HEADER HYDROLASE(CARBOXYLIC ESTERASE) 08-OCT-91 1ACE COMPND Acetylcholinesterase (E.C.3.1.1.7) SOURCE Electric Ray (Torpedo californica) AUTHOR J.L.Sussman,M.Harel,I.Silman JRNL AUTH J.L.Sussman,M.Harel,F.Frolow,C.Oefner,A.Goldman, JRNL AUTH 2 L.Toker,I.Silman JRNL TITL Atomic Structure Of Acetylcholinesterase From JRNL TITL 2 Torpedo Californica: A Prototypic JRNL TITL 3 Acetylcholine-Binding Protein JRNL REF SCIENCE V. 253 872 1991 JRNL REFN ASTM SCIEAS US ISSN 0036-8075 038 REMARK 1 REFERENCE 1 REMARK 1 AUTH J.Sussman,M.Harel,F.Frolow,C.Oefner,L.Toker, REMARK 1 AUTH 2 I.Silman REMARK 1 TITL Structural Studies On Acetylcholinesterases From REMARK 1 TITL 2 Torpedo Californica REMARK 1 EDIT J.Massoulie,F.Bacou,E.Barnard,A.Chatonnet,B.Doctor, REMARK 1 EDIT 2 D.M.Quinn REMARK 1 REF CHOLINESTERASES: STRUCTURE, 7 1991 REMARK 1 REF 2 FUNCTION, MECHANISM, REMARK 1 REF 3 GENETICS, AND CELL BIOLOGY REMARK 1 PUBL AMERICAN CHEMICAL SOCIETY, COLUMBUS, OH REMARK 1 REFN ISBN 0-8412-2008-5 808 REMARK 1 REFERENCE 2 REMARK 1 AUTH J.L.Sussman,M.Harel,F.Frolow,A.Goldman,C.Oefner, REMARK 1 AUTH 2 L.Toker,I.Silman REMARK 1 TITL 3-D Structure Of Acetylcholinesterase From Torpedo REMARK 1 TITL 2 californica REMARK 1 REF PROCEEDINGS OF THE 1991 441 1991 REMARK 1 REF 2 MEDICAL DEFENSE BIOSCIENCE REMARK 1 REF 3 REVIEW REMARK 1 PUBL ? REMARK 1 REFN 804 REMARK 1 REFERENCE 3 REMARK 1 AUTH J.L.Sussman,M.Harel,F.Frolow,I.Silman REMARK 1 TITL X-ray Crystallographic Studies Of REMARK 1 TITL 2 Acetylcholinesterase REMARK 1 REF PROCEEDINGS OF THE 1989 309 1989 REMARK 1 REF 2 MEDICAL DEFENSE BIOSCIENCE REMARK 1 REF 3 REVIEW REMARK 1 PUBL ? REMARK 1 REFN 805 REMARK 1 REFERENCE 4 REMARK 1 AUTH J.L.Sussman,M.Harel,F.Frolow,L.Varon,L.Toker, REMARK 1 AUTH 2 A.H.Futerman,I.Silman REMARK 1 TITL Purification And Crystallization Of A Dimeric Form REMARK 1 TITL 2 Of Acetylcholinesterase From Torpedo californica REMARK 1 TITL 3 Subsequent To Solubilization With REMARK 1 TITL 4 Phosphatidylinositol-specific Phospholipase C REMARK 1 REF J.MOL.BIOL. V. 203 821 1988 REMARK 1 REFN ASTM JMOBAK UK ISSN 0022-2836 070 REMARK 3 REMARK 3 REFINEMENT. MOLECULAR DYNAMICS REFINEMENT BY THE METHOD OF REMARK 3 A. BRUNGER, J. KURIYAN, AND M. KARPLUS (PROGRAM *XPLOR*) REMARK 3 FOLLOWED BY THE RESTRAINED LEAST-SQUARES PROCEDURE OF J. REMARK 3 KONNERT AND W. HENDRICKSON (PROGRAM *PROLSQ*). THE R REMARK 3 VALUE IS 0.186 FOR ALL REFLECTIONS IN THE RESOLUTION REMARK 3 RANGE 6.0 TO 2.8 ANGSTROMS. THE RMS DEVIATION FROM REMARK 3 IDEALITY OF THE BOND LENGTHS OS 0.021 ANGSTROMS. THE RMS REMARK 3 DEVIATION FROM IDEALITY OF THE BOND ANGLES IS 4.0 DEGREES. REMARK 960 REMARK 960 EMBEDDED CIF REMARK 960 REMARK 960 ################################################### REMARK 960 # # REMARK 960 # Converted from PDB format to CIF format by # REMARK 960 # pdb2cif version 2.3.6 15 Jun 98 # REMARK 960 # by # REMARK 960 # P.E. Bourne, H.J. Bernstein and F.C. Bernstein # REMARK 960 # # REMARK 960 # *** See the remarks at the end of this *** # REMARK 960 # *** file for information on conversion *** # REMARK 960 # *** of this entry and on the program *** # REMARK 960 # *** pdb2cif *** # REMARK 960 ################################################### REMARK 960 REMARK 960 REMARK 960 data_1ACE REMARK 960 REMARK 960 _entry.id 1ACE REMARK 960 REMARK 960 REMARK 960 REMARK 960 ################## REMARK 960 # # REMARK 960 # STRUCT # REMARK 960 # # REMARK 960 ################## REMARK 960 REMARK 960 loop_ REMARK 960 _struct.entry_id REMARK 960 1ACE REMARK 960 _struct.title ' Compound::' REMARK 960 _audit_author.name .0 REMARK 960 #< not correct type REMARK 960 _citation.id primary REMARK 960 _citation.page_first .0 REMARK 960 #< not correct type REMARK 960 _citation.year ? REMARK 960 _symmetry.entry_id 1ACE REMARK 960 _audit.revision_id 1ACE REMARK 960 _audit.creation_date 1991-10-08 REMARK 960 ; REMARK 960 1998-06-15 Converted to mmCIF format by pdb2cif.pl 2.3.6 REMARK 960 ; REMARK 960 ########################## REMARK 960 # # REMARK 960 # ENTITY_POLY_SEQ # REMARK 960 # # REMARK 960 ########################## REMARK 960 REMARK 960 loop_ REMARK 960 _entity_poly_seq.entity_id REMARK 960 _entity_poly_seq.mon_id REMARK 960 1 REMARK 960 ; REMARK 960 Protein chain: * REMARK 960 ; REMARK 960 2 'het group ACH' REMARK 960 3 HOH REMARK 960 REMARK 960 loop_ REMARK 960 _struct_asym.entity_id REMARK 960 _chem_comp.id REMARK 960 _chem_comp.mon_nstd_flag REMARK 960 ACH REMARK 960 ; REMARK 960 C7 H16 N1 O2 REMARK 960 ; REMARK 960 ; REMARK 960 ACETYLCHOLINE REMARK 960 ; REMARK 960 HOH REMARK 960 ; REMARK 960 71(H2 O1) REMARK 960 ; REMARK 960 ; REMARK 960 ; REMARK 960 ALA 'C3 H7 N1 O2' Alanine REMARK 960 ARG 'C6 H14 N4 O2' Arginine REMARK 960 ASN 'C4 H8 N2 O3' Asparagine REMARK 960 ASP 'C4 H7 N1 O4' 'Aspartic acid' REMARK 960 CYS 'C3 H7 N1 O2 S1' REMARK 960 Cysteine REMARK 960 GLN 'C5 H10 N2 O3' Glutamine REMARK 960 GLU 'C5 H9 N1 O4' 'Glutamic acid' REMARK 960 GLY 'C2 H5 N1 O2' Glycine REMARK 960 HIS 'C6 H9 N3 O2' Histidine REMARK 960 ILE 'C6 H13 N1 O2' Isoleucine REMARK 960 LEU 'C6 H13 N1 O2' Leucine REMARK 960 LYS 'C6 H14 N2 O2' Lysine REMARK 960 MET 'C5 H11 N1 O2 S1' REMARK 960 Methionine REMARK 960 PHE 'C9 H11 N1 O2' Phenylalanine REMARK 960 PRO 'C5 H9 N1 O2' Proline REMARK 960 SER 'C3 H7 N1 O3' Serine REMARK 960 THR 'C4 H9 N1 O3' Threonine REMARK 960 TRP 'C11 H12 N2 O2' Tryptophan REMARK 960 TYR 'C9 H11 N1 O3' Tyrosine REMARK 960 VAL 'C5 H11 N1 O2' V aline REMARK 960 REMARK 960 REMARK 960 REMARK 960 ###################### REMARK 960 # # REMARK 960 # ATOM_SITES # REMARK 960 # # REMARK 960 ###################### REMARK 960 REMARK 960 REMARK 960 REMARK 960 REMARK 960 REMARK 960 REMARK 960 loop_ REMARK 960 _database_PDB_matrix.entry_id REMARK 960 1ACE REMARK 960 REMARK 960 loop_ REMARK 960 _database_PDB_matrix.origx[1][1] REMARK 960 _database_PDB_matrix.origx[1][2] REMARK 960 1ACE REMARK 960 'See _atom_sites.fract_transf_matrix[i][j]' REMARK 960 REMARK 960 loop_ REMARK 960 _atom_sites.fract_transf_matrix[1][1] REMARK 960 _atom_sites.fract_transf_matrix[1][2] REMARK 960 1 REMARK 960 ; REMARK 960 RESIDUE PRO 104 IS A CIS PROLINE. REMARK 960 ; REMARK 960 REMARK 960 REMARK 960 REMARK 960 #################### REMARK 960 # # REMARK 960 # ATOM_SITE # REMARK 960 # # REMARK 960 #################### REMARK 960 REMARK 960 REMARK 960 REMARK 960 _atom_site.label_seq_id '4 ' REMARK 960 loop_ REMARK 960 _atom_site.label_atom_id REMARK 960 _atom_site.label_comp_id REMARK 960 _atom_site.label_asym_id REMARK 960 _atom_site.auth_seq_id REMARK 960 _atom_site.label_alt_id REMARK 960 _atom_site.Cartn_x REMARK 960 1 1992-01-15 REMARK 960 0 . . . REMARK 960 REMARK 960 REMARK 960 REMARK 960 #################### REMARK 960 # # REMARK 960 # STRUCT_BIOL # REMARK 960 # # REMARK 960 #################### REMARK 960 REMARK 960 REMARK 960 REMARK 960 loop_ REMARK 960 _struct_biol.id REMARK 960 1ACE REMARK 960 * REMARK 960 loop_ REMARK 960 _struct_biol.details REMARK 960 _struct_biol_gen.biol_id REMARK 960 _struct_biol_gen.asym_id REMARK 960 _struct_biol_gen.symmetry REMARK 960 1ACE * 1_555 . REMARK 960 1ACE ACH 1_555 . REMARK 960 1ACE HOH 1_555 . REMARK 960 * * 1_555 . REMARK 960 REMARK 960 REMARK 960 REMARK 960 ############################## REMARK 960 # # REMARK 960 # STRUCT_CONN_TYPE # REMARK 960 # # REMARK 960 ############################## REMARK 960 REMARK 960 REMARK 960 REMARK 960 loop_ REMARK 960 _struct_conn_type.id REMARK 960 _struct_conn_type.criteria REMARK 960 _struct_conn_type.reference REMARK 960 . 'unknown bond type from PDB entry' ? REMARK 960 saltbr 'salt bridge from PDB entry' ? REMARK 960 hydrog 'hydrogen bond from PDB entry' ? REMARK 960 disulf 'disulfide bridge from PDB entry' ? REMARK 960 REMARK 960 REMARK 960 REMARK 960 ############################## REMARK 960 # # REMARK 960 # STRUCT_CONN # REMARK 960 # # REMARK 960 ############################## REMARK 960 REMARK 960 REMARK 960 REMARK 960 loop_ REMARK 960 _struct_conn.id REMARK 960 _struct_conn.conn_type_id REMARK 960 _struct_conn.ptnr1_label_comp_id REMARK 960 _struct_conn.ptnr1_label_asym_id REMARK 960 _struct_conn.ptnr1_auth_seq_id REMARK 960 _struct_conn.ptnr1_label_atom_id REMARK 960 _struct_conn.ptnr1_label_alt_id REMARK 960 _struct_conn.ptnr1_role REMARK 960 _struct_conn.ptnr1_symmetry REMARK 960 _struct_conn.ptnr2_label_comp_id REMARK 960 _struct_conn.ptnr2_label_asym_id REMARK 960 _struct_conn.ptnr2_auth_seq_id REMARK 960 _struct_conn.ptnr2_label_atom_id REMARK 960 _struct_conn.ptnr2_label_alt_id REMARK 960 _struct_conn.ptnr2_role REMARK 960 _struct_conn.ptnr2_symmetry REMARK 960 _struct_conn.ptnr1_atom_site_id REMARK 960 #< not in dictionary REMARK 960 _struct_conn.ptnr1_label_seq_id REMARK 960 _struct_conn.ptnr2_atom_site_id REMARK 960 #< not in dictionary REMARK 960 _struct_conn.ptnr2_label_seq_id REMARK 960 1 . CYS * 67 CB . . . CYS * 67 SG REMARK 960 . . . REMARK 960 521 67 522 67 REMARK 960 2 disulf CYS * 67 SG . . . CYS * 94 SG REMARK 960 . . . REMARK 960 522 67 745 94 REMARK 960 3 . CYS * 94 CB . . . CYS * 94 SG REMARK 960 . . . REMARK 960 744 94 745 94 REMARK 960 4 . SER * 200 CB . . . SER * 200 OG REMARK 960 . . . REMARK 960 1573 200 1574 200 REMARK 960 5 . SER * 200 OG . . . ACH * 998 C5 REMARK 960 . . . REMARK 960 1574 200 4288 . REMARK 960 6 . CYS * 254 CB . . . CYS * 254 SG REMARK 960 . . . REMARK 960 1969 254 1970 254 REMARK 960 7 disulf CYS * 254 SG . . . CYS * 265 SG REMARK 960 . . . REMARK 960 1970 254 2058 265 REMARK 960 8 . CYS * 265 CB . . . CYS * 265 SG REMARK 960 . . . REMARK 960 2057 265 2058 265 REMARK 960 9 . CYS * 402 CB . . . CYS * 402 SG REMARK 960 . . . REMARK 960 3143 402 3144 402 REMARK 960 10 disulf CYS * 402 SG . . . CYS * 521 SG REMARK 960 . . . REMARK 960 3144 402 4150 521 REMARK 960 11 . CYS * 521 CB . . . CYS * 521 SG REMARK 960 . . . REMARK 960 4149 521 4150 521 REMARK 960 12 . ACH * 998 C2 . . . ACH * 998 N1 REMARK 960 . . . REMARK 960 4285 . 4284 . REMARK 960 13 . ACH * 998 C8 . . . ACH * 998 N1 REMARK 960 . . . REMARK 960 4291 . 4284 . REMARK 960 14 . ACH * 998 C9 . . . ACH * 998 N1 REMARK 960 . . . REMARK 960 4292 . 4284 . REMARK 960 15 . ACH * 998 C10 . . . ACH * 998 N1 REMARK 960 . . . REMARK 960 4293 . 4284 . REMARK 960 16 . ACH * 998 C2 . . . ACH * 998 C3 REMARK 960 . . . REMARK 960 4285 . 4286 . REMARK 960 17 . ACH * 998 C3 . . . ACH * 998 O4 REMARK 960 . . . REMARK 960 4286 . 4287 . REMARK 960 18 . ACH * 998 C5 . . . ACH * 998 O4 REMARK 960 . . . REMARK 960 4288 . 4287 . REMARK 960 19 . ACH * 998 C5 . . . ACH * 998 C6 REMARK 960 . . . REMARK 960 4288 . 4289 . REMARK 960 20 . ACH * 998 C5 . . . ACH * 998 O7 REMARK 960 . . . REMARK 960 4288 . 