 49.571 29.315 1.00 0.81 N ATOM 1731 CA LEU B 14 2.551 50.488 29.346 1.00 0.81 C ATOM 1732 C LEU B 14 3.880 49.822 28.930 1.00 0.81 C ATOM 1733 O LEU B 14 4.616 50.402 28.129 1.00 0.81 O ATOM 1734 CB LEU B 14 2.671 51.112 30.750 1.00 0.81 C ATOM 1735 CG LEU B 14 1.567 52.128 31.110 1.00 0.81 C ATOM 1736 CD1 LEU B 14 1.675 52.486 32.594 1.00 0.81 C ATOM 1737 CD2 LEU B 14 1.686 53.431 30.314 1.00 0.81 C ATOM 1738 H LEU B 14 0.905 49.385 30.179 1.00 0.00 H ATOM 1739 HA LEU B 14 2.377 51.284 28.623 1.00 0.00 H ATOM 1740 HB2 LEU B 14 3.636 51.615 30.827 1.00 0.00 H ATOM 1741 HB3 LEU B 14 2.663 50.304 31.483 1.00 0.00 H ATOM 1742 HG LEU B 14 0.584 51.696 30.929 1.00 0.00 H ATOM 1743 HD21 LEU B 14 1.490 53.246 29.259 1.00 0.00 H ATOM 1744 HD22 LEU B 14 2.686 53.851 30.427 1.00 0.00 H ATOM 1745 HD23 LEU B 14 0.953 54.153 30.675 1.00 0.00 H ATOM 1746 HD11 LEU B 14 0.907 53.214 32.856 1.00 0.00 H ATOM 1747 HD12 LEU B 14 1.527 51.590 33.196 1.00 0.00 H ATOM 1748 HD13 LEU B 14 2.659 52.907 32.804 1.00 0.00 H ATOM 1749 N GLU B 15 4.157 48.586 29.366 1.00 0.75 N ATOM 1750 CA GLU B 15 5.349 47.839 28.915 1.00 0.75 C ATOM 1751 C GLU B 15 5.311 47.522 27.413 1.00 0.75 C ATOM 1752 O GLU B 15 6.321 47.678 26.721 1.00 0.75 O ATOM 1753 CB GLU B 15 5.500 46.512 29.675 1.00 0.75 C ATOM 1754 CG GLU B 15 5.896 46.671 31.148 1.00 0.75 C ATOM 1755 CD GLU B 15 6.250 45.321 31.801 1.00 0.75 C ATOM 1756 OE1 GLU B 15 5.839 44.260 31.266 1.00 0.75 O ATOM 1757 OE2 GLU B 15 6.998 45.354 32.804 1.00 0.75 O ATOM 1758 H GLU B 15 3.533 48.150 30.038 1.00 0.00 H ATOM 1759 HA GLU B 15 6.238 48.445 29.092 1.00 0.00 H ATOM 1760 HB2 GLU B 15 4.570 45.945 29.602 1.00 0.00 H ATOM 1761 HB3 GLU B 15 6.289 45.940 29.182 1.00 0.00 H ATOM 1762 HG2 GLU B 15 6.759 47.340 31.203 1.00 0.00 H ATOM 1763 HG3 GLU B 15 5.080 47.140 31.697 1.00 0.00 H ATOM 1764 N GLY B 16 4.132 47.158 26.897 1.00 0.82 N ATOM 1765 CA GLY B 16 3.902 46.941 25.471 1.00 0.82 C ATOM 1766 C GLY B 16 4.073 48.220 24.651 1.00 0.82 C ATOM 1767 O GLY B 16 4.847 48.229 23.695 1.00 0.82 O ATOM 1768 H GLY B 16 3.347 47.049 27.531 1.00 0.00 H ATOM 1769 HA2 GLY B 16 4.596 46.186 25.099 1.00 0.00 H ATOM 1770 HA3 GLY B 16 2.881 46.590 25.333 1.00 0.00 H ATOM 1771 N GLN B 17 3.459 49.327 25.086 1.00 0.76 N ATOM 1772 CA GLN B 17 3.587 50.639 24.442 1.00 0.76 C ATOM 1773 C GLN B 17 5.044 51.093 24.343 1.00 0.76 C ATOM 1774 O GLN B 17 5.449 51.471 23.253 1.00 0.76 O ATOM 1775 CB GLN B 17 2.770 51.721 