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Opened 6 years ago
Last modified 6 years ago
#2990 closed defect
ChimeraX bug report submission — at Initial Version
| Reported by: | Owned by: | ||
|---|---|---|---|
| Priority: | normal | Milestone: | |
| Component: | Third Party | Version: | 0.91 |
| Keywords: | Cc: | ||
| Blocked By: | Blocking: | ||
| Notify when closed: | Platform: | all | |
| Project: | ChimeraX |
Description
The following bug report has been submitted: Platform: Darwin-19.3.0-x86_64-i386-64bit ChimeraX Version: 0.91 (2019-12-23) Description (Describe the actions that caused this problem to occur here) Log: Startup Messages --- warning | 'clip' is a prefix of an existing command 'clipper' UCSF ChimeraX version: 0.91 (2019-12-23) © 2016-2019 Regents of the University of California. All rights reserved. How to cite UCSF ChimeraX > isolde tutorial > toolshed show ISOLDE > set selectionWidth 4 Done loading forcefield > isolde demo cryo_em_intro modelOnly true startIsolde false 6out.pdb title: Asymmetric focused reconstruction of human norovirus gi.1 norwalk strain VLP asymmetric unit In T=3 symmetry [more info...] Chain information for 6out.pdb #1 --- Chain | Description A B C | capsid protein VP1 Loaded cryo-EM demo: PDB ID 6out, EMDB ID 20205 > open 20205 fromDatabase emdb Summary of feedback from opening 20205 fetched from emdb --- note | Fetching compressed map 20205 from ftp://ftp.ebi.ac.uk/pub/databases/emdb/structures/EMD-20205/map/emd_20205.map.gz Opened emd_20205.map, grid size 98,112,104, pixel 1.07,1.07,1.07, shown at level 0.287, step 1, values float32 > clipper associate #2 toModel #1 6out.pdb title: Asymmetric focused reconstruction of human norovirus gi.1 norwalk strain VLP asymmetric unit In T=3 symmetry [more info...] Chain information for 6out.pdb --- Chain | Description 1.1/A 1.1/B 1.1/C | capsid protein VP1 > isolde start > set selectionWidth 4 Done loading forcefield QWidget::repaint: Recursive repaint detected > set bgColor white > clipper spotlight radius 13.00 > clipper spotlight radius 14.00 > clipper spotlight radius 15.00 > clipper spotlight radius 16.00 > clipper spotlight radius 17.00 > clipper spotlight radius 16.00 > clipper spotlight radius 15.00 > clipper spotlight radius 14.00 > clipper spotlight radius 13.00 > clipper spotlight radius 12.00 > clipper spotlight radius 11.00 > clipper spotlight radius 10.00 > clipper spotlight radius 9.00 > clipper spotlight radius 8.00 > clipper spotlight radius 9.00 > clipper spotlight radius 10.00 > clipper spotlight radius 11.00 > set bgColor white > addh Summary of feedback from adding hydrogens to 6out.pdb #1.1 --- notes | Termini for 6out.pdb (#1.1) chain A determined from SEQRES records Termini for 6out.pdb (#1.1) chain B determined from SEQRES records Termini for 6out.pdb (#1.1) chain C determined from SEQRES records Chain-initial residues that are actual N termini: /B THR 9 Chain-initial residues that are not actual N termini: /A ASP 29, /C ASP 29 Chain-final residues that are actual C termini: /A SER 520 Chain-final residues that are not actual C termini: /B ALA 519, /C ALA 519 Missing OXT added to C-terminal