4290 . REMARK 960 REMARK 960 REMARK 960 REMARK 960 #################### REMARK 960 # # REMARK 960 # STRUCT_CONF # REMARK 960 # # REMARK 960 #################### REMARK 960 REMARK 960 REMARK 960 REMARK 960 loop_ REMARK 960 _struct_conf_type.id REMARK 960 _struct_conf_type.criteria REMARK 960 _struct_conf_type.reference REMARK 960 HELX_RH_AL_P 'From PDB' . REMARK 960 REMARK 960 loop_ REMARK 960 _struct_conf.id REMARK 960 _struct_conf.conf_type_id REMARK 960 _struct_conf.beg_label_comp_id REMARK 960 _struct_conf.beg_label_asym_id REMARK 960 _struct_conf.beg_auth_seq_id REMARK 960 _struct_conf.end_label_comp_id REMARK 960 _struct_conf.end_label_asym_id REMARK 960 _struct_conf.end_auth_seq_id REMARK 960 _struct_conf.details REMARK 960 _struct_conf.beg_label_seq_id REMARK 960 _struct_conf.end_label_seq_id REMARK 960 helix_HA HELX_RH_AL_P SER * 79 MET * 83 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 79 83 REMARK 960 helix_HB HELX_RH_AL_P LYS * 133 GLU * 140 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 133 140 REMARK 960 helix_HC HELX_RH_AL_P VAL * 168 ILE * 184 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 168 184 REMARK 960 helix_HD HELX_RH_AL_P ALA * 201 LEU * 211 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 201 211 REMARK 960 helix_HE1 HELX_RH_AL_P VAL * 238 ASN * 251 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 238 251 REMARK 960 helix_HE2 HELX_RH_AL_P ASP * 259 GLU * 268 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 259 268 REMARK 960 helix_HE3 HELX_RH_AL_P PRO * 271 GLU * 278 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 271 278 REMARK 960 helix_HE HELX_RH_AL_P SER * 304 SER * 311 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 304 311 REMARK 960 helix_HF1 HELX_RH_AL_P GLY * 328 GLY * 335 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 328 335 REMARK 960 helix_HF2 HELX_RH_AL_P ARG * 349 SER * 359 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 349 359 REMARK 960 helix_HF3 HELX_RH_AL_P ASP * 365 TYR * 375 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 365 375 REMARK 960 helix_HF HELX_RH_AL_P GLY * 384 TYR * 411 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 384 411 REMARK 960 helix_HG HELX_RH_AL_P ALA * 460 THR * 479 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 460 479 REMARK 960 helix_HH HELX_RH_AL_P VAL * 518 LEU * 531 REMARK 960 'RIGHT-HANDED ALPHA HELIX' REMARK 960 518 531 REMARK 960 REMARK 960 REMARK 960 REMARK 960 #################### REMARK 960 # # REMARK 960 # STRUCT_SITE # REMARK 960 # # REMARK 960 #################### REMARK 960 REMARK 960 REMARK 960 REMARK 960 loop_ REMARK 960 _struct_site.id REMARK 960 _struct_site.details REMARK 960 ACH ? REMARK 960 REMARK 960 loop_ REMARK 960 _struct_site_gen.id REMARK 960 _struct_site_gen.site_id REMARK 960 _struct_site_gen.label_comp_id REMARK 960 _struct_site_gen.label_asym_id REMARK 960 _struct_site_gen.auth_seq_id REMARK 960 _struct_site_gen.label_seq_id REMARK 960 _struct_site_gen.label_alt_id REMARK 960 _struct_site_gen.symmetry REMARK 960 _struct_site_gen.details REMARK 960 1 ACH SER * 200 200 . 1_555 . REMARK 960 2 ACH GLU * 327 327 . 1_555 . REMARK 960 3 ACH HIS * 440 440 . 1_555 . REMARK 960 4 ACH ACH * 998 . . 1_555 . REMARK 960 REMARK 960 REMARK 960 REMARK 960 ################ REMARK 960 # # REMARK 960 # STRUCT_SHEET # REMARK 960 # # REMARK 960 ################ REMARK 960 REMARK 960 loop_ REMARK 960 _struct_sheet.id REMARK 960 _struct_sheet.number_strands REMARK 960 S1 10 REMARK 960 S2 2 REMARK 960 REMARK 960 loop_ REMARK 960 _struct_sheet_hbond.sheet_id REMARK 960 _struct_sheet_hbond.range_id_1 REMARK 960 _struct_sheet_hbond.range_id_2 REMARK 960 _struct_sheet_hbond.range_1_beg_auth_seq_id REMARK 960 _struct_sheet_hbond.range_1_beg_label_atom_id REMARK 960 _struct_sheet_hbond.range_2_beg_auth_seq_id REMARK 960 _struct_sheet_hbond.range_2_beg_label_atom_id REMARK 960 _struct_sheet_hbond.range_1_end_auth_seq_id REMARK 960 _struct_sheet_hbond.range_1_end_label_atom_id REMARK 960 _struct_sheet_hbond.range_2_end_auth_seq_id REMARK 960 _struct_sheet_hbond.range_2_end_label_atom_id REMARK 960 _struct_sheet_hbond.range_1_beg_label_seq_id REMARK 960 _struct_sheet_hbond.range_2_beg_label_seq_id REMARK 960 _struct_sheet_hbond.range_1_end_label_seq_id REMARK 960 _struct_sheet_hbond.range_2_end_label_seq_id REMARK 960 S1 1_S1 2_S1 . . . . . . . REMARK 960 . REMARK 960 . . . . REMARK 960 S1 2_S1 3_S1 . . . . . . . REMARK 960 . REMARK 960 . . . . REMARK 960 S1 3_S1 4_S1 . . . . . . . REMARK 960 . REMARK 960 . . . . REMARK 960 S1 4_S1 5_S1 . . . . . . . REMARK 960 . REMARK 960 . . . . REMARK 960 S1 5_S1 6_S1 . . . . . . . REMARK 960 . REMARK 960 . . . . REMARK 960 S1 6_S1 7_S1 . . . . . . . REMARK 960 . REMARK 960 . . . . REMARK 960 S1 7_S1 8_S1 . . . . . . . REMARK 960 . REMARK 960 . . . . REMARK 960 S1 8_S1 9_S1 . . . . . . . REMARK 960 . REMARK 960 . . . . REMARK 960 S1 9_S1 10_S1 . . . . . . . REMARK 960 . REMARK 960 . . . . REMARK 960 S2 1_S2 2_S2 . . . . . . . REMARK 960 . REMARK 960 . . . . REMARK 960 REMARK 960 loop_ REMARK 960 _struct_sheet_order.sheet_id REMARK 960 _struct_sheet_order.range_id_1 REMARK 960 _struct_sheet_order.range_id_2 REMARK 960 _struct_sheet_order.offset REMARK 960 _struct_sheet_order.sense REMARK 960 S1 1_S1 2_S1 1 anti-parallel REMARK 960 S1 2_S1 3_S1 1 anti-parallel REMARK 960 S1 3_S1 4_S1 1 anti-parallel REMARK 960 S1 4_S1 5_S1 1 anti-parallel REMARK 960 S1 5_S1 6_S1 1 parallel REMARK 960 S1 6_S1 7_S1 1 parallel REMARK 960 S1 7_S1 8_S1 1 parallel REMARK 960 S1 8_S1 9_S1 1 parallel REMARK 960 S1 9_S1 10_S1 1 parallel REMARK 960 S2 1_S2 2_S2 1 anti-parallel REMARK 960 REMARK 960 loop_ REMARK 960 _struct_sheet_range.sheet_id REMARK 960 _struct_sheet_range.id REMARK 960 _struct_sheet_range.beg_label_comp_id REMARK 960 _struct_sheet_range.beg_label_asym_id REMARK 960 _struct_sheet_range.beg_auth_seq_id REMARK 960 _struct_sheet_range.end_label_comp_id REMARK 960 _struct_sheet_range.end_label_asym_id REMARK 960 _struct_sheet_range.end_auth_seq_id REMARK 960 _struct_sheet_range.beg_label_seq_id REMARK 960 _struct_sheet_range.end_label_seq_id REMARK 960 S1 1_S1 LEU * 6 THR * 10 REMARK 960 6 10 REMARK 960 S1 10_S1 ASN * 416 PHE * 423 REMARK 960 416 423 REMARK 960 S1 2_S1 GLY * 13 VAL * 20 REMARK 960 13 20 REMARK 960 S1 3_S1 ILE * 27 LEU * 31 REMARK 960 27 31 REMARK 960 S1 4_S1 TYR * 96 PRO * 102 REMARK 960 96 102 REMARK 960 S1 5_S1 VAL * 141 SER * 147 REMARK 960 141 147 REMARK 960 S1 6_S1 THR * 110 TYR * 116 REMARK 960 110 116 REMARK 960 S1 7_S1 THR * 193 GLU * 199 REMARK 960 193 199 REMARK 960 S1 8_S1 ARG * 221 SER * 226 REMARK 960 221 226 REMARK 960 S1 9_S1 THR * 317 ASN * 324 REMARK 960 317 324 REMARK 960 S2 1_S2 GLN * 500 LEU * 505 REMARK 960 500 505 REMARK 960 S2 2_S2 MET * 510 GLN * 514 REMARK 960 510 514 REMARK 960 REMARK 960 REMARK 960 REMARK 960 ######################## REMARK 960 # # REMARK 960 # PUBL_MANUSCRIPT_INCL # REMARK 960 # # REMARK 960 ######################## REMARK 960 REMARK 960 REMARK 960 REMARK 960 loop_ REMARK 960 _publ_manuscript_incl.entry_id REMARK 960 _publ_manuscript_incl.extra_item REMARK 960 _publ_manuscript_incl.extra_info REMARK 960 _publ_manuscript_incl.extra_defn REMARK 960 1ACE REMARK 960 '_struct_conn.ptnr1_atom_site_id' REMARK 960 '_atom_site.id of partner 1 of structure connection' REMARK 960 no REMARK 960 REMARK 960 1ACE REMARK 960 '_struct_conn.ptnr2_atom_site_id' REMARK 960 '_atom_site.id of partner 2 of structure connection' REMARK 960 no REMARK 960 REMARK 960 ############################################### REMARK 960 # This file was converted automatically from # REMARK 960 # PDB format to mmCIF format by the program # REMARK 960 # pdb2cif version 2.3.6 15 Jun 98 # REMARK 960 # by # REMARK 960 # Phil Bourne, Herbert J. Bernstein and # REMARK 960 # Frances C. Bernstein # REMARK 960 # # REMARK 960 # This work was supported in part by IUCr # REMARK 960 # (for HJB), US NSF, PHS, NIH, NCRR, NIGMS, # REMARK 960 # NLM and DOE (for FCB prior to 1998), and # REMARK 960 # and NSFgrant no. BIR 9310154 (for PEB) # REMARK 960 # # REMARK 960 # # REMARK 960 # Conversion from PDB format to mmCIF is a # REMARK 960 # complex process. This file should be # REMARK 960 # reviewed carefully before use. # REMARK 960 # # REMARK 960 # Even though the authors of pdb2cif have # REMARK 960 # made a good faith effort to ensure that # REMARK 960 # pdb2cif performs according to its # REMARK 960 # documentation, and we would greatly # REMARK 960 # appreciate hearing of any problems you # REMARK 960 # may encounter, the program pdb2cif and # REMARK 960 # any files created by pdb2cif are provided # REMARK 960 # **AS IS** without any warrantee as to # REMARK 960 # correctness, merchantability or fitness # REMARK 960 # for any particular or general use. # REMARK 960 # # REMARK 960 # THE RESPONSIBILITY FOR ANY ADVERSE # REMARK 960 # CONSEQUENCES FROM THE USE OF THE PROGRAM # REMARK 960 # PDB2CIF OR ANY FILE OR FILES CREATED BY # REMARK 960 # LIES SOLELY WITH THE USERS OF THE PROGRAM # REMARK 960 # AND FILE OR FILES AND NOT WITH AUTHORS OF # REMARK 960 # PDB2CIF # REMARK 960 # # REMARK 960 # The program pdb2cif is available from # REMARK 960 # the IUCr and its mirrors (see # REMARK 960 # http://www.iucr.org/iucr-top/cif # REMARK 960 # /software/pdb2cif) or # REMARK 960 # SDSC (see # REMARK 960 # http://www.sdsc.edu/pb/pdb2cif/pdb2cif) or # REMARK 960 # NDB and its mirrors (see # REMARK 960 # http://ndbserver.rutgers.edu/NDB/mmcif # REMARK 960 # /software/pdb2cif) # REMARK 960 # and the NDB mirror sites # REMARK 960 # # REMARK 960 # See H. Bernstein, F. Bernstein, # REMARK 960 # P. E. Bourne CIF Applications. VIII. # REMARK 960 # pdb2cif: Translating PDB Entries into # REMARK 960 # mmCIF Format, J. Appl. Cryst., # REMARK 960 # to appear, 1998. # REMARK 960 # Please report problems to: # REMARK 960 # yaya@bernstein-plus-sons.com # REMARK 960 # # REMARK 960 ############################################### REMARK 960 REMARK 960 REMARK 960 REMARK 960 # REMARK records parsed = 50; REMARK 960 ## specified by PDB REMARK 960 # FTNOTE records parsed = 2; REMARK 960 ## specified by PDB REMARK 960 # HET records parsed = 1; REMARK 960 ## specified by PDB REMARK 960 # HELIX records parsed = 14; REMARK 960 ## specified by PDB REMARK 960 # SHEET records parsed = 12; REMARK 960 ## specified by PDB REMARK 960 # TURN records parsed = 0; REMARK 960 ## specified by PDB REMARK 960 # SITE records parsed = 1; REMARK 960 ## specified by PDB REMARK 960 # AT+HET records parsed = 4196; REMARK 960 ## specified by PDB REMARK 960 # TER records parsed = 0; REMARK 960 ## specified by PDB REMARK 960 # CONECT records parsed = 17; REMARK 960 ## specified by PDB REMARK 960 # SEQRES records parsed = 42; REMARK 960 ## specified by PDB REMARK 960 # Total of 4368 records processed from PDB file REMARK 960 # DATABASE_PDB_REMARK: Only text in colum REMARK 960 #ns 12-70 retained REMARK 960 # PUBL_MANUSCRIPT_INCL: Tokens _struct_co REMARK 960 #nn.ptnrn_atom_site_id used SEQRES 1 * 537 ASP ASP HIS SER GLU LEU LEU VAL ASN THR LYS SER GLY SEQRES 2 * 537 LYS VAL MET GLY THR ARG VAL PRO VAL LEU SER SER HIS SEQRES 3 * 537 ILE SER ALA PHE LEU GLY ILE PRO PHE ALA GLU PRO PRO SEQRES 4 * 537 VAL GLY ASN MET ARG PHE ARG ARG PRO GLU PRO LYS LYS SEQRES 5 * 537 PRO TRP SER GLY VAL TRP ASN ALA SER THR TYR PRO ASN SEQRES 6 * 537 ASN CYS GLN GLN TYR VAL ASP GLU GLN PHE PRO GLY PHE SEQRES 7 * 537 SER GLY SER GLU MET TRP ASN PRO ASN ARG GLU MET SER SEQRES 8 * 537 GLU ASP CYS LEU TYR LEU ASN ILE TRP VAL PRO SER PRO SEQRES 9 * 537 ARG PRO LYS SER THR THR VAL MET VAL TRP ILE TYR GLY SEQRES 10 * 537 GLY GLY PHE TYR SER GLY SER SER THR LEU ASP VAL TYR SEQRES 11 * 537 ASN GLY LYS TYR LEU ALA TYR THR GLU GLU VAL VAL LEU SEQRES 12 * 537 VAL SER LEU SER TYR ARG VAL GLY ALA PHE GLY PHE LEU SEQRES 13 * 537 ALA LEU HIS GLY SER GLN GLU ALA PRO GLY ASN VAL GLY SEQRES 14 * 537 LEU LEU ASP GLN ARG MET ALA LEU GLN TRP VAL HIS ASP SEQRES 15 * 537 ASN ILE GLN PHE PHE GLY GLY ASP PRO LYS THR VAL THR SEQRES 16 * 537 ILE PHE GLY GLU SER ALA GLY GLY ALA SER VAL GLY MET SEQRES 17 * 537 HIS ILE LEU SER PRO GLY