25.174 1.00 0.76 C ATOM 1776 CG GLN B 17 1.253 51.668 24.927 1.00 0.76 C ATOM 1777 CD GLN B 17 0.827 51.734 23.459 1.00 0.76 C ATOM 1778 OE1 GLN B 17 0.078 50.891 22.987 1.00 0.76 O ATOM 1779 NE2 GLN B 17 1.366 52.623 22.647 1.00 0.76 N ATOM 1780 H GLN B 17 2.862 49.255 25.904 1.00 0.00 H ATOM 1781 HA GLN B 17 3.219 50.559 23.419 1.00 0.00 H ATOM 1782 HB2 GLN B 17 3.123 52.702 24.847 1.00 0.00 H ATOM 1783 HB3 GLN B 17 2.960 51.650 26.246 1.00 0.00 H ATOM 1784 HG2 GLN B 17 0.851 50.751 25.355 1.00 0.00 H ATOM 1785 HG3 GLN B 17 0.800 52.508 25.452 1.00 0.00 H ATOM 1786 HE21 GLN B 17 1.962 53.380 22.966 1.00 0.00 H ATOM 1787 HE22 GLN B 17 1.020 52.638 21.705 1.00 0.00 H ATOM 1788 N ALA B 18 5.893 50.835 25.346 1.00 0.81 N ATOM 1789 CA ALA B 18 7.316 51.170 25.245 1.00 0.81 C ATOM 1790 C ALA B 18 8.013 50.503 24.038 1.00 0.81 C ATOM 1791 O ALA B 18 8.784 51.162 23.341 1.00 0.81 O ATOM 1792 CB ALA B 18 8.008 50.817 26.568 1.00 0.81 C ATOM 1793 H ALA B 18 5.530 50.474 26.223 1.00 0.00 H ATOM 1794 HA ALA B 18 7.396 52.249 25.099 1.00 0.00 H ATOM 1795 HB1 ALA B 18 9.039 51.172 26.540 1.00 0.00 H ATOM 1796 HB2 ALA B 18 8.003 49.738 26.721 1.00 0.00 H ATOM 1797 HB3 ALA B 18 7.492 51.301 27.398 1.00 0.00 H ATOM 1798 N ALA B 19 7.654 49.258 23.695 1.00 0.79 N ATOM 1799 CA ALA B 19 8.125 48.608 22.469 1.00 0.79 C ATOM 1800 C ALA B 19 7.486 49.187 21.190 1.00 0.79 C ATOM 1801 O ALA B 19 8.191 49.374 20.198 1.00 0.79 O ATOM 1802 CB ALA B 19 7.881 47.097 22.584 1.00 0.79 C ATOM 1803 H ALA B 19 6.922 48.801 24.228 1.00 0.00 H ATOM 1804 HA ALA B 19 9.201 48.769 22.387 1.00 0.00 H ATOM 1805 HB1 ALA B 19 8.361 46.708 23.479 1.00 0.00 H ATOM 1806 HB2 ALA B 19 6.813 46.884 22.637 1.00 0.00 H ATOM 1807 HB3 ALA B 19 8.297 46.594 21.711 1.00 0.00 H ATOM 1808 N LYS B 20 6.189 49.531 21.209 1.00 0.74 N ATOM 1809 CA LYS B 20 5.473 50.114 20.053 1.00 0.74 C ATOM 1810 C LYS B 20 5.965 51.517 19.689 1.00 0.74 C ATOM 1811 O LYS B 20 6.256 51.763 18.524 1.00 0.74 O ATOM 1812 CB LYS B 20 3.956 50.182 20.299 1.00 0.74 C ATOM 1813 CG LYS B 20 3.322 48.827 20.634 1.00 0.74 C ATOM 1814 CD LYS B 20 1.789 48.915 20.648 1.00 0.74 C ATOM 1815 CE LYS B 20 1.169 47.738 21.413 1.00 0.74 C ATOM 1816 NZ LYS B 20 1.542 46.448 20.790 1.00 0.74 N ATOM 1817 H LYS B 20 5.691 49.426 22.087 1.00 0.00 H ATOM 1818 HA LYS B 20 5.654 49.489 19.177 1.00 0.00 H ATOM 1819 HB2 LYS B 20 3.751 50.878 21.114 1.00 0.00 H ATOM 1820 HB3 LYS B 20 3.484 50.572 19.394 1.00 0.00 