residue /A SER 520 1438 hydrogen bonds Adding 'H' to /A ASP 29 Adding 'H' to /C ASP 29 /B ALA 519 is not terminus, removing H atom from 'C' /C ALA 519 is not terminus, removing H atom from 'C' 11439 hydrogens added > hide HC Unknown command: isolde restain ligands #1 Unknown command: isolde restain ligands #1 > isolde restrain ligands #1 > select #1 22945 atoms, 23062 bonds, 14 models selected > transparency 50 > transparency 0 No rotamer preview selected! Ignoring command. No rotamer preview selected! Ignoring command. No rotamer preview selected! Ignoring command. No rotamer preview selected! Ignoring command. No rotamer preview selected! Ignoring command. > select clear > select clear > cview /B:375 > cview /A:375 > cview /C:375 > cview /B:383 > clipper spotlight > cview /B:383 > volume gaussian #1 bfactor 50 > clipper associate #2 toModel #1 > volume #1.2.1.1 level 1.6 > volume #1.2.1.1 style surface > volume #1.2.1.1 level 0.1698 > volume #1.2.1.1 style image > volume #1.2.1.1 maximumIntensityProjection true > volume #1.2.1.1 style surface > transparency 50 > volume #1.2.1.1 change image level -0.01372,0 level 0.2156,0.8 level > 0.4259,1 > volume #1.2.1.1 level 0.1757 > transparency 0 > transparency 50 > volume #1.2.1.2 level 0.1032 > select clear > cview /A:383 > cview /C:383 > cview /B:383 > clipper spotlight > cview /B:383 > clipper spotlight > cview /A:383 > select clear > volume #1.2.1.2 level 0.08822 > volume #1.2.1.2 level 0.07667 > select #1 22945 atoms, 23062 bonds, 22 models selected > isolde demo cryo_em_intro modelOnly true startIsolde false 6out.pdb title: Asymmetric focused reconstruction of human norovirus gi.1 norwalk strain VLP asymmetric unit In T=3 symmetry [more info...] Chain information for 6out.pdb #2 --- Chain | Description A B C | capsid protein VP1 Loaded cryo-EM demo: PDB ID 6out, EMDB ID 20205 > select #1 22945 atoms, 23062 bonds, 22 models selected > select #1 22945 atoms, 23062 bonds, 22 models selected > select #1 22945 atoms, 23062 bonds, 22 models selected > close #1 6out.pdb title: Asymmetric focused reconstruction of human norovirus gi.1 norwalk strain VLP asymmetric unit In T=3 symmetry [more info...] Chain information for 6out.pdb --- Chain | Description 1.1/A 1.1/B 1.1/C | capsid protein VP1 > isolde demo cryo_em_intro modelOnly true startIsolde false 6out.pdb title: Asymmetric focused reconstruction of human norovirus gi.1 norwalk strain VLP asymmetric unit In T=3 symmetry [more info...] Chain information for 6out.pdb #2 --- Chain | Description A B C | capsid protein VP1 Loaded cryo-EM demo: PDB ID 6out, EMDB ID 20205 > close #1 6out.pdb title: Asymmetric focused reconstruction of human norovirus gi.1 norwalk strain VLP asymmetric unit In T=3 symmetry [more info...] Chain information for 6out.pdb --- Chain | Description 1.1/A 1.1/B 1.1/C | capsid protein VP1 > close #1 > isolde demo cryo_em_intro modelOnly true startIsolde false 6out.pdb title: Asymmetric focused reconstruction of human norovirus gi.1 norwalk strain VLP asymmetric unit In T=3 symmetry [more info...] Chain information for 6out.pdb #1 --- Chain | Description A B C | capsid protein VP1 6out.pdb title: Asymmetric focused reconstruction of human norovirus gi.1 norwalk strain VLP asymmetric unit In T=3 symmetry [more info...] Chain information for 6out.pdb --- Chain | Description 1.1/A 1.1/B 1.1/C | capsid protein VP1 Loaded cryo-EM demo: PDB ID 6out, EMDB ID 20205 > close #1 > open 20205 fromDatabase emdb Opened emd_20205.map, grid size 98,112,104, pixel 1.07,1.07,1.07, shown at level 0.287, step 1, values float32 > save /Users/km503/Documents/ISOLDE-tut/tut-6out.mrc models #1 > close #1 > open "/Users/km503/Documents/VRC40/higher resolution/VRC40-trimer- > rsr40_real_space_refined-coot-0.pdb" Summary of feedback from opening /Users/km503/Documents/VRC40/higher resolution/VRC40-trimer-rsr40_real_space_refined-coot-0.pdb --- warnings | Start residue of secondary structure not found: HELIX 16 16 PHE H 29 ASP H 31 5 3 Start residue of secondary structure not found: HELIX 17 17 HIS H 62 PHE H 64 5 3 Start residue of secondary structure not found: HELIX 18 18 SER H 93 ASP H 95 5 3 Start residue of secondary structure not found: HELIX 19 19 ASN H 170 GLY H 172 5 3 Start residue of secondary structure not found: HELIX 20 20 SER H 201 SER H 203 5 3 43 messages similar to the above omitted End residue of secondary structure not found: HELIX 67 67 SER K 80 ASP K 82 5 3 Start residue of secondary structure not found: HELIX 68 68 ASP K 122 LEU K 125 1 4 Start residue of secondary structure not found: HELIX 69 69 LYS K 183 LYS K 188 1 6 Start residue of secondary structure not found: SHEET 1 K 4 GLN H 3 GLN H 6 0 Start residue of secondary structure not found: SHEET 2 K 4 VAL H 18 SER H 25 -1 N SER H 25 O GLN H 3 Start residue of secondary structure not found: SHEET 3 K 4 LEU H 81 LEU H 88 -1 N LEU H 88 O VAL H 18 2 messages similar to the above omitted End residue of secondary structure not found: SHEET 2 L 6 SER H 121 VAL H 125 1 N ILE H 124 O GLN H 10 Start residue of secondary structure not found: SHEET 3 L 6 ALA H 97 ARG H 103 -1 N TYR H 99 O SER H 121 Start residue of secondary structure not found: SHEET 4 L 6 LEU H 33 LEU H 39 -1 N LEU H 39 O ILE H 98 Start residue of secondary structure not found: SHEET 5 L 6 LEU H 45 ASN H 52 -1 N ILE H 51 O ILE H 34 Start residue of secondary structure not found: SHEET 6 L 6 MET H 58 LEU H 60 -1 N TYR H 59 O ARG H 50 Start residue of secondary structure not found: SHEET 1 M 4 SER H 135 LEU H 139 0 6 messages similar to the above omitted End residue of secondary structure not found: SHEET 1 T 2 TRP C 36 TYR C 41 0 Start residue of secondary structure not found: SHEET 2 T 2 LEU C 494 THR C 499 -1 N THR C 499 O TRP C 36 Start residue of secondary structure not found: SHEET 1 U 2 CYS C 55 SER C 57 0 Start residue of secondary structure not found: SHEET 2 U 2 ILE C 216 TYR C 218 -1 N HIS C 217 O ALA C 56 Start residue of secondary structure not found: SHEET 1 V 4 GLU C 84 HIS C 86 0 Start residue of secondary structure not found: SHEET 2 V 4 VAL C 243 VAL C 246 -1 N THR C 245 O ILE C 85 52 messages similar to the above omitted End residue of secondary structure not found: SHEET 1 AM 2 TRP G 36 TYR G 41 0 Start residue of secondary structure not found: SHEET 2 AM 2 LEU G 494 THR G 