SER ARG ASP LEU PHE ARG ARG SEQRES 18 * 537 ALA ILE LEU GLN SER GLY SER PRO ASN CYS PRO TRP ALA SEQRES 19 * 537 SER VAL SER VAL ALA GLU GLY ARG ARG ARG ALA VAL GLU SEQRES 20 * 537 LEU GLY ARG ASN LEU ASN CYS ASN LEU ASN SER ASP GLU SEQRES 21 * 537 GLU LEU ILE HIS CYS LEU ARG GLU LYS LYS PRO GLN GLU SEQRES 22 * 537 LEU ILE ASP VAL GLU TRP ASN VAL LEU PRO PHE ASP SER SEQRES 23 * 537 ILE PHE ARG PHE SER PHE VAL PRO VAL ILE ASP GLY GLU SEQRES 24 * 537 PHE PHE PRO THR SER LEU GLU SER MET LEU ASN SER GLY SEQRES 25 * 537 ASN PHE LYS LYS THR GLN ILE LEU LEU GLY VAL ASN LYS SEQRES 26 * 537 ASP GLU GLY SER PHE PHE LEU LEU TYR GLY ALA PRO GLY SEQRES 27 * 537 PHE SER LYS ASP SER GLU SER LYS ILE SER ARG GLU ASP SEQRES 28 * 537 PHE MET SER GLY VAL LYS LEU SER VAL PRO HIS ALA ASN SEQRES 29 * 537 ASP LEU GLY LEU ASP ALA VAL THR LEU GLN TYR THR ASP SEQRES 30 * 537 TRP MET ASP ASP ASN ASN GLY ILE LYS ASN ARG ASP GLY SEQRES 31 * 537 LEU ASP ASP ILE VAL GLY ASP HIS ASN VAL ILE CYS PRO SEQRES 32 * 537 LEU MET HIS PHE VAL ASN LYS TYR THR LYS PHE GLY ASN SEQRES 33 * 537 GLY THR TYR LEU TYR PHE PHE ASN HIS ARG ALA SER ASN SEQRES 34 * 537 LEU VAL TRP PRO GLU TRP MET GLY VAL ILE HIS GLY TYR SEQRES 35 * 537 GLU ILE GLU PHE VAL PHE GLY LEU PRO LEU VAL LYS GLU SEQRES 36 * 537 LEU ASN TYR THR ALA GLU GLU GLU ALA LEU SER ARG ARG SEQRES 37 * 537 ILE MET HIS TYR TRP ALA THR PHE ALA LYS THR GLY ASN SEQRES 38 * 537 PRO ASN GLU PRO HIS SER GLN GLU SER LYS TRP PRO LEU SEQRES 39 * 537 PHE THR THR LYS GLU GLN LYS PHE ILE ASP LEU ASN THR SEQRES 40 * 537 GLU PRO MET LYS VAL HIS GLN ARG LEU ARG VAL GLN MET SEQRES 41 * 537 CYS VAL PHE TRP ASN GLN PHE LEU PRO LYS LEU LEU ASN SEQRES 42 * 537 ALA THR ALA CYS CRYST1 112.800 112.800 137.000 90.00 90.00 120.00 P 31 2 1 6 ORIGX1 1.000000 .000000 .000000 .00000 ORIGX2 .000000 1.000000 .000000 .00000 ORIGX3 .000000 .000000 1.000000 .00000 SCALE1 .008865 .005118 .000000 .00000 SCALE2 .000000 .010237 .000000 .00000 SCALE3 .000000 .000000 .007299 .00000 ATOM 27 N SER * 4 -12.046 86.376 34.906 1.00 40.05 N ATOM 28 CA SER * 4 -11.696 87.780 35.240 1.00 39.66 C ATOM 29 C SER * 4 -10.824 87.772 36.489 1.00 38.85 C ATOM 30 O SER * 4 -11.401 87.931 37.583 1.00 39.09 O ATOM 31 CB SER * 4 -12.969 88.602 35.473 1.00 40.14 C ATOM 32 OG SER * 4 -13.945 88.364 34.460 1.00 40.50 O ATOM 33 N GLU * 5 -9.531 87.600 36.329 1.00 37.69 N ATOM 34 CA GLU * 5 -8.574 87.533 37.442 1.00 36.14 C ATOM 35 C GLU * 5 -8.919 86.467 38.479 1.00 34.90 C ATOM 36 O GLU * 5 -8.177 85.488 38.609 1.00 34.88 O ATOM 37 CB GLU * 5 -8.467 88.813 38.220 1.00 36.60 C ATOM 38 CG GLU * 5 -7.270 89.694 37.962 1.00 37.27 C ATOM 39 CD GLU * 5 -5.942 89.010 38.195 1.00 37.60 C ATOM 40 OE1 GLU * 5 -5.181 89.459 39.043 1.00 37.92 O ATOM 41 OE2 GLU * 5 -5.774 88.020 37.445 1.00 37.55 O ATOM 42 N LEU * 6 -9.997 86.685 39.174 1.00 33.49 N ATOM 43 CA LEU * 6 -10.599 85.935 40.230 1.00 32.35 C ATOM 44 C LEU * 6 -11.702 84.988 39.872 1.00 32.46 C ATOM 45 O LEU * 6 -12.007 84.148 40.776 1.00 33.49 O ATOM 46 CB LEU * 6 -11.048 86.956 41.279 1.00 31.62 C ATOM 47 CG LEU * 6 -10.155 87.417 42.394 1.00 31.19 C ATOM 48 CD1 LEU * 6 -8.740 87.792 42.018 1.00 30.76 C ATOM 49 CD2 LEU * 6 -10.821 88.683 42.994 1.00 31.08 C ATOM 50 N LEU * 7 -12.345 84.999 38.735 1.00 32.18 N ATOM 51 CA LEU * 7 -13.419 84.003 38.408 1.00 31.28 C ATOM 52 C LEU * 7 -12.795 83.002 37.427 1.00 30.94 C ATOM 53 O LEU * 7 -12.485 83.406 36.279 1.00 31.36 O ATOM 54 CB LEU * 7 -14.644 84.692 37.841 1.00 31.12 C ATOM 55 CG LEU * 7 -15.845 83.851 37.487 1.00 30.99 C ATOM 56 CD1 LEU * 7 -15.473 82.645 36.620 1.00 31.13 C ATOM 57 CD2 LEU * 7 -16.499 83.311 38.754 1.00 31.02 C ATOM 58 N VAL * 8 -12.620 81.789 37.839 1.00 30.20 N ATOM 59 CA VAL * 8 -12.030 80.701 37.066 1.00 29.45 C ATOM 60 C VAL * 8 -13.004 79.581 36.777 1.00 29.45 C ATOM 61 O VAL * 8 -13.703 79.168 37.708 1.00 29.64 O ATOM 62 CB VAL * 8 -10.796 80.220 37.861 1.00 29.12 C ATOM 63 CG1 VAL * 8 -10.205 78.931 37.368 1.00 28.90 C ATOM 64 CG2 VAL * 8 -9.787 81.367 37.862 1.00 29.24 C ATOM 65 N ASN * 9 -13.030 79.105 35.558 1.00 29.41 N ATOM 66 CA ASN * 9 -13.894 78.004 35.091 1.00 29.47 C ATOM 67 C ASN * 9 -12.973 76.767 35.104 1.00 29.36 C ATOM 68 O ASN * 9 -11.921 76.817 34.431 1.00 30.25 O ATOM 69 CB ASN * 9 -14.363 78.335 33.716 1.00 30.27 C ATOM 70 CG ASN * 9 -15.818 78.345 33.405 1.00 31.48 C ATOM 71 OD1 ASN * 9 -16.574 77.348 33.566 1.00 32.03 O ATOM 72 ND2 ASN * 9 -16.247 79.536 32.899 1.00 31.65 N ATOM 73 N THR * 10 -13.267 75.752 35.824 1.00 28.22 N ATOM 74 CA THR * 10 -12.513 74.512 35.981 1.00 26.73 C ATOM 75 C THR * 10 -13.501 73.479 35.480 1.00 26.20 C ATOM 76 O THR * 10 -14.695 73.834 35.499 1.00 26.45 O ATOM 77 CB THR * 10 -12.141 74.236 37.485 1.00 26.80 C ATOM 78 OG1 THR * 10 -13.407 73.818 38.131 1.00 26.71 O ATOM 79 CG2 THR * 10 -11.484 75.390 38.237 1.00 26.26 C ATOM 80 N LYS * 11 -13.072 72.304 35.101 1.00 25.27 N ATOM 81 CA LYS * 11 -14.042 71.318 34.575 1.00 23.77 C ATOM 82 C LYS * 11 -15.109 70.921 35.545 1.00 24.03 C ATOM 83 O LYS * 11 -16.039 70.174 35.128 1.00 24.66 O ATOM 84 CB LYS * 11 -13.243 70.105 34.108 1.00 22.43 C ATOM 85 CG LYS * 11 -11.973 70.556 33.388 1.00 21.63 C ATOM 86 CD LYS * 11 -11.227 69.311 32.873 1.00 20.98 C ATOM 87 CE LYS * 11 -9.944 69.750 32.221 1.00 20.39 C ATOM 88 NZ LYS * 11 -9.015 68.610 32.162 1.00 20.52 N ATOM 89 N SER * 12 -15.006 71.332 36.780 1.00 24.27 N ATOM 90 CA SER * 12 -15.880 70.989 37.903 1.00 24.55 C ATOM 91 C SER * 12 -17.006 72.022 37.993 1.00 24.74 C ATOM 92 O SER * 12 -18.142 71.701 38.362 1.00 24.64 O ATOM 93 CB SER * 12 -15.142 71.007 39.240 1.00 25.04 C ATOM 94 OG SER * 12 -14.087 70.107 39.457 1.00 25.46 O ATOM 95 N GLY * 13 -16.541 73.218 37.664 1.00 24.90 N ATOM 96 CA GLY * 13 -17.359 74.404 37.655 1.00 25.49 C ATOM 97 C GLY * 13 -16.539 75.669 37.847 1.00 26.19 C ATOM 98 O GLY * 13 -15.305 75.691 37.910 1.00 25.78 O ATOM 99 N LYS * 14 -17.334 76.747 37.952 1.00 27.23 N ATOM 100 CA LYS * 14 -16.774 78.098 38.127 1.00 28.02 C ATOM 101 C LYS * 14 -16.397 78.307 39.591 1.00 28.01 C ATOM 102 O LYS * 14 -17.175 77.885 40.460 1.00 27.85 O ATOM 103 CB LYS * 14 -17.717 79.190 37.669 1.00 28.74 C ATOM 104 CG LYS * 14 -17.860 79.317 36.153 1.00 29.51 C ATOM 105 CD LYS * 14 -19.281 79.902 35.906 1.00 30.66 C ATOM 106 CE LYS * 14 -19.444 80.397 34.470 1.00 31.03 C ATOM 107 NZ LYS * 14 -18.083 80.884 33.984 1.00 31.61 N ATOM 108 N VAL * 15 -15.248 78.937 39.770 1.00 28.06 N ATOM 109 CA VAL * 15 -14.711 79.217 41.115 1.00 28.37 C ATOM 110 C VAL * 15 -14.335 80.671 41.207 1.00 28.82 C ATOM 111 O VAL * 15 -13.654 81.136 40.310 1.00 28.99 O ATOM 112 CB VAL * 15 -13.569 78.214 41.355 1.00 27.97 C ATOM 113 CG1 VAL * 15 -12.399 78.819 42.068 1.00 28.18 C ATOM 114 CG2 VAL * 15 -14.095 77.000 42.096 1.00 28.00 C ATOM 115 N MET * 16 -14.760 81.333 42.257 1.00 29.91 N ATOM 116 CA MET * 16 -14.438 82.817 42.450 1.00 30.52 C ATOM 117 C MET * 16 -13.553 82.900 43.688 1.00 30.32 C ATOM 118 O MET * 16 -13.895 82.527 44.830 1.00 30.03 O ATOM 119 CB MET * 16 -15.730 83.549 42.349 1.00 31.13 C ATOM 120 CG MET * 16 -16.099 84.808 42.979 1.00 32.08 C ATOM 121 SD MET * 16 -15.442 86.233 41.987 1.00 32.98 S ATOM 122 CE MET * 16 -16.569 85.961 40.551 1.00 33.02 C ATOM 123 N GLY * 17 -12.337 83.347 43.466 1.00 30.47 N ATOM 124 CA GLY * 17 -11.280 83.506 44.459 1.00 30.89 C ATOM 125 C GLY * 17 -11.407 84.770 45.259 1.00 31.44 C ATOM 126 O GLY * 17 -12.493 85.386 45.290 1.00 32.25 O ATOM 127 N THR * 18 -10.349 85.181 45.878 1.00 31.74 N ATOM 128 CA THR * 18 -10.239 86.367 46.732 1.00 32.33 C ATOM 129 C THR * 18 -8.874 86.970 46.490 1.00 32.78 C ATOM 130 O THR * 18 -7.880 86.263 46.117 1.00 33.19 O ATOM 131 CB THR * 18 -10.466 85.927 48.232 1.00 33.06 C ATOM 132 OG1 THR * 18 -11.205 86.983 48.956 1.00 33.75 O ATOM 133 CG2 THR * 18 -9.193 85.524 48.995 1.00 32.72 C ATOM 134 N ARG * 19 -8.776 88.269 46.712 1.00 32.80 N ATOM 135 CA ARG * 19 -7.480 88.963 46.494 1.00 32.52 C ATOM 136 C ARG * 19 -6.821 89.258 47.823 1.00 31.68 C ATOM 137 O ARG * 19 -7.209 90.188 48.578 1.00 32.11 O ATOM 138 CB ARG * 19 -7.722 90.207 45.619 1.00 33.39 C ATOM 139 CG ARG * 19 -6.505 91.060 45.378 1.00 34.85 C ATOM 140 CD ARG * 19 -6.648 92.107 44.342 1.00 36.37 C ATOM 141 NE ARG * 19 -5.339 92.654 43.915 1.00 37.94 N ATOM 142 CZ ARG * 19 -4.382 91.804 43.440 1.00 39.23 C ATOM 143 NH1 ARG * 19 -4.612 90.463 43.361 1.00 39.63 N ATOM 144 NH2 ARG * 19 -3.192 92.258 43.024 1.00 39.35 N ATOM 145 N VAL * 20 -5.783 88.497 48.145 1.00 29.97 N ATOM 146 CA VAL * 20 -5.062 88.701 49.424 1.00 28.21 C ATOM 147 C VAL * 20 -3.826 89.576 49.285 1.00 27.45 C ATOM 148 O VAL * 20 -3.155 89.475 48.268 1.00 27.09 O ATOM 149 CB VAL * 20 -4.710 87.265 49.907 1.00 27.43 C ATOM 150 CG1 VAL * 20 -5.935 86.376 49.830 1.00 26.92 C ATOM 151 CG2 VAL * 20 -3.505 86.732 49.169 1.00 26.91 C ATOM 152 N PRO * 21 -3.531 90.373 50.300 1.00 27.02 N ATOM 153 CA PRO * 21 -2.358 91.243 50.338 1.00 26.97 C ATOM 154 C PRO * 21 -1.152 90.352 50.657 1.00 27.18 C ATOM 155 O PRO * 21 -1.351 89.355 51.379 1.00 27.18 O ATOM 156 CB PRO * 21 -2.578 92.246 51.446 1.00 26.40 C ATOM 157 CG PRO * 21 -3.735 91.765 52.206 1.00 26.55 C ATOM 158 CD PRO * 21 -4.297 90.521 51.543 1.00 26.94 C ATOM 159 N VAL * 22 -.017 90.749 50.116 1.00 27.28 N ATOM 160 CA VAL * 22 1.226 90.002 50.306 1.00 27.81 C ATOM 161 C VAL * 22 2.415 90.950 50.138 1.00 28.35 C ATOM 162 O VAL * 22 2.625 91.572 49.074 1.00 28.71 O ATOM 163 CB VAL * 22 1.307 88.748 49.396 1.00 27.41 C ATOM 164 CG1 VAL * 22 1.605 89.037 47.935 1.00 27.29 C ATOM 165 CG2 VAL * 22 2.397 87.828 49.904 1.00 27.38 C ATOM 166 N LEU * 23 3.198 91.004 51.204 1.00 28.71 N ATOM 167 CA LEU * 23 4.389 91.877 51.246 1.00 28.74 C ATOM 168 C LEU * 23 3.956 93.130 50.478 1.00 29.32 C ATOM 169 O LEU * 23 2.960 93.789 50.784 1.00 29.26 O ATOM 170 CB LEU * 23 5.640 91.214 50.787 1.00 28.39 C ATOM 171 CG LEU * 23 6.313 90.075 51.482 1.00 28.63 C ATOM 172 CD1 LEU * 23 5.907 89.880 52.941 1.00 28.40 C ATOM 173 CD2 LEU * 23 6.048 88.731 50.759 1.00 29.07 C ATOM 174 N SER * 24 4.702 93.408 49.453 1.00 30.43 N ATOM 175 CA SER * 24 4.474 94.584 48.604 1.00 31.20 C ATOM 176 C SER * 24 3.114 94.569 47.923 1.00 31.38 C ATOM 177 O SER * 24 2.185 95.352 48.282 1.00 31.46 O ATOM 178 CB SER * 24 5.609 94.650 47.575 1.00 31.58 C ATOM 179 OG SER * 24 6.459 93.502 47.726 1.00 32.01 O ATOM 180 N SER * 25 3.045 93.646 46.944 1.00 30.81 N ATOM 181 CA SER * 25 1.827 93.530 46.133 1.00 30.03 C ATOM 182 C SER * 25 .623 92.982 46.842 1.00 29.51 C ATOM 183 O SER * 25 .354 93.191 48.021 1.00 29.26 O ATOM 184 CB SER * 25 2.119 92.823 44.818 1.00 30.24 C ATOM 185 OG SER * 25 2.820 93.648 43.890 1.00 30.50 O ATOM 186 N HIS * 26 -.145 92.303 46.028 1.00 29.42 N ATOM 187 CA HIS * 26 -1.399 91.591 46.189 1.00 28.89 C ATOM 188 C HIS * 26 -1.356 90.340 45.281 1.00 28.45 C ATOM 189 O HIS * 26 -.596 90.214 44.315 1.00 28.36 O ATOM 190 CB HIS * 26 -2.660 92.406 45.888 1.00 28.81 C ATOM 196 N ILE * 27 -2.211 89.395 45.631 1.00 27.93 N ATOM 197 CA ILE * 27 -2.292 88.094 44.958 1.00 26.68 C ATOM 198 C ILE * 27 -3.686 87.539 44.996 1.00 26.05 C ATOM 199 O ILE * 27 -4.581 88.089 45.667 1.00 25.87 O ATOM 200 CB ILE * 27 -1.219 87.187 45.654 1.00 26.73 C ATOM 201 CG1 ILE * 27 .076 87.378 44.822 1.00 27.26 C ATOM 202 CG2 ILE * 27 -1.587 85.733 45.892 1.00 26.85 C ATOM 203 CD1 ILE * 27 1.190 86.328 45.164 1.00 28.13 C ATOM 204 N SER * 28 -3.802 86.426 44.251 1.00 