H ATOM 1821 HG2 LYS B 20 3.636 48.082 19.905 1.00 0.00 H ATOM 1822 HG3 LYS B 20 3.659 48.516 21.617 1.00 0.00 H ATOM 1823 HD2 LYS B 20 1.418 48.935 19.619 1.00 0.00 H ATOM 1824 HD3 LYS B 20 1.485 49.840 21.137 1.00 0.00 H ATOM 1825 HE2 LYS B 20 1.502 47.785 22.453 1.00 0.00 H ATOM 1826 HE3 LYS B 20 0.082 47.852 21.387 1.00 0.00 H ATOM 1827 HZ1 LYS B 20 2.258 46.573 20.087 1.00 0.00 H ATOM 1828 HZ2 LYS B 20 0.807 46.137 20.133 1.00 0.00 H ATOM 1829 HZ3 LYS B 20 1.730 45.682 21.409 1.00 0.00 H ATOM 1830 N GLU B 21 6.218 52.363 20.684 1.00 0.70 N ATOM 1831 CA GLU B 21 6.786 53.708 20.507 1.00 0.70 C ATOM 1832 C GLU B 21 8.209 53.647 19.924 1.00 0.70 C ATOM 1833 O GLU B 21 8.533 54.390 18.998 1.00 0.70 O ATOM 1834 CB GLU B 21 6.801 54.449 21.858 1.00 0.70 C ATOM 1835 CG GLU B 21 5.422 54.700 22.498 1.00 0.70 C ATOM 1836 CD GLU B 21 4.446 55.561 21.682 1.00 0.70 C ATOM 1837 OE1 GLU B 21 4.888 56.197 20.703 1.00 0.70 O ATOM 1838 OE2 GLU B 21 3.242 55.482 22.025 1.00 0.70 O ATOM 1839 H GLU B 21 5.949 52.084 21.621 1.00 0.00 H ATOM 1840 HA GLU B 21 6.171 54.275 19.805 1.00 0.00 H ATOM 1841 HB2 GLU B 21 7.306 55.407 21.727 1.00 0.00 H ATOM 1842 HB3 GLU B 21 7.396 53.863 22.562 1.00 0.00 H ATOM 1843 HG2 GLU B 21 4.934 53.747 22.678 1.00 0.00 H ATOM 1844 HG3 GLU B 21 5.579 55.168 23.471 1.00 0.00 H ATOM 1845 N PHE B 22 8.994 52.622 20.287 1.00 0.72 N ATOM 1846 CA PHE B 22 10.269 52.337 19.622 1.00 0.72 C ATOM 1847 C PHE B 22 10.095 51.928 18.147 1.00 0.72 C ATOM 1848 O PHE B 22 10.789 52.484 17.297 1.00 0.72 O ATOM 1849 CB PHE B 22 11.068 51.311 20.441 1.00 0.72 C ATOM 1850 CG PHE B 22 12.330 50.796 19.768 1.00 0.72 C ATOM 1851 CD1 PHE B 22 13.491 51.591 19.733 1.00 0.72 C ATOM 1852 CD2 PHE B 22 12.339 49.526 19.160 1.00 0.72 C ATOM 1853 CE1 PHE B 22 14.646 51.126 19.076 1.00 0.72 C ATOM 1854 CE2 PHE B 22 13.500 49.054 18.520 1.00 0.72 C ATOM 1855 CZ PHE B 22 14.651 49.858 18.470 1.00 0.72 C ATOM 1856 H PHE B 22 8.673 52.004 21.023 1.00 0.00 H ATOM 1857 HA PHE B 22 10.848 53.260 19.610 1.00 0.00 H ATOM 1858 HB2 PHE B 22 11.348 51.783 21.383 1.00 0.00 H ATOM 1859 HB3 PHE B 22 10.433 50.461 20.683 1.00 0.00 H ATOM 1860 HD1 PHE B 22 13.485 52.568 20.194 1.00 0.00 H ATOM 1861 HD2 PHE B 22 11.442 48.922 19.170 1.00 0.00 H ATOM 1862 HE1 PHE B 22 15.526 51.747 19.027 1.00 0.00 H ATOM 1863 HE2 PHE B 22 13.496 48.089 18.033 1.00 0.00 H ATOM 1864 HZ PHE B 22 15.531 49.510 17.950 1.00 0.00 H ATOM 1865 N ILE B 23 9.082 51.122 