25.18 N ATOM 205 CA SER * 28 -5.104 85.749 44.164 1.00 24.45 C ATOM 206 C SER * 28 -5.041 84.495 45.028 1.00 24.03 C ATOM 207 O SER * 28 -3.956 83.886 45.057 1.00 24.32 O ATOM 208 CB SER * 28 -5.508 85.442 42.747 1.00 24.63 C ATOM 209 OG SER * 28 -6.570 86.322 42.365 1.00 24.88 O ATOM 210 N ALA * 29 -6.179 84.194 45.636 1.00 22.79 N ATOM 211 CA ALA * 29 -6.236 83.002 46.497 1.00 21.74 C ATOM 212 C ALA * 29 -7.595 82.345 46.301 1.00 21.16 C ATOM 213 O ALA * 29 -8.578 83.059 46.410 1.00 21.50 O ATOM 214 CB ALA * 29 -6.000 83.473 47.920 1.00 21.80 C ATOM 215 N PHE * 30 -7.643 81.076 45.999 1.00 20.21 N ATOM 216 CA PHE * 30 -8.916 80.351 45.785 1.00 19.62 C ATOM 217 C PHE * 30 -8.958 79.399 46.969 1.00 18.95 C ATOM 218 O PHE * 30 -8.099 78.466 46.955 1.00 19.71 O ATOM 219 CB PHE * 30 -8.935 79.654 44.400 1.00 20.31 C ATOM 220 CG PHE * 30 -8.852 80.647 43.252 1.00 19.91 C ATOM 221 CD1 PHE * 30 -10.049 81.072 42.644 1.00 19.60 C ATOM 222 CD2 PHE * 30 -7.615 81.157 42.854 1.00 19.43 C ATOM 223 CE1 PHE * 30 -10.032 82.007 41.639 1.00 19.34 C ATOM 224 CE2 PHE * 30 -7.551 82.101 41.843 1.00 19.19 C ATOM 225 CZ PHE * 30 -8.772 82.511 41.254 1.00 19.50 C ATOM 226 N LEU * 31 -9.845 79.621 47.899 1.00 17.14 N ATOM 227 CA LEU * 31 -9.890 78.831 49.124 1.00 15.69 C ATOM 228 C LEU * 31 -10.980 77.803 49.272 1.00 15.52 C ATOM 229 O LEU * 31 -12.213 77.870 49.110 1.00 15.73 O ATOM 230 CB LEU * 31 -9.837 79.919 50.221 1.00 14.96 C ATOM 231 CG LEU * 31 -8.577 80.508 50.809 1.00 14.08 C ATOM 232 CD1 LEU * 31 -7.300 80.372 50.048 1.00 13.65 C ATOM 233 CD2 LEU * 31 -8.853 81.987 51.077 1.00 13.39 C ATOM 234 N GLY * 32 -10.507 76.609 49.688 1.00 14.77 N ATOM 235 CA GLY * 32 -11.360 75.497 49.923 1.00 14.21 C ATOM 236 C GLY * 32 -12.246 75.035 48.803 1.00 13.80 C ATOM 237 O GLY * 32 -13.502 74.971 48.988 1.00 13.71 O ATOM 238 N ILE * 33 -11.591 74.669 47.725 1.00 13.32 N ATOM 239 CA ILE * 33 -12.272 74.112 46.521 1.00 13.05 C ATOM 240 C ILE * 33 -12.507 72.619 46.714 1.00 12.89 C ATOM 241 O ILE * 33 -11.530 71.839 46.924 1.00 13.18 O ATOM 242 CB ILE * 33 -11.310 74.374 45.285 1.00 12.64 C ATOM 243 CG1 ILE * 33 -11.195 75.880 45.032 1.00 12.44 C ATOM 244 CG2 ILE * 33 -11.772 73.587 44.051 1.00 12.66 C ATOM 245 CD1 ILE * 33 -10.060 76.211 44.035 1.00 12.60 C ATOM 246 N PRO * 34 -13.721 72.152 46.643 1.00 12.83 N ATOM 247 CA PRO * 34 -13.992 70.700 46.807 1.00 13.31 C ATOM 248 C PRO * 34 -13.229 69.903 45.771 1.00 14.46 C ATOM 249 O PRO * 34 -13.023 70.452 44.631 1.00 15.57 O ATOM 250 CB PRO * 34 -15.490 70.593 46.613 1.00 12.72 C ATOM 251 CG PRO * 34 -15.930 71.841 45.916 1.00 12.46 C ATOM 252 CD PRO * 34 -14.933 72.918 46.381 1.00 12.76 C ATOM 253 N PHE * 35 -12.827 68.682 46.009 1.00 14.79 N ATOM 254 CA PHE * 35 -12.106 67.900 44.993 1.00 15.27 C ATOM 255 C PHE * 35 -12.562 66.457 45.047 1.00 16.32 C ATOM 256 O PHE * 35 -12.165 65.595 44.218 1.00 17.02 O ATOM 257 CB PHE * 35 -10.640 68.000 45.227 1.00 15.83 C ATOM 258 CG PHE * 35 -10.017 67.372 46.413 1.00 16.67 C ATOM 259 CD1 PHE * 35 -9.907 65.987 46.528 1.00 16.80 C ATOM 260 CD2 PHE * 35 -9.470 68.185 47.423 1.00 17.31 C ATOM 261 CE1 PHE * 35 -9.283 65.392 47.600 1.00 17.02 C ATOM 262 CE2 PHE * 35 -8.836 67.626 48.549 1.00 17.65 C ATOM 263 CZ PHE * 35 -8.746 66.209 48.609 1.00 17.73 C ATOM 264 N ALA * 36 -13.370 66.206 46.059 1.00 16.48 N ATOM 265 CA ALA * 36 -13.921 64.878 46.390 1.00 16.29 C ATOM 266 C ALA * 36 -15.261 65.057 47.032 1.00 16.72 C ATOM 267 O ALA * 36 -15.633 66.175 47.411 1.00 17.04 O ATOM 268 CB ALA * 36 -12.871 64.216 47.262 1.00 15.76 C ATOM 269 N GLU * 37 -16.081 64.075 47.180 1.00 17.96 N ATOM 270 CA GLU * 37 -17.419 64.360 47.831 1.00 19.55 C ATOM 271 C GLU * 37 -17.231 64.193 49.295 1.00 20.25 C ATOM 272 O GLU * 37 -16.326 63.391 49.646 1.00 21.25 O ATOM 273 CB GLU * 37 -18.344 63.379 47.137 1.00 20.11 C ATOM 274 CG GLU * 37 -18.774 64.038 45.779 1.00 21.60 C ATOM 275 CD GLU * 37 -20.237 64.408 45.804 1.00 22.29 C ATOM 276 OE1 GLU * 37 -21.055 63.495 45.969 1.00 22.52 O ATOM 277 OE2 GLU * 37 -20.415 65.643 45.685 1.00 22.76 O ATOM 278 N PRO * 38 -17.940 64.889 50.152 1.00 20.40 N ATOM 279 CA PRO * 38 -17.799 64.797 51.600 1.00 20.43 C ATOM 280 C PRO * 38 -17.835 63.334 52.010 1.00 20.87 C ATOM 281 O PRO * 38 -18.833 62.696 51.664 1.00 21.61 O ATOM 282 CB PRO * 38 -18.992 65.554 52.127 1.00 20.32 C ATOM 283 CG PRO * 38 -19.190 66.646 51.094 1.00 20.37 C ATOM 284 CD PRO * 38 -18.986 65.867 49.793 1.00 20.74 C ATOM 285 N PRO * 39 -16.783 62.882 52.695 1.00 20.47 N ATOM 286 CA PRO * 39 -16.689 61.520 53.153 1.00 20.40 C ATOM 287 C PRO * 39 -17.482 61.322 54.428 1.00 20.63 C ATOM 288 O PRO * 39 -17.075 60.561 55.339 1.00 20.93 O ATOM 289 CB PRO * 39 -15.185 61.303 53.308 1.00 20.12 C ATOM 290 CG PRO * 39 -14.737 62.638 53.779 1.00 20.26 C ATOM 291 CD PRO * 39 -15.598 63.648 53.074 1.00 20.16 C ATOM 292 N VAL * 40 -18.638 61.951 54.479 1.00 20.74 N ATOM 293 CA VAL * 40 -19.509 61.804 55.664 1.00 21.13 C ATOM 294 C VAL * 40 -20.376 60.559 55.503 1.00 21.89 C ATOM 295 O VAL * 40 -20.157 59.713 54.650 1.00 22.06 O ATOM 296 CB VAL * 40 -20.322 63.096 55.831 1.00 20.47 C ATOM 297 CG1 VAL * 40 -19.439 64.326 55.944 1.00 19.97 C ATOM 298 CG2 VAL * 40 -21.301 63.087 54.694 1.00 20.11 C ATOM 299 N GLY * 41 -21.351 60.448 56.359 1.00 23.07 N ATOM 300 CA GLY * 41 -22.337 59.384 56.468 1.00 24.05 C ATOM 301 C GLY * 41 -21.770 58.009 56.242 1.00 24.86 C ATOM 302 O GLY * 41 -20.687 57.687 56.740 1.00 24.78 O ATOM 303 N ASN * 42 -22.519 57.235 55.470 1.00 26.08 N ATOM 304 CA ASN * 42 -22.156 55.834 55.142 1.00 27.08 C ATOM 305 C ASN * 42 -20.820 55.732 54.417 1.00 27.67 C ATOM 306 O ASN * 42 -20.234 54.643 54.235 1.00 27.65 O ATOM 307 CB ASN * 42 -23.315 55.158 54.412 1.00 27.03 C ATOM 311 N MET * 43 -20.326 56.877 54.027 1.00 28.53 N ATOM 312 CA MET * 43 -19.067 57.043 53.321 1.00 29.22 C ATOM 313 C MET * 43 -17.834 57.134 54.190 1.00 28.79 C ATOM 314 O MET * 43 -16.750 57.377 53.617 1.00 28.95 O ATOM 315 CB MET * 43 -19.209 58.314 52.442 1.00 30.34 C ATOM 316 CG MET * 43 -20.244 57.902 51.368 1.00 31.63 C ATOM 317 SD MET * 43 -19.416 58.505 49.825 1.00 33.10 S ATOM 318 CE MET * 43 -19.711 60.289 50.112 1.00 32.89 C ATOM 319 N ARG * 44 -17.952 56.958 55.481 1.00 28.29 N ATOM 320 CA ARG * 44 -16.805 57.028 56.381 1.00 27.85 C ATOM 321 C ARG * 44 -15.905 55.815 56.123 1.00 27.62 C ATOM 322 O ARG * 44 -16.479 54.725 55.999 1.00 27.25 O ATOM 323 CB ARG * 44 -17.208 57.037 57.871 1.00 27.85 C ATOM 324 CG ARG * 44 -16.039 57.582 58.727 1.00 27.61 C ATOM 325 CD ARG * 44 -16.250 57.461 60.198 1.00 26.87 C ATOM 326 NE ARG * 44 -17.035 58.590 60.662 1.00 26.43 N ATOM 327 CZ ARG * 44 -17.820 58.543 61.737 1.00 26.34 C ATOM 328 NH1 ARG * 44 -17.983 57.423 62.445 1.00 26.20 N ATOM 329 NH2 ARG * 44 -18.403 59.668 62.134 1.00 25.94 N ATOM 330 N PHE * 45 -14.600 56.030 56.097 1.00 27.27 N ATOM 331 CA PHE * 45 -13.641 54.959 55.880 1.00 27.62 C ATOM 332 C PHE * 45 -13.561 54.535 54.407 1.00 27.87 C ATOM 333 O PHE * 45 -12.580 53.862 54.017 1.00 27.46 O ATOM 334 CB PHE * 45 -13.897 53.734 56.793 1.00 27.81 C ATOM 335 CG PHE * 45 -14.213 54.042 58.226 1.00 27.99 C ATOM 336 CD1 PHE * 45 -13.368 54.827 59.014 1.00 27.85 C ATOM 337 CD2 PHE * 45 -15.403 53.548 58.813 1.00 27.97 C ATOM 338 CE1 PHE * 45 -13.684 55.134 60.330 1.00 27.38 C ATOM 339 CE2 PHE * 45 -15.739 53.851 60.125 1.00 27.22 C ATOM 340 CZ PHE * 45 -14.859 54.649 60.861 1.00 27.11 C ATOM 341 N ARG * 46 -14.550 54.916 53.624 1.00 28.23 N ATOM 342 CA ARG * 46 -14.608 54.575 52.203 1.00 28.96 C ATOM 343 C ARG * 46 -13.710 55.498 51.370 1.00 28.30 C ATOM 344 O ARG * 46 -13.542 56.697 51.652 1.00 28.39 O ATOM 345 CB ARG * 46 -16.013 54.530 51.567 1.00 30.40 C ATOM 346 CG ARG * 46 -16.745 53.190 51.825 1.00 32.09 C ATOM 347 CD ARG * 46 -17.389 52.695 50.584 1.00 33.97 C ATOM 348 NE ARG * 46 -16.391 52.260 49.562 1.00 35.66 N ATOM 349 CZ ARG * 46 -16.460 52.746 48.294 1.00 36.55 C ATOM 350 NH1 ARG * 46 -17.374 53.645 47.876 1.00 36.65 N ATOM 351 NH2 ARG * 46 -15.577 52.294 47.379 1.00 36.69 N ATOM 352 N ARG * 47 -13.150 54.850 50.359 1.00 27.08 N ATOM 353 CA ARG * 47 -12.231 55.480 49.388 1.00 25.83 C ATOM 354 C ARG * 47 -12.986 56.669 48.852 1.00 25.34 C ATOM 355 O ARG * 47 -14.225 56.504 48.780 1.00 25.84 O ATOM 356 CB ARG * 47 -11.987 54.450 48.316 1.00 25.85 C ATOM 357 CG ARG * 47 -10.982 54.710 47.240 1.00 26.21 C ATOM 363 N PRO * 48 -12.332 57.750 48.506 1.00 24.74 N ATOM 364 CA PRO * 48 -13.003 58.930 47.985 1.00 24.62 C ATOM 365 C PRO * 48 -13.594 58.813 46.589 1.00 24.78 C ATOM 366 O PRO * 48 -13.119 58.124 45.672 1.00 24.97 O ATOM 367 CB PRO * 48 -11.975 60.049 48.068 1.00 24.08 C ATOM 368 CG PRO * 48 -10.666 59.365 48.215 1.00 24.29 C ATOM 369 CD PRO * 48 -10.881 57.936 48.617 1.00 24.51 C ATOM 370 N GLU * 49 -14.682 59.543 46.430 1.00 24.92 N ATOM 371 CA GLU * 49 -15.448 59.677 45.186 1.00 25.26 C ATOM 372 C GLU * 49 -15.081 61.089 44.693 1.00 25.46 C ATOM 373 O GLU * 49 -14.825 61.949 45.556 1.00 26.21 O ATOM 374 CB GLU * 49 -16.940 59.575 45.303 1.00 25.19 C ATOM 375 CG GLU * 49 -17.648 58.215 45.497 1.00 25.23 C ATOM 379 N PRO * 50 -15.022 61.280 43.401 1.00 25.15 N ATOM 380 CA PRO * 50 -14.676 62.584 42.821 1.00 24.77 C ATOM 381 C PRO * 50 -15.875 63.492 42.994 1.00 24.96 C ATOM 382 O PRO * 50 -17.007 62.997 42.902 1.00 25.16 O ATOM 383 CB PRO * 50 -14.364 62.296 41.407 1.00 24.67 C ATOM 384 CG PRO * 50 -14.648 60.854 41.162 1.00 25.11 C ATOM 385 CD PRO * 50 -15.319 60.272 42.377 1.00 25.06 C ATOM 386 N LYS * 51 -15.637 64.756 43.205 1.00 25.14 N ATOM 387 CA LYS * 51 -16.704 65.737 43.424 1.00 25.59 C ATOM 388 C LYS * 51 -17.601 66.021 42.250 1.00 26.65 C ATOM 389 O LYS * 51 -17.070 66.497 41.207 1.00 27.23 O ATOM 390 CB LYS * 51 -16.018 67.085 43.783 1.00 24.60 C ATOM 391 CG LYS * 51 -17.045 68.177 43.945 1.00 23.47 C ATOM 392 CD LYS * 51 -17.982 67.865 45.060 1.00 23.10 C ATOM 393 CE LYS * 51 -18.658 69.135 45.561 1.00 23.22 C ATOM 394 NZ LYS * 51 -19.864 68.698 46.361 1.00 23.54 N ATOM 395 N LYS * 52 -18.894 65.815 42.385 1.00 27.27 N ATOM 396 CA LYS * 52 -19.848 66.117 41.273 1.00 27.41 C ATOM 397 C LYS * 52 -19.683 67.552 40.839 1.00 27.71 C ATOM 398 O LYS * 52 -19.505 68.430 41.691 1.00 27.63 O ATOM 399 CB LYS * 52 -21.250 65.877 41.793 1.00 27.34 C ATOM 400 CG LYS * 52 -21.421 64.486 42.389 1.00 27.06 C ATOM 401 CD LYS * 52 -22.816 63.957 42.101 1.00 27.00 C ATOM 402 CE LYS * 52 -23.037 62.596 42.794 1.00 26.70 C ATOM 403 NZ LYS * 52 -23.601 62.905 44.146 1.00 26.72 N ATOM 404 N PRO * 53 -19.730 67.799 39.536 1.00 28.44 N ATOM 405 CA PRO * 53 -19.538 69.165 38.978 1.00 28.96 C ATOM 406 C PRO * 53 -20.604 70.067 39.523 1.00 29.76 C ATOM 407 O PRO * 53 -21.738 69.581 39.785 1.00 30.55 O ATOM 408 CB PRO * 53 -19.589 68.995 37.483 1.00 28.58 C ATOM 409 CG PRO * 53 -19.395 67.524 37.243 1.00 28.21 C ATOM 410 CD PRO * 53 -19.956 66.841 38.461 1.00 28.30 C ATOM 411 N TRP * 54 -20.268 71.319 39.728 1.00 30.37 N ATOM 412 CA TRP * 54 -21.319 72.212 40.284 1.00 30.88 C ATOM 413 C TRP * 54 -21.637 73.216 39.178 1.00 31.56 C ATOM 414 O TRP * 54 -20.942 73.416 38.166 1.00 32.05 O ATOM 415 CB TRP * 54 -20.936 72.872 41.630 1.00 30.24 C ATOM 416 CG TRP * 54 -19.650 73.592 41.561 1.00 29.97 C ATOM 417 CD1 TRP * 54 -19.429 74.901 41.195 1.00 30.14 C ATOM 418 CD2 TRP * 54 -18.348 73.022 41.781 1.00 29.80 C ATOM 419 NE1 TRP * 54 -18.070 75.180 41.189 1.00 29.89 N ATOM 420 CE2 TRP * 54 -17.395 74.043 41.544 1.00 29.67 C ATOM 421 CE3 TRP * 54 -17.937 71.753 42.172 1.00 29.67 C ATOM 422 CZ2 TRP * 54 -16.042 73.849 41.706 1.00 29.64 C ATOM 423 CZ3 TRP * 54 -16.571 71.541 42.292 1.00 29.89 C ATOM 424 CH2 TRP * 54 -15.646 72.563 42.073 1.00 29.99 C ATOM 425 N SER * 55 -22.772 73.816 39.434 1.00 31.93 N ATOM 426 CA SER * 55 -23.328 74.888 38.627 1.00 31.99 C ATOM 427 C SER * 55 -23.137 76.136 39.523 1.00 31.93 C ATOM 428 O SER * 55 -22.920 75.991 40.781 1.00 32.86 O ATOM 429 CB SER * 55 -24.807 74.679 38.377 1.00 32.13 C ATOM 430 OG SER * 55 -25.169 75.773 37.516 1.00 33.25 O ATOM 431 N GLY * 56 -23.254 77.297 38.945 1.00 30.72 N ATOM 432 CA GLY * 56 -23.106 78.489 39.830 1.00 29.35 C ATOM 433 C GLY * 56 -21.593 78.625 40.008 1.00 28.48 C ATOM 434 O GLY * 56 -20.876 77.828 39.441 1.00 29.03 O ATOM 435 N VAL * 57 -21.228 79.619 40.713 1.00 27.76 N ATOM 436 CA VAL * 57 -19.872 79.970 41.044 1.00 27.31 C ATOM 437 C VAL * 57 -19.609 79.447 42.466 1.00 27.26 C ATOM 438 O VAL * 57 -20.380 79.759 43.384 1.00 27.25 O ATOM 439 CB VAL * 57 -19.756 81.509 40.935 1.00 26.95 C ATOM 440 CG1 VAL * 57 -18.661 82.011 41.869 1.00 27.15 C ATOM 441 CG2 VAL * 57 -19.543 81.989 39.536 1.00 26.60 C ATOM 442 N TRP * 58 -18.565 78.672 42.607 1.00 27.31 N ATOM 443 CA TRP * 58 -18.163 78.139 43.912 1.00 27.27 C ATOM 444 C TRP * 58 -17.475 79.326 44.615 1.00 27.61 C ATOM 445 O TRP * 58 -16.483 79.791 43.980 1.00 28.11 O ATOM 446 CB TRP * 58 -17.152 76.995 43.748 1.00 27.00 C ATOM 447 CG TRP * 58 -16.832 76.512 45.138 1.00 26.72 C ATOM 448 CD1 TRP * 58 -15.856 76.955 45.978 1.00 26.63 C ATOM 449 CD2 TRP * 58 -17.608 75.548 45.860 1.00 26.29 C ATOM 450 NE1 TRP * 58 -15.964 76.263 47.181 1.00 26.44 N ATOM 451 CE2 TRP * 58 -17.015 75.417 47.119 1.00 26.21 C ATOM 452 CE3 TRP * 58 -18.712 74.792 45.536 1.00 26.18 C ATOM 453 CZ2 TRP * 58 -17.491 74.539 48.070 1.00 26.54 C ATOM 454 CZ3 TRP * 58 -19.178 73.918 46.475 1.00 26.44 C ATOM 455 CH2 TRP * 58 -18.600 73.791 47.730 1.00 26.58 C ATOM 456 N ASN * 59 -17.942 79.801 45.749 1.00 27.56 N ATOM 457 CA ASN * 59 -17.229 80.969 46.349 1.00 27.86 C ATOM 458 C ASN * 59 -15.946 80.462 46.971 1.00 27.16 C ATOM 459 O ASN * 59 -16.179 79.590 47.829 1.00 27.88 O ATOM 460 CB ASN * 59 -18.149 81.668 47.355 1.00 29.07 C ATOM 461 CG ASN * 59 -17.459 82.917 47.917 1.00 30.26 C ATOM 462 OD1 ASN * 59 -17.776 83.411 49.008 1.00 30.69 O ATOM 463 ND2 ASN * 59 -16.475 83.449 47.141 1.00 30.68 N ATOM 464 N ALA * 60 -14.755 80.887 46.686 1.00 25.90 N ATOM 465 CA ALA * 60 -13.553 80.299 47.319 1.00 24.94 C ATOM 466 C ALA * 60 -12.693 81.331 47.991 1.00 24.76 C ATOM 467 O ALA * 60 -11.486 81.471 47.686 1.00 24.73 O ATOM 468 CB ALA * 60 -12.784 79.621 46.176 1.00 24.71 C ATOM 469 N SER * 61 -13.269 82.067 48.920 1.00 24.61 N ATOM 470 CA SER * 61 -12.537 83.192 49.575 1.00 24.48 C ATOM 471 C SER * 61 -12.295 83.015 51.051 1.00 24.72 C ATOM 472 O SER * 61 -11.659 83.882 51.722 1.00 25.20 O ATOM 473 CB SER * 61 -13.417 84.422 49.276 1.00 24.16 C ATOM 474 OG SER * 61 -14.734 83.991 49.775 1.00 23.97 O ATOM 475 N THR * 62 -12.772 81.885 51.551 1.00 23.74 N ATOM 476 CA THR * 62 -12.621 81.482 52.950 1.00 22.65 C ATOM 477 C THR * 62 -12.144 80.044 53.031 1.00 21.52 C ATOM 478 O THR * 62 -12.679 79.225 52.292 1.00 21.51 O ATOM 479 CB THR * 62 -14.066 81.669 53.564 1.00 23.05 C ATOM 480 OG1 THR * 62 -14.907 80.966 52.601 1.00 23.48 O ATOM 481 CG2 THR * 62 -14.415 83.157 53.667 1.00 23.48 C ATOM 482 N TYR * 63 -11.208 79.724 53.883 1.00 20.30 N ATOM 483 CA TYR * 63 -10.612 78.437 54.155 1.00 18.96 C ATOM 484 C TYR * 63 -11.624 77.342 54.513 1.00 18.07 C ATOM 485 O TYR * 63 -12.596 77.592 55.185 1.00 17.83 O ATOM 486 CB TYR * 63 -9.659 78.491 55.339 1.00 18.69 C ATOM 487 CG TYR * 63 -8.283 78.996 55.076 1.00 19.12 C ATOM 488 CD1 TYR * 63 -7.801 80.150 55.685 1.00 19.25 C ATOM 489 CD2 TYR * 63 -7.414 78.326 54.235 1.00 19.42 C ATOM 490 CE1 TYR * 63 -6.513 80.607 55.477 1.00 19.46 C ATOM 491 CE2 TYR * 63 -6.102 78.775 54.019 1.00 19.59 C ATOM 492 CZ TYR * 63 -5.657 79.925 54.631 1.00 19.36 C ATOM 493 OH TYR * 63 -4.374 80.338 54.418 1.00 19.12 O ATOM 494 N PRO * 64 -11.314 76.134 54.074 1.00 17.52 N ATOM 495 CA PRO * 64 -12.178 74.992 54.368 1.00 17.17 C ATOM 496 C PRO * 64 -12.041 74.554 55.819 1.00 17.01 C ATOM 497 O PRO * 64 -11.129 74.893 56.615 1.00 16.98 O ATOM 498 CB PRO * 64 -11.707 73.956 53.332 1.00 17.01 C ATOM 499 CG PRO * 64 -10.233 74.262 53.153 1.00 17.14 C ATOM 500 CD PRO * 64 -10.107 75.771 53.284 1.00 17.24 C ATOM 501 N ASN * 65 -12.981 73.726 56.274 1.00 16.90 N ATOM 502 CA ASN * 65 -12.906 73.194 57.630 1.00 16.59 C ATOM 503 C ASN * 65 -11.641 72.280 57.593 1.00 16.53 C ATOM 504 O ASN * 65 -11.272 71.912 56.479 1.00 16.60 O ATOM 505 CB ASN * 65 -14.003 72.242 57.992 1.00 17.06 C ATOM 506 CG ASN * 65 -15.356 72.894 58.160 1.00 17.78 C ATOM 507 OD1 ASN * 65 -16.314 72.123 57.869 1.00 18.42 O ATOM 508 ND2 ASN * 65 -15.319 74.160 58.571 1.00 17.45 N ATOM 509 N ASN * 66 -11.217 71.991 58.791 1.00 16.22 N ATOM 510 CA ASN * 66 -10.094 71.055 58.999 1.00 16.19 C ATOM 511 C ASN * 66 -10.780 69.671 59.211 1.00 16.10 C ATOM 512 O ASN * 66 -11.968 69.602 59.663 1.00 16.11 O ATOM 513 CB ASN * 66 -9.222 71.493 60.158 1.00 16.27 C ATOM 514 CG ASN * 66 -8.628 72.856 59.915 1.00 16.62 C ATOM 515 OD1 ASN * 66 -8.419 73.314 58.788 1.00 17.25 O ATOM 516 ND2 ASN * 66 -8.362 73.611 60.964 1.00 17.01 N ATOM 517 N CYS * 67 -10.069 68.637 58.867 1.00 15.53 N ATOM 518 CA CYS * 67 -10.616 67.282 59.051 1.00 15.55 C ATOM 519 C CYS * 67 -10.664 67.021 60.550 1.00 15.97 C ATOM 520 O CYS * 67 -9.905 67.701 61.264 1.00 16.40 O ATOM 521 CB CYS * 67 -9.717 66.277 58.341 1.00 15.23 C ATOM 522 SG CYS * 67 -9.745 66.286 56.559 1.00 15.01 S ATOM 523 N GLN * 68 -11.471 66.084 61.002 1.00 16.67 N ATOM 524 CA GLN * 68 -11.556 65.702 62.415 1.00 17.21 C ATOM 525 C GLN * 68 -10.179 65.237 62.877 1.00 17.81 C ATOM 526 O GLN * 68 -9.550 64.473 62.106 1.00 18.37 O ATOM 527 CB GLN * 68 -12.518 64.526 62.597 1.00 16.90 C ATOM 528 CG GLN * 68 -13.921 64.966 62.330 1.00 17.80 C ATOM 529 CD GLN * 68 -14.495 65.851 63.424 1.00 18.19 C ATOM 530 OE1 GLN * 68 -13.734 66.420 64.227 1.00 18.68 O ATOM 531 NE2 GLN * 68 -15.817 65.934 63.419 1.00 17.64 N ATOM 532 N GLN * 69 -9.717 65.601 64.050 1.00 18.31 N ATOM 533 CA GLN * 69 -8.382 65.108 64.484 1.00 18.71 C ATOM 534 C GLN * 69 -8.092 65.496 65.921 1.00 19.41 C ATOM 535 O GLN * 69 -8.758 66.374 66.492 1.00 20.31 O ATOM 536 CB GLN * 69 -7.262 65.728 63.632 1.00 18.05 C ATOM 537 CG GLN * 69 -7.384 67.238 63.727 1.00 17.71 C ATOM 538 CD GLN * 69 -6.562 67.948 62.667 1.00 17.32 C ATOM 539 OE1 GLN * 69 -5.431 68.339 63.020 1.00 17.17 O ATOM 540 NE2 GLN * 69 -7.174 68.044 61.506 1.00 16.50 N ATOM 541 N TYR * 70 -7.064 64.845 66.416 1.00 19.72 N ATOM 542 CA TYR * 70 -6.517 65.042 67.751 1.00 19.44 C ATOM 543 C TYR * 70 -6.041 66.482 67.944 1.00 18.64 C ATOM 544 O TYR * 70 -5.188 66.942 67.182 1.00 18.51 O ATOM 545 CB TYR * 70 -5.270 64.127 67.892 1.00 20.44 C ATOM 546 CG TYR * 70 -4.788 64.211 69.321 1.00 21.93 C ATOM 547 CD1 TYR * 70 -5.361 63.426 70.327 1.00 22.45 C ATOM 548 CD2 TYR * 70 -3.767 65.086 69.665 1.00 22.78 C ATOM 549 CE1 TYR * 70 -4.945 63.509 71.641 1.00 22.91 C ATOM 550 CE2 TYR * 70 -3.342 65.186 71.001 1.00 23.34 C ATOM 551 CZ TYR * 70 -3.938 64.410 71.973 1.00 23.28 C ATOM 552 OH TYR * 70 -3.469 64.537 73.246 1.00 23.43 O ATOM 553 N VAL * 71 -6.539 67.178 68.930 1.00 18.04 N ATOM 554 CA VAL * 71 -6.111 68.572 69.221 1.00 17.59 C ATOM 555 C VAL * 71 -5.155 68.589 70.410 1.00 17.79 C ATOM 556 O VAL * 71 -5.596 68.143 71.484 1.00 18.19 O ATOM 557 CB VAL * 71 -7.394 69.395 69.443 1.00 16.88 C ATOM 558 CG1 VAL * 71 -7.078 70.835 69.634 1.00 16.37 C ATOM 559 CG2 VAL * 71 -8.366 69.079 68.325 1.00 16.69 C ATOM 560 N ASP * 72 -3.935 69.049 70.262 1.00 17.87 N ATOM 561 CA ASP * 72 -2.885 69.108 71.255 1.00 17.94 C ATOM 562 C ASP * 72 -3.120 70.125 72.352 1.00 18.41 C ATOM 563 O ASP * 72 -2.759 71.281 72.189 1.00 18.38 O ATOM 564 CB ASP * 72 -1.498 69.311 70.639 1.00 17.95 C ATOM 565 CG ASP * 72 -.372 69.559 71.629 1.00 17.75 C ATOM 566 OD1 ASP * 72 -.099 70.637 72.127 1.00 17.75 O ATOM 567 OD2 ASP * 72 .349 68.604 71.939 1.00 17.84 O ATOM 568 N GLU * 73 -3.661 69.631 73.478 1.00 19.26 N ATOM 569 CA GLU * 73 -3.954 70.480 74.645 1.00 18.92 C ATOM 570 C GLU * 73 -2.853 70.646 75.674 1.00 18.74 C ATOM 571 O GLU * 73 -3.035 71.473 76.571 1.00 18.52 O ATOM 572 CB GLU * 73 -5.218 70.072 75.345 1.00 18.67 C ATOM 573 CG GLU * 73 -6.425 70.770 74.698 1.00 18.59 C ATOM 574 CD GLU * 73 -7.673 70.001 74.936 1.00 18.87 C ATOM 575 OE1 GLU * 73 -7.668 68.816 75.226 1.00 19.69 O ATOM 576 OE2 GLU * 73 -8.672 70.678 74.785 1.00 19.02 O ATOM 577 N GLN * 74 -1.740 69.972 75.499 1.00 18.60 N ATOM 578 CA GLN * 74 -.582 70.037 76.335 1.00 18.48 C ATOM 579 C GLN * 74 -.126 71.400 76.780 1.00 17.87 C ATOM 580 O GLN * 74 .120 71.528 77.994 1.00 18.49 O ATOM 581 CB GLN * 74 .638 69.321 75.686 1.00 19.40 C ATOM 582 CG GLN * 74 .712 67.935 76.312 1.00 20.69 C ATOM 583 CD GLN * 74 1.525 67.869 77.560 1.00 21.75 C ATOM 584 OE1 GLN * 74 1.970 66.766 77.953 1.00 23.06 O ATOM 585 NE2 GLN * 74 1.775 68.962 78.274 1.00 22.18 N ATOM 586 N PHE * 75 .026 72.375 75.956 1.00 17.15 N ATOM 587 CA PHE * 75 .498 73.742 76.367 1.00 15.89 C ATOM 588 C PHE * 75 -.521 74.778 75.991 1.00 15.08 C ATOM 589 O PHE * 75 -.324 75.694 75.174 1.00 15.49 O ATOM 590 CB PHE * 75 1.905 73.871 75.777 1.00 15.81 C ATOM 591 CG PHE * 75 2.836 72.738 76.154 1.00 15.65 C ATOM 592 CD1 PHE * 75 3.161 71.764 75.239 1.00 15.78 C ATOM 593 CD2 PHE * 75 3.402 72.672 77.423 1.00 15.87 C ATOM 594 CE1 PHE * 75 4.040 70.730 75.520 1.00 16.00 C ATOM 595 CE2 PHE * 75 4.264 71.628 77.790 1.00 15.99 C ATOM 596 CZ PHE * 75 4.586 70.647 76.817 1.00 16.06 C ATOM 597 N PRO * 76 -1.708 74.662 76.598 1.00 14.25 N ATOM 598 CA PRO * 76 -2.834 75.592 76.307 1.00 13.00 C ATOM 599 C PRO * 76 -2.332 76.989 76.220 1.00 12.28 C ATOM 600 O PRO * 76 -1.701 77.405 77.229 1.00 13.01 O ATOM 601 CB PRO * 76 -3.829 75.341 77.406 1.00 12.52 C ATOM 602 CG PRO * 76 -3.587 73.918 77.789 1.00 13.48 C ATOM 603 CD PRO * 76 -2.083 73.640 77.597 1.00 13.71 C ATOM 604 N GLY * 77 -2.551 77.680 75.143 1.00 11.44 N ATOM 605 CA GLY * 77 -2.119 79.063 74.889 1.00 9.84 C ATOM 606 C GLY * 77 -.738 79.120 74.282 1.00 8.73 C ATOM 607 O GLY * 77 -.325 80.034 73.547 1.00 9.05 O ATOM 608 N PHE * 78 .096 78.135 74.547 1.00 7.52 N ATOM 609 CA PHE * 78 1.458 78.154 73.949 1.00 6.62 C ATOM 610 C PHE * 78 1.365 78.100 72.429 1.00 7.66 C ATOM 611 O PHE * 78 .841 77.052 71.888 1.00 8.04 O ATOM 612 CB PHE * 78 2.168 76.929 74.448 1.00 4.95 C ATOM 613 CG PHE * 78 3.604 76.952 74.184 1.00 3.89 C ATOM 614 CD1 PHE * 78 4.308 78.160 74.367 1.00 3.37 C ATOM 615 CD2 PHE * 78 4.262 75.790 73.817 1.00 3.58 C ATOM 616 CE1 PHE * 78 5.687 78.201 74.139 1.00 2.90 C ATOM 617 CE2 PHE * 78 5.670 75.829 73.631 1.00 3.29 C ATOM 618 CZ PHE * 78 6.350 77.038 73.804 1.00 2.80 C ATOM 619 N SER * 79 1.824 79.108 71.730 1.00 8.08 N ATOM 620 CA SER * 79 1.766 79.070 70.263 1.00 8.98 C ATOM 621 C SER * 79 2.670 77.933 69.776 1.00 9.37 C ATOM 622 O SER * 79 2.208 77.289 68.818 1.00 10.14 O ATOM 623 CB SER * 79 2.256 80.364 69.586 1.00 8.90 C ATOM 624 OG SER * 79 3.502 80.527 70.290 1.00 10.54 O ATOM 625 N GLY * 80 3.836 77.722 70.297 1.00 9.51 N ATOM 626 CA GLY * 80 4.707 76.633 69.830 1.00 10.51 C ATOM 627 C GLY * 80 3.942 