17.792 1.00 0.76 N ATOM 1866 CA ILE B 23 8.759 50.831 16.378 1.00 0.76 C ATOM 1867 C ILE B 23 8.318 52.094 15.618 1.00 0.76 C ATOM 1868 O ILE B 23 8.776 52.320 14.496 1.00 0.76 O ATOM 1869 CB ILE B 23 7.699 49.705 16.235 1.00 0.76 C ATOM 1870 CG1 ILE B 23 8.107 48.356 16.876 1.00 0.76 C ATOM 1871 CG2 ILE B 23 7.353 49.474 14.749 1.00 0.76 C ATOM 1872 CD1 ILE B 23 9.509 47.869 16.504 1.00 0.76 C ATOM 1873 H ILE B 23 8.474 50.762 18.519 1.00 0.00 H ATOM 1874 HA ILE B 23 9.675 50.497 15.891 1.00 0.00 H ATOM 1875 HB ILE B 23 6.782 50.027 16.730 1.00 0.00 H ATOM 1876 HG12 ILE B 23 8.042 48.432 17.957 1.00 0.00 H ATOM 1877 HG13 ILE B 23 7.388 47.592 16.575 1.00 0.00 H ATOM 1878 HG21 ILE B 23 6.794 50.325 14.357 1.00 0.00 H ATOM 1879 HG22 ILE B 23 8.263 49.335 14.163 1.00 0.00 H ATOM 1880 HG23 ILE B 23 6.720 48.593 14.643 1.00 0.00 H ATOM 1881 HD11 ILE B 23 9.654 46.855 16.875 1.00 0.00 H ATOM 1882 HD12 ILE B 23 10.265 48.522 16.943 1.00 0.00 H ATOM 1883 HD13 ILE B 23 9.604 47.873 15.423 1.00 0.00 H ATOM 1884 N ALA B 24 7.498 52.954 16.227 1.00 0.76 N ATOM 1885 CA ALA B 24 7.057 54.214 15.629 1.00 0.76 C ATOM 1886 C ALA B 24 8.232 55.180 15.375 1.00 0.76 C ATOM 1887 O ALA B 24 8.391 55.672 14.257 1.00 0.76 O ATOM 1888 CB ALA B 24 5.986 54.830 16.538 1.00 0.76 C ATOM 1889 H ALA B 24 7.153 52.717 17.152 1.00 0.00 H ATOM 1890 HA ALA B 24 6.596 53.998 14.665 1.00 0.00 H ATOM 1891 HB1 ALA B 24 5.597 55.742 16.085 1.00 0.00 H ATOM 1892 HB2 ALA B 24 6.408 55.076 17.514 1.00 0.00 H ATOM 1893 HB3 ALA B 24 5.164 54.127 16.676 1.00 0.00 H ATOM 1894 N TRP B 25 9.182 55.255 16.310 1.00 0.73 N ATOM 1895 CA TRP B 25 10.429 56.014 16.171 1.00 0.73 C ATOM 1896 C TRP B 25 11.348 55.487 15.055 1.00 0.73 C ATOM 1897 O TRP B 25 11.799 56.276 14.221 1.00 0.73 O ATOM 1898 CB TRP B 25 11.126 56.029 17.538 1.00 0.73 C ATOM 1899 CG TRP B 25 12.438 56.746 17.598 1.00 0.73 C ATOM 1900 CD1 TRP B 25 12.592 58.061 17.332 1.00 0.73 C ATOM 1901 CD2 TRP B 25 13.766 56.262 17.994 1.00 0.73 C ATOM 1902 NE1 TRP B 25 13.904 58.422 17.525 1.00 0.73 N ATOM 1903 CE2 TRP B 25 14.667 57.368 17.962 1.00 0.73 C ATOM 1904 CE3 TRP B 25 14.312 55.017 18.390 1.00 0.73 C ATOM 1905 CZ2 TRP B 25 16.015 57.265 18.322 1.00 0.73 C ATOM 1906 CZ3 TRP B 25 15.668 54.903 18.775 1.00 0.73 C ATOM 1907 CH2 TRP B 25 16.516 56.028 18.754 1.00 0.73 C ATOM 1908 H TRP B 25 8.991 54.821 17.210 1.00 0.00 H ATOM 1909 HA TRP B 25 10.181 57.043 15.908 1.00 0.00 H ATOM 1910 HB2 TRP B 25 10.454 56.519 18.246 1.00 0.00 H ATOM 1911 HB3 TRP B 25 11.269 55.005 17.882 1.00 0.00 H ATOM 1912 HD1 TRP B 25 11.803 58.740 17.035 1.00 0.00 H ATOM 1913 HE3 TRP B 25 13.667 54.150 18.402 1.00 0.00 H ATOM 1914 HZ2 TRP B 25 16.639 58.148 18.269 1.00 0.00 H ATOM 1915 HZ3 TRP B 25 16.056 53.951 19.100 1.00 0.00 H ATOM 1916 HH2 TRP B 25 17.545 55.952 19.069 1.00 0.00 H ATOM 1917 HE1 TRP B 25 14.252 59.379 17.371 1.00 0.00 H ATOM 1918 N LEU B 26 11.454 54.162 14.878 1.00 0.77 N ATOM 1919 CA LEU B 26 12.119 53.577 13.703 1.00 0.77 C ATOM 1920 C LEU B 26 11.385 53.910 12.393 1.00 0.77 C ATOM 1921 O LEU B 26 12.027 54.313 11.426 1.00 0.77 O ATOM 1922 CB LEU B 26 12.243 52.049 13.836 1.00 0.77 C ATOM 1923 CG LEU B 26 13.062 51.517 15.024 1.00 0.77 C ATOM 1924 CD1 LEU B 26 12.966 49.995 15.010 1.00 0.77 C ATOM 1925 CD2 LEU B 26 14.526 51.941 14.982 1.00 0.77 C ATOM 1926 H LEU B 26 11.028 53.549 15.568 1.00 0.00 H ATOM 1927 HA LEU B 26 13.120 54.003 13.619 1.00 0.00 H ATOM 1928 HB2 LEU B 26 11.240 51.627 13.896 1.00 0.00 H ATOM 1929 HB3 LEU B 26 12.700 51.673 12.919 1.00 0.00 H ATOM 1930 HG LEU B 26 12.652 51.874 15.959 1.00 0.00 H ATOM 1931 HD21 LEU B 26 14.577 53.016 15.126 1.00 0.00 H ATOM 1932 HD22 LEU B 26 14.966 51.675 14.023 1.00 0.00 H ATOM 1933 HD23 LEU B 26 15.071 51.448 15.788 1.00 0.00 H ATOM 1934 HD11 LEU B 26 13.587 49.577 15.798 1.00 0.00 H ATOM 1935 HD12 LEU B 26 11.932 49.699 15.179 1.00 0.00 H ATOM 1936 HD13 LEU B 26 13.295 49.618 14.041 1.00 0.00 H ATOM 1937 N ARG B 27 10.045 53.860 12.373 1.00 0.68 N ATOM 1938 CA ARG B 27 9.234 54.192 11.184 1.00 0.68 C ATOM 1939 C ARG B 27 9.359 55.662 10.764 1.00 0.68 C ATOM 1940 O ARG B 27 9.378 55.921 9.560 1.00 0.68 O ATOM 1941 CB ARG B 27 7.759 53.809 11.410 1.00 0.68 C ATOM 1942 CG ARG B 27 7.522 52.294 11.320 1.00 0.68 C ATOM 1943 CD ARG B 27 6.048 51.951 11.593 1.00 0.68 C ATOM 1944 NE ARG B 27 5.734 50.570 11.183 1.00 0.68 N ATOM 1945 CZ ARG B 27 4.578 49.936 11.273 1.00 0.68 C ATOM 1946 NH1 ARG B 27 4.501 48.742 10.771 1.00 0.68 N ATOM 1947 NH2 ARG B 27 3.523 50.438 11.855 1.00 0.68 N ATOM 1948 H ARG B 27 9.571 53.567 13.225 1.00 0.00 H ATOM 1949 HA ARG B 27 9.618 53.617 10.342 1.00 0.00 H ATOM 1950 HB2 ARG B 27 7.423 54.175 12.379 1.00 0.00 H ATOM 1951 HB3 ARG B 27 7.153 54.286 10.638 1.00 0.00 H ATOM 1952 HG2 ARG B 27 8.151 51.771 12.040 1.00 0.00 H ATOM 1953 HG3 ARG B 27 7.793 51.960 10.318 1.00 0.00 H ATOM 1954 HD2 ARG B 27 5.847 52.082 12.660 1.00 