75.337 69.570 1.00 11.42 C ATOM 628 O GLY * 80 4.327 74.531 68.673 1.00 11.58 O ATOM 629 N SER * 81 2.885 75.069 70.301 1.00 11.89 N ATOM 630 CA SER * 81 2.065 73.877 70.189 1.00 12.94 C ATOM 631 C SER * 81 .737 74.140 69.487 1.00 14.14 C ATOM 632 O SER * 81 .078 73.293 68.848 1.00 14.14 O ATOM 633 CB SER * 81 1.834 73.258 71.601 1.00 12.30 C ATOM 634 OG SER * 81 .714 73.962 72.207 1.00 11.53 O ATOM 635 N GLU * 82 .228 75.346 69.649 1.00 15.91 N ATOM 636 CA GLU * 82 -1.071 75.672 69.017 1.00 17.40 C ATOM 637 C GLU * 82 -.881 75.920 67.537 1.00 16.68 C ATOM 638 O GLU * 82 -1.771 75.613 66.684 1.00 16.53 O ATOM 639 CB GLU * 82 -1.790 76.768 69.756 1.00 19.34 C ATOM 640 CG GLU * 82 -2.774 76.154 70.818 1.00 22.47 C ATOM 641 CD GLU * 82 -2.632 76.920 72.100 1.00 25.22 C ATOM 642 OE1 GLU * 82 -3.511 77.082 72.943 1.00 26.95 O ATOM 643 OE2 GLU * 82 -1.476 77.453 72.287 1.00 26.41 O ATOM 644 N MET * 83 .296 76.448 67.207 1.00 15.52 N ATOM 645 CA MET * 83 .600 76.736 65.816 1.00 14.71 C ATOM 646 C MET * 83 .305 75.535 64.895 1.00 14.77 C ATOM 647 O MET * 83 .174 75.817 63.691 1.00 15.00 O ATOM 648 CB MET * 83 2.004 77.178 65.555 1.00 13.78 C ATOM 649 CG MET * 83 2.892 75.935 65.725 1.00 13.20 C ATOM 650 SD MET * 83 4.499 76.784 65.657 1.00 12.68 S ATOM 651 CE MET * 83 4.713 76.714 63.847 1.00 12.66 C ATOM 652 N TRP * 84 .241 74.340 65.407 1.00 14.71 N ATOM 653 CA TRP * 84 -.045 73.134 64.642 1.00 14.05 C ATOM 654 C TRP * 84 -1.457 72.613 64.828 1.00 14.18 C ATOM 655 O TRP * 84 -1.701 71.556 64.145 1.00 14.38 O ATOM 656 CB TRP * 84 .940 72.030 64.998 1.00 14.17 C ATOM 657 CG TRP * 84 2.368 72.427 65.063 1.00 14.92 C ATOM 658 CD1 TRP * 84 3.159 72.622 66.177 1.00 15.09 C ATOM 659 CD2 TRP * 84 3.231 72.698 63.947 1.00 14.93 C ATOM 660 NE1 TRP * 84 4.438 72.984 65.824 1.00 14.78 N ATOM 661 CE2 TRP * 84 4.495 73.044 64.471 1.00 14.95 C ATOM 662 CE3 TRP * 84 3.013 72.711 62.578 1.00 15.01 C ATOM 663 CZ2 TRP * 84 5.573 73.362 63.646 1.00 15.30 C ATOM 664 CZ3 TRP * 84 4.068 73.051 61.771 1.00 15.30 C ATOM 665 CH2 TRP * 84 5.331 73.359 62.279 1.00 15.43 C ATOM 666 N ASN * 85 -2.331 73.214 65.624 1.00 13.94 N ATOM 667 CA ASN * 85 -3.682 72.625 65.806 1.00 13.81 C ATOM 668 C ASN * 85 -4.663 73.241 64.819 1.00 13.33 C ATOM 669 O ASN * 85 -4.469 74.377 64.366 1.00 13.57 O ATOM 670 CB ASN * 85 -4.260 72.769 67.176 1.00 15.25 C ATOM 671 CG ASN * 85 -3.765 72.157 68.428 1.00 16.00 C ATOM 672 OD1 ASN * 85 -3.845 70.983 68.720 1.00 16.08 O ATOM 673 ND2 ASN * 85 -3.212 73.070 69.277 1.00 16.77 N ATOM 674 N PRO * 86 -5.741 72.491 64.606 1.00 12.85 N ATOM 675 CA PRO * 86 -6.781 72.935 63.683 1.00 12.65 C ATOM 676 C PRO * 86 -7.097 74.378 63.991 1.00 13.43 C ATOM 677 O PRO * 86 -7.224 74.585 65.230 1.00 14.13 O ATOM 678 CB PRO * 86 -7.955 72.039 63.919 1.00 11.93 C ATOM 679 CG PRO * 86 -7.550 71.019 64.882 1.00 12.06 C ATOM 680 CD PRO * 86 -6.062 71.171 65.139 1.00 12.49 C ATOM 681 N ASN * 87 -7.187 75.243 62.985 1.00 13.74 N ATOM 682 CA ASN * 87 -7.577 76.620 63.266 1.00 14.07 C ATOM 683 C ASN * 87 -8.923 76.954 62.617 1.00 14.97 C ATOM 684 O ASN * 87 -9.274 78.166 62.729 1.00 15.65 O ATOM 685 CB ASN * 87 -6.602 77.654 62.848 1.00 14.16 C ATOM 686 CG ASN * 87 -6.270 77.444 61.386 1.00 14.46 C ATOM 687 OD1 ASN * 87 -5.496 78.286 60.926 1.00 14.52 O ATOM 688 ND2 ASN * 87 -6.811 76.369 60.838 1.00 14.61 N ATOM 689 N ARG * 88 -9.587 76.027 61.995 1.00 15.38 N ATOM 690 CA ARG * 88 -10.910 76.310 61.376 1.00 15.85 C ATOM 691 C ARG * 88 -11.756 75.184 61.954 1.00 15.97 C ATOM 692 O ARG * 88 -11.085 74.260 62.415 1.00 16.41 O ATOM 693 CB ARG * 88 -10.982 76.384 59.880 1.00 16.25 C ATOM 694 CG ARG * 88 -10.357 77.411 59.038 1.00 16.91 C ATOM 695 CD ARG * 88 -10.453 78.873 59.320 1.00 17.37 C ATOM 696 NE ARG * 88 -11.714 79.487 58.859 1.00 17.43 N ATOM 700 N GLU * 89 -13.046 75.236 61.913 1.00 16.24 N ATOM 701 CA GLU * 89 -13.883 74.182 62.522 1.00 16.30 C ATOM 702 C GLU * 89 -13.539 72.848 61.966 1.00 15.84 C ATOM 703 O GLU * 89 -13.404 72.857 60.759 1.00 16.50 O ATOM 704 CB GLU * 89 -15.362 74.494 62.325 1.00 17.11 C ATOM 705 CG GLU * 89 -16.409 73.438 62.052 1.00 17.56 C ATOM 709 N MET * 90 -13.402 71.824 62.760 1.00 15.56 N ATOM 710 CA MET * 90 -13.112 70.453 62.275 1.00 14.95 C ATOM 711 C MET * 90 -14.453 69.926 61.753 1.00 14.38 C ATOM 712 O MET * 90 -15.490 70.341 62.329 1.00 14.49 O ATOM 713 CB MET * 90 -12.654 69.520 63.404 1.00 15.10 C ATOM 714 CG MET * 90 -11.161 69.676 63.594 1.00 15.52 C ATOM 715 SD MET * 90 -10.711 68.694 65.075 1.00 15.66 S ATOM 716 CE MET * 90 -10.382 70.099 66.161 1.00 16.56 C ATOM 717 N SER * 91 -14.417 69.062 60.791 1.00 13.43 N ATOM 718 CA SER * 91 -15.664 68.478 60.231 1.00 12.20 C ATOM 719 C SER * 91 -15.270 67.284 59.400 1.00 11.86 C ATOM 720 O SER * 91 -14.160 67.302 58.872 1.00 10.73 O ATOM 721 CB SER * 91 -16.325 69.548 59.378 1.00 12.16 C ATOM 722 OG SER * 91 -17.212 68.936 58.426 1.00 12.23 O ATOM 723 N GLU * 92 -16.153 66.313 59.242 1.00 12.75 N ATOM 724 CA GLU * 92 -15.822 65.129 58.381 1.00 13.24 C ATOM 725 C GLU * 92 -15.848 65.571 56.909 1.00 13.74 C ATOM 726 O GLU * 92 -15.161 64.942 56.093 1.00 13.77 O ATOM 727 CB GLU * 92 -16.618 63.891 58.538 1.00 12.97 C ATOM 728 CG GLU * 92 -16.225 63.089 59.757 1.00 13.49 C ATOM 729 CD GLU * 92 -17.017 61.845 59.940 1.00 14.26 C ATOM 730 OE1 GLU * 92 -18.192 61.917 60.283 1.00 14.94 O ATOM 731 OE2 GLU * 92 -16.356 60.836 59.678 1.00 14.62 O ATOM 732 N ASP * 93 -16.612 66.623 56.658 1.00 13.95 N ATOM 733 CA ASP * 93 -16.651 67.253 55.343 1.00 14.22 C ATOM 734 C ASP * 93 -15.413 68.209 55.425 1.00 14.65 C ATOM 735 O ASP * 93 -15.590 69.355 55.922 1.00 14.93 O ATOM 736 CB ASP * 93 -17.898 68.008 55.073 1.00 14.62 C ATOM 737 CG ASP * 93 -17.929 68.916 53.876 1.00 15.36 C ATOM 738 OD1 ASP * 93 -19.051 69.157 53.360 1.00 15.91 O ATOM 739 OD2 ASP * 93 -16.885 69.436 53.408 1.00 15.33 O ATOM 740 N CYS * 94 -14.293 67.717 54.935 1.00 14.42 N ATOM 741 CA CYS * 94 -13.055 68.471 54.949 1.00 14.29 C ATOM 742 C CYS * 94 -12.140 68.316 53.768 1.00 14.40 C ATOM 743 O CYS * 94 -10.998 68.852 53.913 1.00 14.93 O ATOM 744 CB CYS * 94 -12.160 67.975 56.123 1.00 14.43 C ATOM 745 SG CYS * 94 -11.655 66.203 55.967 1.00 13.59 S ATOM 746 N LEU * 95 -12.499 67.625 52.730 1.00 14.28 N ATOM 747 CA LEU * 95 -11.551 67.436 51.568 1.00 13.53 C ATOM 748 C LEU * 95 -11.597 68.607 50.587 1.00 13.64 C ATOM 749 O LEU * 95 -12.434 68.567 49.616 1.00 14.33 O ATOM 750 CB LEU * 95 -12.002 66.098 51.012 1.00 12.42 C ATOM 751 CG LEU * 95 -11.632 64.860 51.732 1.00 11.70 C ATOM 752 CD1 LEU * 95 -12.197 63.626 51.019 1.00 11.49 C ATOM 753 CD2 LEU * 95 -10.101 64.781 51.697 1.00 11.86 C ATOM 754 N TYR * 96 -10.798 69.601 50.799 1.00 12.84 N ATOM 755 CA TYR * 96 -10.680 70.800 50.014 1.00 13.08 C ATOM 756 C TYR * 96 -9.253 71.017 49.575 1.00 13.80 C ATOM 757 O TYR * 96 -8.379 70.257 50.006 1.00 14.48 O ATOM 758 CB TYR * 96 -11.164 72.063 50.831 1.00 12.45 C ATOM 759 CG TYR * 96 -12.654 71.801 51.002 1.00 12.39 C ATOM 760 CD1 TYR * 96 -13.082 70.928 51.970 1.00 12.57 C ATOM 761 CD2 TYR * 96 -13.594 72.342 50.152 1.00 12.22 C ATOM 762 CE1 TYR * 96 -14.427 70.642 52.147 1.00 12.78 C ATOM 763 CE2 TYR * 96 -14.922 72.065 50.291 1.00 12.34 C ATOM 764 CZ TYR * 96 -15.345 71.196 51.268 1.00 12.79 C ATOM 765 OH TYR * 96 -16.704 70.908 51.401 1.00 13.44 O ATOM 766 N LEU * 97 -9.069 72.044 48.768 1.00 14.37 N ATOM 767 CA LEU * 97 -7.660 72.329 48.277 1.00 14.59 C ATOM 768 C LEU * 97 -7.593 73.838 48.202 1.00 15.00 C ATOM 769 O LEU * 97 -8.718 74.410 48.050 1.00 15.46 O ATOM 770 CB LEU * 97 -7.539 71.485 47.067 1.00 14.57 C ATOM 771 CG LEU * 97 -7.942 71.582 45.646 1.00 13.70 C ATOM 772 CD1 LEU * 97 -7.220 72.697 44.874 1.00 13.20 C ATOM 773 CD2 LEU * 97 -7.436 70.273 44.992 1.00 13.51 C ATOM 774 N ASN * 98 -6.444 74.422 48.299 1.00 15.15 N ATOM 775 CA ASN * 98 -6.282 75.885 48.269 1.00 15.87 C ATOM 776 C ASN * 98 -5.222 76.215 47.231 1.00 16.44 C ATOM 777 O ASN * 98 -4.192 75.519 47.176 1.00 17.03 O ATOM 778 CB ASN * 98 -5.890 76.418 49.665 1.00 16.24 C ATOM 779 CG ASN * 98 -6.612 75.833 50.852 1.00 16.56 C ATOM 780 OD1 ASN * 98 -7.874 75.943 50.985 1.00 16.52 O ATOM 781 ND2 ASN * 98 -5.809 75.183 51.736 1.00 16.08 N ATOM 782 N ILE * 99 -5.412 77.255 46.471 1.00 17.19 N ATOM 783 CA ILE * 99 -4.470 77.671 45.399 1.00 17.42 C ATOM 784 C ILE * 99 -4.077 79.121 45.521 1.00 17.78 C ATOM 785 O ILE * 99 -4.994 79.979 45.699 1.00 18.24 O ATOM 786 CB ILE * 99 -5.230 77.380 44.029 1.00 17.08 C ATOM 787 CG1 ILE * 99 -5.722 75.917 44.044 1.00 16.94 C ATOM 788 CG2 ILE * 99 -4.389 77.738 42.810 1.00 16.91 C ATOM 789 CD1 ILE * 99 -6.830 75.540 43.058 1.00 16.74 C ATOM 790 N TRP * 100 -2.808 79.408 45.435 1.00 17.92 N ATOM 791 CA TRP * 100 -2.358 80.816 45.548 1.00 18.78 C ATOM 792 C TRP * 100 -1.685 81.174 44.212 1.00 19.42 C ATOM 793 O TRP * 100 -.590 80.631 43.932 1.00 19.65 O ATOM 794 CB TRP * 100 -1.429 81.039 46.715 1.00 18.47 C ATOM 795 CG TRP * 100 -2.091 81.185 48.017 1.00 18.49 C ATOM 796 CD1 TRP * 100 -2.593 82.312 48.611 1.00 18.43 C ATOM 797 CD2 TRP * 100 -2.338 80.092 48.932 1.00 18.70 C ATOM 798 NE1 TRP * 100 -3.156 81.978 49.836 1.00 18.76 N ATOM 799 CE2 TRP * 100 -2.995 80.630 50.058 1.00 18.62 C ATOM 800 CE3 TRP * 100 -2.081 78.734 48.886 1.00 18.64 C ATOM 801 CZ2 TRP * 100 -3.370 79.828 51.090 1.00 18.50 C ATOM 802 CZ3 TRP * 100 -2.468 77.919 49.907 1.00 18.36 C ATOM 803 CH2 TRP * 100 -3.104 78.477 50.987 1.00 18.78 C ATOM 804 N VAL * 101 -2.331 82.062 43.487 1.00 19.76 N ATOM 805 CA VAL * 101 -1.848 82.467 42.164 1.00 19.79 C ATOM 806 C VAL * 101 -1.249 83.857 42.073 1.00 19.54 C ATOM 807 O VAL * 101 -1.862 84.836 42.558 1.00 19.88 O ATOM 808 CB VAL * 101 -3.031 82.344 41.145 1.00 19.98 C ATOM 809 CG1 VAL * 101 -2.477 82.431 39.732 1.00 20.25 C ATOM 810 CG2 VAL * 101 -3.903 81.126 41.330 1.00 19.92 C ATOM 811 N PRO * 102 -.090 83.905 41.446 1.00 19.05 N ATOM 812 CA PRO * 102 .595 85.181 41.223 1.00 19.48 C ATOM 813 C PRO * 102 -.398 86.123 40.566 1.00 20.52 C ATOM 814 O PRO * 102 -1.449 85.665 40.057 1.00 20.72 O ATOM 815 CB PRO * 102 1.719 84.801 40.274 1.00 18.75 C ATOM 816 CG PRO * 102 2.031 83.397 40.645 1.00 18.80 C ATOM 817 CD PRO * 102 .638 82.773 40.875 1.00 18.89 C ATOM 818 N SER * 103 -.131 87.406 40.565 1.00 22.08 N ATOM 819 CA SER * 103 -1.110 88.331 39.885 1.00 23.98 C ATOM 820 C SER * 103 -.257 89.409 39.204 1.00 24.98 C ATOM 821 O SER * 103 .554 90.058 39.865 1.00 25.50 O ATOM 822 CB SER * 103 -2.182 88.832 40.778 1.00 24.09 C ATOM 823 OG SER * 103 -2.424 90.186 40.437 1.00 25.09 O ATOM 824 N PRO * 104 -.412 89.603 37.903 1.00 25.58 1 N ATOM 825 CA PRO * 104 -1.361 88.921 37.026 1.00 25.33 1 C ATOM 826 C PRO * 104 -1.078 87.438 36.891 1.00 25.14 1 C ATOM 827 O PRO * 104 .097 87.032 36.944 1.00 24.81 1 O ATOM 828 CB PRO * 104 -1.145 89.656 35.696 1.00 25.53 1 C ATOM 829 CG PRO * 104 .334 90.040 35.751 1.00 25.22 1 C ATOM 830 CD PRO * 104 .410 90.609 37.180 1.00 25.36 1 C ATOM 831 N ARG * 105 -2.182 86.746 36.711 1.00 25.23 N ATOM 832 CA ARG * 105 -2.262 85.277 36.534 1.00 25.25 C ATOM 833 C ARG * 105 -1.287 84.825 35.468 1.00 24.86 C ATOM 834 O ARG * 105 -1.340 85.428 34.384 1.00 25.63 O ATOM 835 CB ARG * 105 -3.662 84.826 36.081 1.00 25.06 C ATOM 836 CG ARG * 105 -3.841 83.505 35.453 1.00 24.96 C ATOM 837 CD ARG * 105 -5.094 82.788 35.704 1.00 25.17 C ATOM 838 NE ARG * 105 -6.303 83.569 35.875 1.00 25.36 N ATOM 839 CZ ARG * 105 -7.441 83.261 35.213 