0.00 H ATOM 1955 HD3 ARG B 27 5.413 52.638 11.028 1.00 0.00 H ATOM 1956 HE ARG B 27 6.454 50.070 10.688 1.00 0.00 H ATOM 1957 HH11 ARG B 27 5.296 48.313 10.328 1.00 0.00 H ATOM 1958 HH12 ARG B 27 3.684 48.156 10.904 1.00 0.00 H ATOM 1959 HH21 ARG B 27 3.529 51.384 12.183 1.00 0.00 H ATOM 1960 HH22 ARG B 27 2.620 50.012 11.696 1.00 0.00 H ATOM 1961 N VAL B 28 9.576 56.582 11.709 1.00 0.80 N ATOM 1962 CA VAL B 28 9.891 58.006 11.462 1.00 0.80 C ATOM 1963 C VAL B 28 11.317 58.219 10.918 1.00 0.80 C ATOM 1964 O VAL B 28 11.544 59.193 10.203 1.00 0.80 O ATOM 1965 CB VAL B 28 9.654 58.827 12.755 1.00 0.80 C ATOM 1966 CG1 VAL B 28 10.121 60.288 12.681 1.00 0.80 C ATOM 1967 CG2 VAL B 28 8.159 58.881 13.107 1.00 0.80 C ATOM 1968 H VAL B 28 9.514 56.271 12.674 1.00 0.00 H ATOM 1969 HA VAL B 28 9.214 58.388 10.698 1.00 0.00 H ATOM 1970 HB VAL B 28 10.186 58.348 13.577 1.00 0.00 H ATOM 1971 HG11 VAL B 28 11.207 60.334 12.592 1.00 0.00 H ATOM 1972 HG12 VAL B 28 9.667 60.787 11.824 1.00 0.00 H ATOM 1973 HG13 VAL B 28 9.842 60.817 13.594 1.00 0.00 H ATOM 1974 HG21 VAL B 28 7.750 57.878 13.206 1.00 0.00 H ATOM 1975 HG22 VAL B 28 7.606 59.414 12.334 1.00 0.00 H ATOM 1976 HG23 VAL B 28 8.026 59.392 14.061 1.00 0.00 H ATOM 1977 N GLY B 29 12.240 57.275 11.145 1.00 0.75 N ATOM 1978 CA GLY B 29 13.649 57.358 10.729 1.00 0.75 C ATOM 1979 C GLY B 29 14.665 57.513 11.870 1.00 0.75 C ATOM 1980 O GLY B 29 15.806 57.879 11.608 1.00 0.75 O ATOM 1981 H GLY B 29 11.943 56.424 11.606 1.00 0.00 H ATOM 1982 HA2 GLY B 29 13.794 58.191 10.041 1.00 0.00 H ATOM 1983 HA3 GLY B 29 13.899 56.439 10.197 1.00 0.00 H ATOM 1984 N ARG B 30 14.283 57.208 13.124 1.00 0.59 N ATOM 1985 CA ARG B 30 15.176 57.110 14.300 1.00 0.59 C ATOM 1986 C ARG B 30 15.947 58.415 14.663 1.00 0.59 C ATOM 1987 O ARG B 30 17.074 58.325 15.155 1.00 0.59 O ATOM 1988 CB ARG B 30 16.074 55.866 14.124 1.00 0.59 C ATOM 1989 CG ARG B 30 16.480 55.206 15.447 1.00 0.59 C ATOM 1990 CD ARG B 30 17.302 53.926 15.237 1.00 0.59 C ATOM 1991 NE ARG B 30 18.667 54.209 14.759 1.00 0.59 N ATOM 1992 CZ ARG B 30 19.666 54.725 15.431 1.00 0.59 C ATOM 1993 NH1 ARG B 30 20.786 55.002 14.822 1.00 0.59 N ATOM 1994 NH2 ARG B 30 19.604 54.894 16.726 1.00 0.59 N ATOM 1995 H ARG B 30 13.321 56.902 13.253 1.00 0.00 H ATOM 1996 HA ARG B 30 14.525 56.937 15.159 1.00 0.00 H ATOM 1997 HB2 ARG B 30 15.525 55.118 13.546 1.00 0.00 H ATOM 1998 HB3 ARG B 30 16.966 56.145 13.564 1.00 0.00 H ATOM 1999 HG2 ARG B 30 15.570 54.941 15.981 1.00 0.00 H ATOM 2000 HG3 ARG B 30 17.051 55.911 16.048 1.00 0.00 H ATOM 2001 HD2 ARG B 30 17.338 53.358 16.168 1.00 0.00 H ATOM 2002 HD3 ARG B 30 16.803 53.305 14.489 1.00 0.00 H ATOM 2003 HE ARG B 30 18.838 53.959 13.780 1.00 0.00 H ATOM 2004 HH11 ARG B 30 20.740 54.989 13.804 1.00 0.00 H ATOM 2005 HH12 ARG B 30 21.437 55.612 15.273 1.00 0.00 H ATOM 2006 HH21 ARG B 30 18.682 54.811 17.126 1.00 0.00 H ATOM 2007 HH22 ARG B 30 20.336 55.366 17.217 1.00 0.00 H ATOM 2008 N GLY B 31 15.339 59.559 14.372 1.00 0.61 N ATOM 2009 CA GLY B 31 15.842 60.927 14.629 1.00 0.61 C ATOM 2010 C GLY B 31 15.706 61.432 16.079 1.00 0.61 C ATOM 2011 O GLY B 31 14.868 60.851 16.796 1.00 0.61 O ATOM 2012 OXT GLY B 31 16.245 62.514 16.317 1.00 0.61 O ATOM 2013 H GLY B 31 14.405 59.488 14.011 1.00 0.00 H ATOM 2014 HA2 GLY B 31 15.300 61.632 14.014 1.00 0.00 H ATOM 2015 HA3 GLY B 31 16.895 60.986 14.375 1.00 0.00 H TER 2016 GLY B 31 CONECT 2017 2018 2044 2045 2046 CONECT 2018 2017 2019 2047 2048 CONECT 2042 2041 2043 2083 2084 CONECT 2019 2018 2020 2049 2050 CONECT 2020 2019 2021 2051 2052 CONECT 2021 2020 2022 2053 2054 CONECT 2022 2021 2023 2055 2056 CONECT 2023 2022 2024 2057 2058 CONECT 2041 2040 2042 2081 2082 CONECT 2024 2023 2025 2059 2060 CONECT 2039 2038 2040 2079 2080 CONECT 2026 2025 2027 2061 2062 CONECT 2038 2037 2039 2077 2078 CONECT 2027 2026 2028 2063 2064 CONECT 2036 2035 2037 2075 2076 CONECT 2029 2028 2030 2065 2066 CONECT 2035 2034 2036 2073 2074 CONECT 2030 2029 2031 2067 2068 CONECT 2033 2032 2034 2071 2072 CONECT 2032 2031 2033 2069 2070 CONECT 2044 2017 CONECT 2053 2021 CONECT 2054 2021 CONECT 2055 2022 CONECT 2056 2022 CONECT 2057 2023 CONECT 2058 2023 CONECT 2059 2024 CONECT 2060 2024 CONECT 2061 2026 CONECT 2062 2026 CONECT 2045 2017 CONECT 2063 2027 CONECT 2064 2027 CONECT 2065 2029 CONECT 2066 2029 CONECT 2067 2030 CONECT 2068 2030 CONECT 2069 2032 CONECT 2070 2032 CONECT 2071 2033 CONECT 2072 2033 CONECT 2046 2017 CONECT 2073 2035 CONECT 2074 2035 CONECT 2075 2036 CONECT 2076 2036 CONECT 2077 2038 CONECT 2078 2038 CONECT 2079 2039 CONECT 2080 2039 CONECT 2081 2041 CONECT 2082 2041 CONECT 2047 2018 CONECT 2083 2042 CONECT 2084 2042 CONECT 2085 2043 CONECT 2048 2018 CONECT 2049 2019 CONECT 2050 2019 CONECT 2051 2020 CONECT 2052 2020 CONECT 2043 2042 2085 CONECT 2040 2039 2041 CONECT 2025 2024 2026 CONECT 2037 2036 2038 CONECT 2028 2027 2029 CONECT 2034 2033 2035 CONECT 2031 2030 2032 END