1.00 25.66 C ATOM 840 NH1 ARG * 105 -7.566 82.216 34.377 1.00 25.24 N ATOM 841 NH2 ARG * 105 -8.501 84.085 35.355 1.00 25.83 N ATOM 842 N PRO * 106 -.500 83.840 35.809 1.00 24.43 N ATOM 843 CA PRO * 106 .503 83.320 34.837 1.00 24.10 C ATOM 844 C PRO * 106 -.176 82.588 33.698 1.00 23.97 C ATOM 845 O PRO * 106 -1.448 82.490 33.690 1.00 23.70 O ATOM 846 CB PRO * 106 1.412 82.469 35.734 1.00 23.81 C ATOM 847 CG PRO * 106 .826 82.350 37.055 1.00 23.58 C ATOM 848 CD PRO * 106 -.476 83.145 37.100 1.00 23.86 C ATOM 849 N LYS * 107 .600 82.066 32.742 1.00 23.89 N ATOM 850 CA LYS * 107 -.038 81.306 31.623 1.00 24.28 C ATOM 851 C LYS * 107 .274 79.825 31.730 1.00 23.87 C ATOM 852 O LYS * 107 -.572 78.936 31.472 1.00 23.53 O ATOM 853 CB LYS * 107 .150 81.914 30.242 1.00 24.66 C ATOM 854 CG LYS * 107 -1.060 82.838 29.930 1.00 25.31 C ATOM 855 CD LYS * 107 -.595 84.187 29.361 1.00 25.77 C ATOM 856 CE LYS * 107 -1.741 85.190 29.329 1.00 26.25 C ATOM 857 NZ LYS * 107 -2.557 85.146 30.604 1.00 26.42 N ATOM 858 N SER * 108 1.480 79.525 32.139 1.00 23.74 N ATOM 859 CA SER * 108 1.937 78.125 32.353 1.00 23.50 C ATOM 860 C SER * 108 3.135 78.313 33.280 1.00 22.89 C ATOM 861 O SER * 108 4.167 78.702 32.721 1.00 24.00 O ATOM 862 CB SER * 108 2.253 77.320 31.149 1.00 23.92 C ATOM 863 OG SER * 108 1.042 76.559 30.771 1.00 25.28 O ATOM 864 N THR * 109 2.929 78.118 34.552 1.00 21.51 N ATOM 865 CA THR * 109 3.987 78.313 35.555 1.00 19.95 C ATOM 866 C THR * 109 4.081 77.163 36.505 1.00 19.16 C ATOM 867 O THR * 109 3.021 76.488 36.688 1.00 19.33 O ATOM 868 CB THR * 109 3.713 79.709 36.240 1.00 19.82 C ATOM 869 OG1 THR * 109 4.939 79.912 37.021 1.00 20.23 O ATOM 870 CG2 THR * 109 2.440 79.819 37.031 1.00 19.41 C ATOM 871 N THR * 110 5.254 76.910 37.089 1.00 18.07 N ATOM 872 CA THR * 110 5.416 75.757 37.984 1.00 17.41 C ATOM 873 C THR * 110 4.380 75.651 39.070 1.00 16.38 C ATOM 874 O THR * 110 4.117 76.692 39.713 1.00 17.09 O ATOM 875 CB THR * 110 6.799 75.674 38.697 1.00 18.24 C ATOM 876 OG1 THR * 110 7.800 76.429 37.964 1.00 19.25 O ATOM 877 CG2 THR * 110 7.308 74.215 38.830 1.00 18.84 C ATOM 878 N VAL * 111 3.837 74.492 39.306 1.00 14.93 N ATOM 879 CA VAL * 111 2.867 74.265 40.400 1.00 13.75 C ATOM 880 C VAL * 111 3.542 73.539 41.575 1.00 12.90 C ATOM 881 O VAL * 111 4.324 72.622 41.254 1.00 12.85 O ATOM 882 CB VAL * 111 1.650 73.465 39.930 1.00 13.33 C ATOM 883 CG1 VAL * 111 .534 73.481 40.964 1.00 13.14 C ATOM 884 CG2 VAL * 111 1.139 73.996 38.615 1.00 13.54 C ATOM 885 N MET * 112 3.250 73.915 42.795 1.00 12.08 N ATOM 886 CA MET * 112 3.789 73.245 44.027 1.00 11.32 C ATOM 887 C MET * 112 2.590 72.768 44.834 1.00 11.24 C ATOM 888 O MET * 112 1.653 73.616 45.069 1.00 12.11 O ATOM 889 CB MET * 112 4.740 74.108 44.833 1.00 10.63 C ATOM 890 CG MET * 112 5.961 74.424 44.008 1.00 10.26 C ATOM 891 SD MET * 112 7.246 75.353 44.890 1.00 9.58 S ATOM 892 CE MET * 112 8.076 73.992 45.732 1.00 9.23 C ATOM 893 N VAL * 113 2.529 71.534 45.191 1.00 10.99 N ATOM 894 CA VAL * 113 1.423 70.953 45.974 1.00 11.58 C ATOM 895 C VAL * 113 1.969 70.578 47.364 1.00 12.18 C ATOM 896 O VAL * 113 2.756 69.615 47.538 1.00 12.59 O ATOM 897 CB VAL * 113 .732 69.769 45.307 1.00 11.69 C ATOM 898 CG1 VAL * 113 -.550 69.265 45.968 1.00 11.02 C ATOM 899 CG2 VAL * 113 .397 70.140 43.831 1.00 12.52 C ATOM 900 N TRP * 114 1.521 71.352 48.352 1.00 11.76 N ATOM 901 CA TRP * 114 2.029 71.028 49.705 1.00 11.45 C ATOM 902 C TRP * 114 1.197 69.925 50.284 1.00 11.28 C ATOM 903 O TRP * 114 -.032 70.068 50.158 1.00 11.78 O ATOM 904 CB TRP * 114 2.000 72.331 50.520 1.00 11.67 C ATOM 905 CG TRP * 114 2.155 72.122 51.995 1.00 11.62 C ATOM 906 CD1 TRP * 114 1.205 72.151 52.992 1.00 11.40 C ATOM 907 CD2 TRP * 114 3.416 71.818 52.633 1.00 11.27 C ATOM 908 NE1 TRP * 114 1.796 71.889 54.205 1.00 11.33 N ATOM 909 CE2 TRP * 114 3.141 71.673 54.011 1.00 11.26 C ATOM 910 CE3 TRP * 114 4.699 71.669 52.141 1.00 10.91 C ATOM 911 CZ2 TRP * 114 4.131 71.406 54.913 1.00 11.34 C ATOM 912 CZ3 TRP * 114 5.694 71.408 53.037 1.00 11.49 C ATOM 913 CH2 TRP * 114 5.431 71.266 54.412 1.00 11.71 C ATOM 914 N ILE * 115 1.769 68.936 50.879 1.00 11.33 N ATOM 915 CA ILE * 115 1.146 67.812 51.592 1.00 11.16 C ATOM 916 C ILE * 115 1.640 67.806 53.062 1.00 11.18 C ATOM 917 O ILE * 115 2.843 67.460 53.330 1.00 11.71 O ATOM 918 CB ILE * 115 1.449 66.446 50.934 1.00 11.31 C ATOM 919 CG1 ILE * 115 1.182 66.484 49.409 1.00 11.53 C ATOM 920 CG2 ILE * 115 .625 65.357 51.699 1.00 11.35 C ATOM 921 CD1 ILE * 115 1.208 65.106 48.671 1.00 11.05 C ATOM 922 N TYR * 116 .797 68.178 54.004 1.00 10.41 N ATOM 923 CA TYR * 116 1.062 68.306 55.424 1.00 9.30 C ATOM 924 C TYR * 116 1.360 67.058 56.216 1.00 9.70 C ATOM 925 O TYR * 116 .901 65.948 55.877 1.00 10.29 O ATOM 926 CB TYR * 116 -.084 69.062 56.169 1.00 8.26 C ATOM 927 CG TYR * 116 -1.461 68.504 56.229 1.00 7.08 C ATOM 928 CD1 TYR * 116 -1.703 67.228 56.741 1.00 6.96 C ATOM 929 CD2 TYR * 116 -2.564 69.214 55.771 1.00 6.39 C ATOM 930 CE1 TYR * 116 -2.978 66.666 56.834 1.00 6.60 C ATOM 931 CE2 TYR * 116 -3.846 68.680 55.810 1.00 6.03 C ATOM 932 CZ TYR * 116 -4.060 67.433 56.337 1.00 6.42 C ATOM 933 OH TYR * 116 -5.334 66.910 56.402 1.00 6.16 O ATOM 934 N GLY * 117 2.109 67.275 57.303 1.00 9.63 N ATOM 935 CA GLY * 117 2.440 66.153 58.219 1.00 9.76 C ATOM 936 C GLY * 117 1.422 66.224 59.382 1.00 9.59 C ATOM 937 O GLY * 117 .518 67.077 59.334 1.00 9.25 O ATOM 938 N GLY * 118 1.651 65.376 60.378 1.00 9.43 N ATOM 939 CA GLY * 118 .831 65.248 61.600 1.00 8.26 C ATOM 940 C GLY * 118 .793 63.781 61.986 1.00 8.34 C ATOM 941 O GLY * 118 -.225 63.222 62.484 1.00 9.19 O ATOM 942 N GLY * 119 1.866 63.081 61.713 1.00 7.74 N ATOM 943 CA GLY * 119 2.004 61.670 62.003 1.00 7.99 C ATOM 944 C GLY * 119 .816 60.901 61.508 1.00 8.67 C ATOM 945 O GLY * 119 .643 59.738 61.964 1.00 9.72 O ATOM 946 N PHE * 120 .009 61.399 60.637 1.00 9.01 N ATOM 947 CA PHE * 120 -1.159 60.775 60.039 1.00 9.94 C ATOM 948 C PHE * 120 -2.453 60.804 60.868 1.00 10.53 C ATOM 949 O PHE * 120 -3.443 60.288 60.330 1.00 10.38 O ATOM 950 CB PHE * 120 -.972 59.317 59.557 1.00 9.74 C ATOM 951 CG PHE * 120 -.078 59.137 58.357 1.00 9.66 C ATOM 952 CD1 PHE * 120 -.491 59.598 57.103 1.00 9.99 C ATOM 953 CD2 PHE * 120 1.147 58.518 58.460 1.00 9.20 C ATOM 954 CE1 PHE * 120 .313 59.448 55.990 1.00 10.02 C ATOM 955 CE2 PHE * 120 1.997 58.396 57.360 1.00 9.16 C ATOM 956 CZ PHE * 120 1.582 58.858 56.133 1.00 9.41 C ATOM 957 N TYR * 121 -2.454 61.347 62.068 1.00 10.89 N ATOM 958 CA TYR * 121 -3.595 61.426 62.972 1.00 10.06 C ATOM 959 C TYR * 121 -3.987 62.900 63.098 1.00 10.12 C ATOM 960 O TYR * 121 -5.008 63.171 63.742 1.00 9.64 O ATOM 961 CB TYR * 121 -3.261 60.861 64.406 1.00 10.04 C ATOM 962 CG TYR * 121 -2.189 61.729 65.091 1.00 9.71 C ATOM 963 CD1 TYR * 121 -2.530 62.898 65.763 1.00 9.45 C ATOM 964 CD2 TYR * 121 -.848 61.418 64.974 1.00 9.75 C ATOM 965 CE1 TYR * 121 -1.588 63.718 66.314 1.00 9.38 C ATOM 966 CE2 TYR * 121 .148 62.213 65.521 1.00 10.04 C ATOM 967 CZ TYR * 121 -.260 63.368 66.205 1.00 10.10 C ATOM 968 OH TYR * 121 .755 64.172 66.713 1.00 10.90 O ATOM 969 N SER * 122 -3.139 63.768 62.542 1.00 10.08 N ATOM 970 CA SER * 122 -3.418 65.217 62.604 1.00 11.00 C ATOM 971 C SER * 122 -2.983 65.869 61.299 1.00 12.06 C ATOM 972 O SER * 122 -2.394 65.161 60.465 1.00 13.16 O ATOM 973 CB SER * 122 -2.722 65.887 63.779 1.00 10.90 C ATOM 974 OG SER * 122 -1.307 65.889 63.623 1.00 10.67 O ATOM 975 N GLY * 123 -3.187 67.145 61.113 1.00 12.71 N ATOM 976 CA GLY * 123 -2.859 67.938 59.960 1.00 13.06 C ATOM 977 C GLY * 123 -4.053 68.830 59.562 1.00 13.95 C ATOM 978 O GLY * 123 -5.264 68.582 59.706 1.00 13.64 O ATOM 979 N SER * 124 -3.644 69.955 58.992 1.00 14.77 N ATOM 980 CA SER * 124 -4.496 71.043 58.507 1.00 14.96 C ATOM 981 C SER * 124 -3.784 71.752 57.382 1.00 15.34 C ATOM 982 O SER * 124 -2.576 71.962 57.454 1.00 15.56 O ATOM 983 CB SER * 124 -4.767 71.942 59.706 1.00 15.12 C ATOM 984 OG SER * 124 -6.071 71.762 60.192 1.00 14.71 O ATOM 985 N SER * 125 -4.509 72.054 56.320 1.00 16.27 N ATOM 986 CA SER * 125 -3.906 72.737 55.152 1.00 16.77 C ATOM 987 C SER * 125 -4.091 74.261 55.347 1.00 17.14 C ATOM 988 O SER * 125 -3.555 74.976 54.493 1.00 17.86 O ATOM 989 CB SER * 125 -4.566 72.361 53.849 1.00 16.76 C ATOM 990 OG SER * 125 -5.673 73.212 53.553 1.00 16.93 O ATOM 991 N THR * 126 -4.806 74.624 56.392 1.00 16.46 N ATOM 992 CA THR * 126 -5.105 75.992 56.708 1.00 16.00 C ATOM 993 C THR * 126 -4.251 76.667 57.734 1.00 15.96 C ATOM 994 O THR * 126 -4.531 77.854 58.109 1.00 16.20 O ATOM 995 CB THR * 126 -6.643 76.021 57.180 1.00 15.89 C ATOM 996 OG1 THR * 126 -6.692 75.384 58.478 1.00 15.75 O ATOM 997 CG2 THR * 126 -7.548 75.334 56.177 1.00 15.58 C ATOM 998 N LEU * 127 -3.241 76.022 58.271 1.00 15.77 N ATOM 999 CA LEU * 127 -2.391 76.659 59.305 1.00 15.58 C ATOM 1000 C LEU * 127 -1.651 77.888 58.786 1.00 16.03 C ATOM 1001 O LEU * 127 -1.158 77.887 57.645 1.00 16.89 O ATOM 1002 CB LEU * 127 -1.381 75.633 59.815 1.00 14.57 C ATOM 1003 CG LEU * 127 -1.773 74.239 60.196 1.00 13.63 C ATOM 1004 CD1 LEU * 127 -.551 73.548 60.808 1.00 13.41 C ATOM 1005 CD2 LEU * 127 -2.952 74.256 61.104 1.00 13.12 C ATOM 1006 N ASP * 128 -1.452 78.880 59.617 1.00 16.31 N ATOM 1007 CA ASP * 128 -.724 80.088 59.286 1.00 16.42 C ATOM 1008 C ASP * 128 .636 79.820 58.620 1.00 16.39 C ATOM 1009 O ASP * 128 .919 80.538 57.648 1.00 16.50 O ATOM 1010 CB ASP * 128 -.552 80.963 60.497 1.00 17.27 C ATOM 1011 CG ASP * 128 -1.793 81.645 61.009 1.00 18.71 C ATOM 1012 OD1 ASP * 128 -2.859 81.602 60.366 1.00 18.65 O ATOM 1013 OD2 ASP * 128 -1.630 82.267 62.143 1.00 19.86 O ATOM 1014 N VAL * 129 1.455 78.914 59.077 1.00 16.60 N ATOM 1015 CA VAL * 129 2.777 78.615 58.586 1.00 16.23 C ATOM 1016 C VAL * 129 2.706 77.883 57.250 1.00 16.70 C ATOM 1017 O VAL * 129 3.843 77.660 56.789 1.00 17.49 O ATOM 1018 CB VAL * 129 3.728 77.681 59.426 1.00 15.40 C ATOM 1019 CG1 VAL * 129 4.707 78.451 60.301 1.00 15.05 C ATOM 1020 CG2 VAL * 129 2.955 76.617 60.100 1.00 14.77 C ATOM 1021 N TYR * 130 1.511 77.535 56.854 1.00 16.34 N ATOM 1022 CA TYR * 130 1.407 76.830 55.542 1.00 15.89 C ATOM 1023 C TYR * 130 .802 77.838 54.554 1.00 17.00 C ATOM 1024 O TYR * 130 .350 77.469 53.455 1.00 17.69 O ATOM 1025 CB TYR * 130 .510 75.618 55.720 1.00 14.07 C ATOM 1026 CG TYR * 130 .991 74.462 56.546 1.00 12.75 C ATOM 1027 CD1 TYR * 130 2.350 74.190 56.818 1.00 11.53 C ATOM 1028 CD2 TYR * 130 .017 73.565 57.068 1.00 11.86 C ATOM 1029 CE1 TYR * 130 2.711 73.081 57.559 1.00 10.80 C ATOM 1030 CE2 TYR * 130 .395 72.459 57.820 1.00 10.90 C ATOM 1031 CZ TYR * 130 1.734 72.209 58.067 1.00 10.64 C ATOM 1032 OH TYR * 130 2.043 71.081 58.798 1.00 9.56 O ATOM 1033 N ASN * 131 .728 79.099 54.953 1.00 17.73 N ATOM 1034 CA ASN * 131 .105 80.122 54.102 1.00 18.68 C ATOM 1035 C ASN * 131 .932 80.361 52.855 1.00 19.55 C ATOM 1036 O ASN * 131 1.991 81.010 52.856 1.00 20.16 O ATOM 1037 CB ASN * 131 -.263 81.341 54.906 1.00 18.67 C ATOM 1038 CG ASN * 131 -.900 82.385 53.972 1.00 18.31 C ATOM 1039 OD1 ASN * 131 -.266 82.878 53.068 1.00 18.53 O ATOM 1040 ND2 ASN * 131 -2.133 82.658 54.222 1.00 18.45 N ATOM 1041 N GLY * 132 .371 79.848 51.764 1.00 20.13 N ATOM 1042 CA GLY * 132 .967 79.853 50.454 1.00 20.50 C ATOM 1043 C GLY * 132 1.358 81.078 49.719 1.00 20.51 C ATOM 1044 O GLY * 132 2.093 80.971 48.683 1.00 20.44 O ATOM 1045 N LYS * 133 .913 82.239 50.190 1.00 20.27 N ATOM 1046 CA LYS * 133 1.206 83.506 49.545 1.00 20.02 C ATOM 1047 C LYS * 133 2.608 84.011 49.525 1.00 20.49 C ATOM 1048 O LYS * 133 2.950 84.604 48.441 1.00 21.14 O ATOM 1049 CB LYS * 133 .268 84.555 50.008 1.00 19.93 C ATOM 1050 CG LYS * 133 .456 85.286 51.311 1.00 20.19 C ATOM 1051 CD LYS * 133 -.944 85.706 51.750 1.00 20.60 C ATOM 1052 CE LYS * 133 -.981 86.837 52.738 1.00 21.00 C ATOM 1053 NZ LYS * 133 .354 87.459 52.734 1.00 21.44 N ATOM 1054 N TYR * 134 3.478 83.889 50.473 1.00 21.06 N ATOM 1055 CA TYR * 134 4.838 84.490 50.298 1.00 21.48 C ATOM 1056 C TYR * 134 5.585 83.736 49.230 1.00 21.21 C ATOM 1057 O TYR * 134 6.435 84.263 48.494 1.00 20.83 O ATOM 1058 CB TYR * 134 5.506 84.650 51.671 1.00 22.63 C ATOM 1059 CG TYR * 134 4.609 85.229 52.746 1.00 23.78 C ATOM 1060 CD1 TYR * 134 4.689 86.551 53.183 1.00 24.44 C ATOM 1061 CD2 TYR * 134 3.609 84.441 53.311 1.00 24.30 C ATOM 1062 CE1 TYR * 134 3.828 87.060 54.167 1.00 24.75 C ATOM 1063 CE2 TYR * 134 2.735 84.911 54.268 1.00 24.89 C ATOM 1064 CZ TYR * 134 2.875 86.232 54.700 1.00 25.24 C ATOM 1065 OH TYR * 134 1.986 86.636 55.682 1.00 26.42 O ATOM 1066 N LEU * 135 5.279 82.462 49.117 1.00 21.41 N ATOM 1067 CA LEU * 135 5.917 81.540 48.119 1.00 21.36 C ATOM 1068 C LEU * 135 5.317 81.833 46.741 1.00 21.93 C ATOM 1069 O LEU * 135 6.077 82.045 45.784 1.00 21.96 O ATOM 1070 CB LEU * 135 5.803 80.120 48.675 1.00 20.37 C ATOM 1071 CG LEU * 135 6.466 78.935 48.035 1.00 19.53 C ATOM 1072 CD1 LEU * 135 7.865 79.401 47.579 1.00 19.99 C ATOM 1073 CD2 LEU * 135 6.598 77.771 48.982 1.00 18.11 C ATOM 1074 N ALA * 136 3.987 81.878 46.644 1.00 22.47 N ATOM 1075 CA ALA * 136 3.296 82.181 45.397 1.00 23.20 C ATOM 1076 C ALA * 136 3.844 83.520 44.865 1.00 23.90 C ATOM 1077 O ALA * 136 4.213 83.677 43.678 1.00 24.48 O ATOM 1078 CB ALA * 136 1.786 82.280 45.536 1.00 22.85 C ATOM 1079 N TYR * 137 3.923 84.479 45.758 1.00 24.21 N ATOM 1080 CA TYR * 137 4.412 85.808 45.331 1.00 24.66 C ATOM 1081 C TYR * 137 5.891 85.857 45.087 1.00 24.79 C ATOM 1082 O TYR * 137 6.321 86.211 43.972 1.00 25.62 O ATOM 1083 CB TYR * 137 3.865 86.832 46.299 1.00 24.92 C ATOM 1084 CG TYR * 137 4.394 88.225 46.169 1.00 25.79 C ATOM 1085 CD1 TYR * 137 5.646 88.647 46.620 1.00 25.85 C ATOM 1086 CD2 TYR * 137 3.553 89.194 45.618 1.00 26.29 C ATOM 1087 CE1 TYR * 137 6.055 89.978 46.492 1.00 26.26 C ATOM 1088 CE2 TYR * 137 3.939 90.520 45.478 1.00 26.41 C ATOM 1089 CZ TYR * 137 5.192 90.907 45.915 1.00 26.58 C ATOM 1090 OH TYR * 137 5.480 92.236 45.740 1.00 27.11 O ATOM 1091 N THR * 138 6.750 85.562 46.019 1.00 24.70 N ATOM 1092 CA THR * 138 8.204 85.631 45.868 1.00 24.18 C ATOM 1093 C THR * 138 8.647 84.901 44.634 1.00 24.32 C ATOM 1094 O THR * 138 9.305 85.484 43.740 1.00 24.84 O ATOM 1095 CB THR * 138 8.893 85.136 47.190 1.00 24.28 C ATOM 1096 OG1 THR * 138 8.415 86.005 48.259 1.00 23.95 O ATOM 1097 CG2 THR * 138 10.424 85.068 47.192 1.00 24.58 C ATOM 1098 N GLU * 139 8.289 83.645 44.508 1.00 24.20 N ATOM 1099 CA GLU * 139 8.707 82.815 43.376 1.00 24.02 C ATOM 1100 C GLU * 139 7.819 82.686 42.190 1.00 24.05 C ATOM 1101 O GLU * 139 8.160 81.938 41.263 1.00 24.01 O ATOM 1102 CB GLU * 139 9.006 81.400 43.935 1.00 23.93 C ATOM 1103 CG GLU * 139 10.132 81.319 44.978 1.00 23.63 C ATOM 1104 CD GLU * 139 11.465 81.702 44.364 1.00 23.73 C ATOM 1105 OE1 GLU * 139 11.785 81.317 43.249 1.00 23.53 O ATOM 1106 OE2 GLU * 139 12.167 82.436 45.080 1.00 23.65 O ATOM 1107 N GLU * 140 6.711 83.354 42.099 1.00 24.72 N ATOM 1108 CA GLU * 140 5.790 83.267 40.946 1.00 25.12 C ATOM 1109 C GLU * 140 5.705 81.761 40.681 1.00 24.38 C ATOM 1110 O GLU * 140 6.413 81.218 39.828 1.00 25.16 O ATOM 1111 CB GLU * 140 6.241 83.969 39.707 1.00 26.36 C ATOM 1112 CG GLU * 140 6.032 85.485 39.554 1.00 28.29 C ATOM 1113 CD GLU * 140 7.298 86.294 39.478 1.00 29.65 C ATOM 1114 OE1 GLU * 140 8.428 85.762 39.343 1.00 30.80 O ATOM 1115 OE2 GLU * 140 7.131 87.535 39.550 1.00 29.94 O ATOM 1116 N VAL * 141 4.894 81.138 41.483 1.00 22.78 N ATOM 1117 CA VAL * 141 4.666 79.680 41.422 1.00 20.95 C ATOM 1118 C VAL * 141 3.189 79.495 41.788 1.00 20.66 C ATOM 1119 O VAL * 141 2.632 80.365 42.516 1.00 20.43 O ATOM 1120 CB VAL * 141 5.663 79.034 42.369 1.00 20.29 C ATOM 1121 CG1 VAL * 141 4.976 77.986 43.242 1.00 20.60 C ATOM 1122 CG2 VAL * 141 6.885 78.456 41.712 1.00 19.90 C ATOM 1123 N VAL * 142 2.604 78.433 41.238 1.00 19.77 N ATOM 1124 CA VAL * 142 1.174 78.212 41.641 1.00 19.15 C ATOM 1125 C VAL * 142 1.276 77.304 42.878 1.00 19.05 C ATOM 1126 O VAL * 142 1.808 76.152 42.828 1.00 19.49 O ATOM 1127 CB VAL * 142 .289 77.846 40.477 1.00 18.69 C ATOM 1128 CG1 VAL * 142 -.904 76.977 40.831 1.00 17.89 C ATOM 1129 CG2 VAL * 142 -.191 79.151 39.779 1.00 18.28 C ATOM 1130 N LEU * 143 .831 77.819 44.021 1.00 18.05 N ATOM 1131 CA LEU * 143 .956 76.926 45.218 1.00 17.68 C ATOM 1132 C LEU * 143 -.384 76.315 45.577 1.00 17.04 C ATOM 1133 O LEU * 143 -1.377 77.098 45.651 1.00 16.72 O ATOM 1134 CB LEU * 143 1.658 77.798 46.251 1.00 17.96 C ATOM 1135 CG LEU * 143 2.574 77.118 47.273 1.00 17.82 C ATOM 1136 CD1 LEU * 143 3.257 78.232 48.041 1.00 18.19 C ATOM 1137 CD2 LEU * 143 1.719 76.284 48.194 1.00 18.07 C ATOM 1138 N VAL * 144 -.424 74.982 45.727 1.00 15.91 N ATOM 1139 CA VAL * 144 -1.754 74.391 46.111 1.00 15.46 C ATOM 1140 C VAL * 144 -1.490 73.633 47.406 1.00 15.33 C ATOM 1141 O VAL * 144 -.319 73.153 47.571 1.00 16.21 O ATOM 1142 CB VAL * 144 -2.540 73.630 45.039 1.00 15.05 C ATOM 1143 CG1 VAL * 144 -1.906 73.789 43.653 1.00 15.06 C ATOM 1144 CG2 VAL * 144 -2.915 72.192 45.248 1.00 13.96 C ATOM 1145 N SER * 145 -2.482 73.592 48.259 1.00 14.24 N ATOM 1146 CA SER * 145 -2.265 72.849 49.534 1.00 14.17 C ATOM 1147 C SER * 145 -3.545 72.017 49.639 1.00 13.99 C ATOM 1148 O SER * 145 -4.626 72.623 49.714 1.00 13.82 O ATOM 1149 CB SER * 145 -1.978 73.695 50.720 1.00 14.26 C ATOM 1150 OG SER * 145 -3.066 74.526 51.046 1.00 14.82 O ATOM 1151 N LEU * 146 -3.308 70.706 49.586 1.00 13.50 N ATOM 1152 CA LEU * 146 -4.459 69.789 49.622 1.00 13.43 C ATOM 1153 C LEU * 146 -4.744 69.344 51.054 1.00 13.97 C ATOM 1154 O LEU * 146 -3.941 69.634 51.963 1.00 13.50 O ATOM 1155 CB LEU * 146 -4.129 68.728 48.576 1.00 12.78 C ATOM 1156 CG LEU * 146 -2.978 67.797 48.910 1.00 12.53 C ATOM 1157 CD1 LEU * 146 -3.498 66.902 50.067 1.00 12.66 C ATOM 1158 CD2 LEU * 146 -2.522 66.991 47.715 1.00 11.50 C ATOM 1159 N SER * 147 -5.901 68.680 51.215 1.00 14.35 N ATOM 1160 CA SER * 147 -6.292 68.158 52.509 1.00 15.22 C ATOM 1161 C SER * 147 -6.502 66.631 52.329 1.00 15.39 C ATOM 1162 O SER * 147 -6.749 66.239 51.175 1.00 16.10 O ATOM 1163 CB SER * 147 -7.499 68.697 53.179 1.00 15.92 C ATOM 1164 OG SER * 147 -8.645 68.774 52.403 1.00 17.03 O ATOM 1165 N TYR * 148 -6.377 65.960 53.450 1.00 14.76 N ATOM 1166 CA TYR * 148 -6.545 64.503 53.480 1.00 14.23 C ATOM 1167 C TYR * 148 -7.090 64.005 54.822 1.00 13.31 C ATOM 1168 O TYR * 148 -6.912 64.695 55.841 1.00 13.79 O ATOM 1169 CB TYR * 148 -5.297 63.770 53.105 1.00 14.78 C ATOM 1170 CG TYR * 148 -4.053 63.765 53.903 1.00 15.14 C ATOM 1171 CD1 TYR * 148 -3.727 62.695 54.750 1.00 15.53 C ATOM 1172 CD2 TYR * 148 -3.131 64.795 53.793 1.00 15.50 C ATOM 1173 CE1 TYR * 148 -2.550 62.653 55.483 1.00 15.62 C ATOM 1174 CE2 TYR * 148 -1.929 64.776 54.509 1.00 15.84 C ATOM 1175 CZ TYR * 148 -1.653 63.710 55.349 1.00 15.80 C ATOM 1176 OH TYR * 148 -.472 63.745 56.034 1.00 16.13 O ATOM 1177 N ARG * 149 -7.751 62.886 54.783 1.00 11.79 N ATOM 1178 CA ARG * 149 -8.319 62.294 55.999 1.00 11.14 C ATOM 1179 C ARG * 149 -7.193 61.647 56.785 1.00 11.51 C ATOM 1180 O ARG * 149 -6.481 60.753 56.294 1.00 12.34 O ATOM 1181 CB ARG * 149 -9.451 61.333 55.679 1.00 10.11 C ATOM 1182 CG ARG * 149 -10.689 62.042 55.125 1.00 9.49 C ATOM 1183 CD ARG * 149 -11.783 61.072 54.827 1.00 9.47 C ATOM 1184 NE ARG * 149 -11.583 60.354 53.568 1.00 8.99 N ATOM 1185 CZ ARG * 149 -12.068 59.225 53.119 1.00 8.32 C ATOM 1186 NH1 ARG * 149 -11.685 58.763 51.927 1.00 8.02 N ATOM 1187 NH2 ARG * 149 -12.955 58.504 53.801 1.00 7.90 N ATOM 1188 N VAL * 150 -7.018 62.097 58.008 1.00 11.61 N ATOM 1189 CA VAL * 150 -6.013 61.626 58.982 1.00 11.48 C ATOM 1190 C VAL * 150 -6.711 60.726 60.006 1.00 12.17 C ATOM 1191 O VAL * 150 -7.971 60.763 60.028 1.00 13.12 O ATOM 1192 CB VAL * 150 -5.414 62.878 59.658 1.00 10.54 C ATOM 1193 CG1 VAL * 150 -4.751 63.866 58.723 1.00 10.21 C ATOM 1194 CG2 VAL * 150 -6.485 63.584 60.458 1.00 10.00 C ATOM 1195 N GLY * 151 -6.071 59.969 60.831 1.00 12.52 N ATOM 1196 CA GLY * 151 -6.694 59.157 61.850 1.00 13.41 C ATOM 1197 C GLY * 151 -7.490 58.014 61.357 1.00 14.87 C ATOM 1198 O GLY * 151 -7.421 57.556 60.228 1.00 16.12 O ATOM 1199 N ALA * 152 -8.280 57.402 62.211 1.00 15.62 N ATOM 1200 CA ALA * 152 -9.106 56.248 61.935 1.00 15.31 C ATOM 1201 C ALA * 152 -9.818 56.490 60.609 1.00 15.19 C ATOM 1202 O ALA * 152 -9.891 55.593 59.756 1.00 15.16 O ATOM 1203 CB ALA * 152 -10.177 56.089 63.050 1.00 15.54 C ATOM 1204 N PHE * 153 -10.346 57.726 60.585 1.00 14.47 N ATOM 1205 CA PHE * 153 -11.137 58.255 59.482 1.00 13.25 C ATOM 1206 C PHE * 153 -10.479 58.097 58.125 1.00 12.71 C ATOM 1207 O PHE * 153 -11.219 57.816 57.188 1.00 12.83 O ATOM 1208 CB PHE * 153 -11.438 59.759 59.638 1.00 13.09 C ATOM 1209 CG PHE * 153 -12.289 59.964 60.861 1.00 13.18 C ATOM 1210 CD1 PHE * 153 -11.774 60.639 61.966 1.00 12.97 C ATOM 1211 CD2 PHE * 153 -13.580 59.423 60.878 1.00 13.13 C ATOM 1212 CE1 PHE * 153 -12.543 60.790 63.099 1.00 13.01 C ATOM 1213 CE2 PHE * 153 -14.351 59.588 62.011 1.00 13.52 C ATOM 1214 CZ PHE * 153 -13.818 60.272 63.123 1.00 13.39 C ATOM 1215 N GLY * 154 -9.182 58.358 58.098 1.00 11.81 N ATOM 1216 CA GLY * 154 -8.437 58.259 56.863 1.00 11.42 C ATOM 1217 C GLY * 154 -7.667 56.983 56.745 1.00 11.63 C ATOM 1218 O GLY * 154 -7.261 56.573 55.662 1.00 12.11 O ATOM 1219 N PHE * 155 -7.430 56.268 57.836 1.00 11.84 N ATOM 1220 CA PHE * 155 -6.602 55.076 57.760 1.00 11.47 C ATOM 1221 C PHE * 155 -7.097 53.851 58.405 1.00 12.15 C ATOM 1222 O PHE * 155 -6.260 52.938 58.678 1.00 12.56 O ATOM 1223 CB PHE * 155 -5.237 55.628 58.118 1.00 11.58 C ATOM 1224 CG PHE * 155 -4.622 56.713 57.269 1.00 11.72 C ATOM 1225 CD1 PHE * 155 -3.617 56.426 56.343 1.00 11.27 C ATOM 1226 CD2 PHE * 155 -4.944 58.062 57.447 1.00 12.11 C ATOM 1227 CE1 PHE * 155 -2.994 57.372 55.611 1.00 11.28 C ATOM 1228 CE2 PHE * 155 -4.315 59.085 56.708 1.00 11.92 C ATOM 1229 CZ PHE * 155 -3.329 58.732 55.793 1.00 11.81 C ATOM 1230 N LEU * 156 -8.386 53.613 58.584 1.00 13.01 N ATOM 1231 CA LEU * 156 -8.772 52.308 59.231 1.00 14.12 C ATOM 1232 C LEU * 156 -8.561 51.242 58.165 1.00 15.41 C ATOM 1233 O LEU * 156 -9.112 51.422 57.059 1.00 15.90 O ATOM 1234 CB LEU * 156 -10.176 52.407 59.759 1.00 13.88 C ATOM 1235 CG LEU * 156 -10.707 51.471 60.795 1.00 13.71 C ATOM 1236 CD1 LEU * 156 -10.987 52.236 62.105 1.00 14.26 C ATOM 1237 CD2 LEU * 156 -12.068 50.945 60.355 1.00 13.77 C ATOM 1238 N ALA * 157 -7.801 50.181 58.458 1.00 16.30 N ATOM 1239 CA ALA * 157 -7.565 49.141 57.501 1.00 16.66 C ATOM 1240 C ALA * 157 -8.168 47.779 57.754 1.00 17.76 C ATOM 1241 O ALA * 157 -7.412 46.863 58.245 1.00 18.49 O ATOM 1242 CB ALA * 157 -6.052 48.981 57.294 1.00 16.06 C ATOM 1243 N LEU * 158 -9.409 47.573 57.361 1.00 18.24 N ATOM 1244 CA LEU * 158 -10.004 46.208 57.493 1.00 19.39 C ATOM 1245 C LEU * 158 -9.839 45.658 56.054 1.00 20.18 C ATOM 1246 O LEU * 158 -10.795 45.712 55.306 1.00 20.02 O ATOM 1247 CB LEU * 158 -11.413 46.230 57.989 1.00 19.53 C ATOM 1