499 -1 N THR G 499 O TRP G 36 Start residue of secondary structure not found: SHEET 1 AN 2 CYS G 55 SER G 57 0 Start residue of secondary structure not found: SHEET 2 AN 2 ILE G 216 TYR G 218 -1 N HIS G 217 O ALA G 56 Start residue of secondary structure not found: SHEET 1 AO 4 GLU G 84 HIS G 86 0 Start residue of secondary structure not found: SHEET 2 AO 4 VAL G 243 VAL G 246 -1 N THR G 245 O ILE G 85 41 messages similar to the above omitted End residue of secondary structure not found: SHEET 2 BB 2 ARG K 103 MET K 106 1 N ARG K 103 O LEU K 11 Start residue of secondary structure not found: SHEET 1 BC 3 LEU K 85 GLN K 90 0 Start residue of secondary structure not found: SHEET 2 BC 3 ILE K 33 LEU K 38 -1 N LEU K 38 O LEU K 85 Start residue of secondary structure not found: SHEET 3 BC 3 ARG K 45 VAL K 48 -1 N VAL K 48 O TRP K 35 Start residue of secondary structure not found: SHEET 1 BD 4 SER K 114 PHE K 118 0 Start residue of secondary structure not found: SHEET 2 BD 4 THR K 129 ASN K 137 -1 N ASN K 137 O SER K 114 5 messages similar to the above omitted Cannot find LINK/SSBOND residue CYS (22 ) Cannot find LINK/SSBOND residue CYS (155 ) Cannot find LINK/SSBOND residue CYS (120 ) Cannot find LINK/SSBOND residue CYS (127 ) Cannot find LINK/SSBOND residue CYS (132 ) 27 messages similar to the above omitted Chain information for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb #1 --- Chain | Description A E I | No description available B F J | No description available C G K | No description available D H L | No description available The following atoms were found to have physically impossible anisotropic B-factor (ANISOU) entries. These have been removed in favour of their isotropic B-factors. C1: N C1: CA C1: C C1: O C1: CB C1: CG C1: CD C1: OE1 C1: NE2 C2: N C2: CA C2: C C2: O C2: CB C2: CG1 C2: CG2 C3: N C3: CA C3: C C3: O C3: CB C3: CG C3: CD C3: OE1 C3: NE2 C4: N C4: CA C4: C C4: O C4: CB C4: CG C4: CD1 C4: CD2 C5: N C5: CA C5: C C5: O C5: CB C5: CG1 C5: CG2 C5: CD1 C6: N C6: CA C6: C C6: O C6: CB C6: CG C6: CD C6: OE1 C6: NE2 C7: N C7: CA C7: C C7: O C7: CB C7: OG C8: N C8: CA C8: C C8: O C9: N C9: CA C9: C C9: O C9: CB C9: CG C9: CD C10: N C10: CA C10: C C10: O C10: CB C10: CG C10: CD C10: OE1 C10: NE2 C11: N C11: CA C11: C C11: O C11: CB C11: CG C11: CD1 C11: CD2 C11: CE1 C11: CE2 C11: CZ C12: N C12: CA C12: C C12: O C12: CB C12: CG C12: CD C12: CE C12: NZ C13: N C13: CA C13: C C13: O C13: CB C13: OG1 C13: CG2 C14: N C14: CA C14: C C14: O C14: CB C14: CG C14: CD C15: N C15: CA C15: C C15: O C16: N C16: CA C16: C C16: O C16: CB C17: N C17: CA C17: C C17: O C17: CB C17: OG C18: N C18: CA C18: C C18: O C18: CB C18: CG1 C18: CG2 C19: N C19: CA C19: C C19: O C19: CB C19: OG1 C19: CG2 C20: N C20: CA C20: C C20: O C20: CB C20: CG1 C20: CG2 C21: N C21: CA C21: C C21: O C21: CB C21: OG C22: N C22: CA C22: C C22: O C22: CB C22: SG C23: N C23: CA C23: C C23: O C23: CB C23: CG C23: CD C23: CE C23: NZ C24: N C24: CA C24: C C24: O C24: CB C25: N C25: CA C25: C C25: O C25: CB C25: OG C26: N C26: CA C26: C C26: O C27: N C27: CA C27: C C27: O C27: CB C27: CG C27: CD1 C27: CD2 C27: CE1 C27: CE2 C27: CZ C27: OH C28: N C28: CA C28: C C28: O C28: CB C28: CG1 C28: CG2 C28: CD1 C29: N C29: CA C29: C C29: O C29: CB C29: CG C29: CD1 C29: CD2 C29: CE1 C29: CE2 C29: CZ C30: N C30: CA C30: C C30: O C30: CB C30: OG1 C30: CG2 C31: N C31: CA C31: C C31: O C31: CB C31: CG C31: OD1 C31: OD2 C32: N C32: CA C32: C C32: O C32: CB C32: CG C32: CD1 C32: CD2 C32: CE1 C32: CE2 C32: CZ C32: OH C33: N C33: CA C33: C C33: O C33: CB C33: CG C33: CD1 C33: CD2 C34: N C34: CA C34: C C34: O C34: CB C34: CG1 C34: CG2 C34: CD1 C35: N C35: CA C35: C C35: O C35: CB C35: CG C35: ND1 C35: CD2 C35: CE1 C35: NE2 C36: N C36: CA C36: C C36: O C36: CB C36: CG C36: CD1 C36: CD2 C36: NE1 C36: CE2 C36: CE3 C36: CZ2 C36: CZ3 C36: CH2 C37: N C37: CA C37: C C37: O C37: CB C37: CG1 C37: CG2 C38: N C38: CA C38: C C38: O C38: CB C38: CG C38: CD C38: NE C38: CZ C38: NH1 C38: NH2 C39: N C39: CA C39: C C39: O C39: CB C39: CG C39: CD1 C39: CD2 C40: N C40: CA C40: C C40: O C40: CB C40: CG1 C40: CG2 C41: N C41: CA C41: C C41: O C41: CB C41: CG C41: CD C42: N C42: CA C42: C C42: O C43: N C43: CA C43: C C43: O C43: CB C43: CG C43: CD C43: CE C43: NZ C44: N C44: CA C44: C C44: O C45: N C45: CA C45: C C45: O C45: CB C45: CG C45: CD1 C45: CD2 C46: N C46: CA C46: C C46: O C46: CB C46: CG C46: CD C46: OE1 C46: OE2 C47: N C47: CA C47: C C47: O C47: CB C47: CG C47: CD1 C47: CD2 C47: NE1 C47: CE2 C47: CE3 C47: CZ2 C47: CZ3 C47: CH2 C48: N C48: CA C48: C C48: O C48: CB C48: CG C48: CD1 C48: CD2 C49: N C49: CA C49: C C49: O C50: N C50: CA C50: C C50: O C50: CB C50: CG C50: CD C50: NE C50: CZ C50: NH1 C50: NH2 C51: N C51: CA C51: C C51: O C51: CB C51: CG1 C51: CG2 C51: CD1 C52: N C52: CA C52: C C52: O C52: CB C52: CG C52: OD1 C52: ND2 C53: N C53: CA C53: C C53: O C53: CB C53: OG1 C53: CG2 C54: N C54: CA C54: C C54: O C54: CB C54: CG C54: OD1 C54: ND2 C55: N C55: CA C55: C C55: O C55: CB C56: N C56: CA C56: C C56: O C57: N C57: CA C57: C C57: O C57: CB C57: CG C57: CD1 C57: CD2 C58: N C58: CA C58: C C58: O C58: CB C58: CG C58: SD C58: CE C59: N C59: CA C59: C C59: O C59: CB C59: CG C59: CD1 C59: CD2 C59: CE1 C59: CE2 C59: CZ C59: OH C60: N C60: CA C60: C C60: O C60: CB C60: CG C60: CD1 C60: CD2 C61: N C61: CA C61: C C61: O C61: CB C61: OG C62: N C62: CA C62: C C62: O C62: CB C62: CG C62: ND1 C62: CD2 C62: CE1 C62: NE2 C63: N C63: CA C63: C C63: O C63: CB C63: CG C63: CD C63: CE C63: NZ C64: N C64: CA C64: C C64: O C64: CB C64: CG C64: CD1 C64: CD2 C64: CE1 C64: CE2 C64: CZ C65: N C65: CA C65: C C65: O C65: CB C65: CG C65: CD C65: OE1 C65: OE2 C66: N C66: CA C66: C C66: O C67: N C67: CA C67: C C67: O C67: CB C67: CG C67: CD C67: NE C67: CZ C67: NH1 C67: NH2 C68: N C68: CA C68: C C68: O C68: CB C68: CG C68: CD1 C68: CD2 C69: N C69: CA C69: C C69: O C69: CB C69: CG1 C69: CG2 C69: CD1 C70: N C70: CA C70: C C70: O C70: CB C70: CG C70: CD1 C70: CD2 C71: N C71: CA C71: C C71: O C71: CB C71: CG C71: CD C71: NE C71: CZ C71: NH1 C71: NH2 C72: N C72: CA C72: C C72: O C72: CB C72: CG C72: CD C72: NE C72: CZ C72: NH1 C72: NH2 C73: N C73: CA C73: C C73: O C73: CB C73: CG1 C73: CG2 C74: N C74: CA C74: C C74: O C74: CB C74: CG1 C74: CG2 C75: N C75: CA C75: C C75: O C75: CB C75: CG C75: OD1 C75: OD2 C76: N C76: CA C76: C C76: O C76: CB C76: CG C76: CD1 C76: CD2 C76: NE1 C76: CE2 C76: CE3 C76: CZ2 C76: CZ3 C76: CH2 C77: N C77: CA C77: C C77: O C77: CB C77: CG C77: CD C77: NE C77: CZ C77: NH1 C77: NH2 C78: N C78: CA C78: C C78: O C78: CB C78: OG1 C78: CG2 C79: N C79: CA C79: C C79: O C79: CB C79: CG C79: CD C80: N C80: CA C80: C C80: O C80: CB C80: OG C81: N C81: CA C81: C C81: O C81: CB C81: CG C81: CD1 C81: CD2 C82: N C82: CA C82: C C82: O C83: N C83: CA C83: C C83: O C83: CB C83: OG1 C83: CG2 C84: N C84: CA C84: C C84: O C84: CB C84: CG1 C84: CG2 C85: N C85: CA C85: C C85: O C85: CB C85: CG C85: OD1 C85: ND2 C86: N C86: CA C86: C C86: O C86: CB C86: CG C86: SD C86: CE C87: N C87: CA C87: C C87: O C87: CB C87: CG C87: CD C87: OE1 C87: OE2 C88: N C88: CA C88: C C88: O C88: CB C88: CG C88: CD1 C88: CD2 C89: N C89: CA C89: C C89: O C89: CB C89: CG C89: CD C89: NE C89: CZ C89: NH1 C89: NH2 C90: N C90: CA C90: C C90: O C90: CB C90: CG C90: OD1 C90: ND2 C91: N C91: CA C91: C C91: O C91: CB C91: CG1 C91: CG2 C92: N C92: CA C92: C C92: O C92: CB C92: CG C92: CD C92: NE C92: CZ C92: NH1 C92: NH2 C93: N C93: CA C93: C C93: O C93: CB C93: OG C94: N C94: CA C94: C C94: O C94: CB C94: CG C94: OD1 C94: OD2 C95: N C95: CA C95: C C95: O C95: CB C95: CG C95: OD1 C95: OD2 C96: N C96: CA C96: C C96: O C96: CB C96: OG C97: N C97: CA C97: C C97: O C97: CB C98: N C98: CA C98: C C98: O C98: CB C98: CG1 C98: CG2 C98: CD1 C99: N C99: CA C99: C C99: O C99: CB C99: CG C99: CD1 C99: CD2 C99: CE1 C99: CE2 C99: CZ C99: OH C100: N C100: CA C100: C C100: O C100: CB C100: CG C100: CD1 C100: CD2 C100: CE1 C100: CE2 C100: CZ C101: N C101: CA C101: C C101: O C101: CB C101: SG C102: N C102: CA C102: C C102: O C103: N C103: CA C103: C C103: O C103: CB C103: CG C103: CD C103: NE C103: CZ C103: NH1 C103: NH2 C104: N C104: CA C104: C C104: O C104: CB C104: CG1 C104: CG2 C105: N C105: CA C105: C C105: O C105: CB C105: CG1 C105: CG2 C106: N C106: CA C106: C C106: O C106: CB C106: CG C106: OD1 C106: OD2 C107: N C107: CA C107: C C107: O C108: N C108: CA C108: C C108: O C108: CB C108: CG C108: CD1 C108: CD2 C108: CE1 C108: CE2 C108: CZ C109: N C109: CA C109: C C109: O C109: CB C109: CG C109: OD1 C109: ND2 C110: N C110: CA C110: C C110: O C110: CB C111: N C111: CA C111: C C111: O C111: CB C112: N C112: CA C112: C C112: O C113: N C113: CA C113: C C113: O C113: CB C113: CG C113: CD C114: N C114: CA C114: C C114: O C114: CB C114: CG C114: CD1 C114: CD2 C115: N C115: CA C115: C C115: O C115: CB C115: CG C115: CD C115: OE1 C115: OE2 C116: N C116: CA C116: C C116: O C116: CB C116: CG C116: CD1 C116: CD2 C116: CE1 C116: CE2 C116: CZ C117: N C117: CA C117: C C117: O C117: CB C117: CG C117: CD1 C117: CD2 C117: NE1 C117: CE2 C117: CE3 C117: CZ2 C117: CZ3 C117: CH2 C118: N C118: CA C118: C C118: O C119: N C119: CA C119: C C119: O C119: CB C119: CG C119: CD C119: OE1 C119: NE2 C120: N C120: CA C120: C C120: O C121: N C121: CA C121: C C121: O C121: CB C121: OG C122: N C122: CA C122: C C122: O C122: CB C122: CG C122: CD C123: N C123: CA C123: C C123: O C123: CB C123: CG1 C123: CG2 C124: N C124: CA C124: C C124: O C124: CB C124: CG1 C124: CG2 C124: CD1 C125: N C125: CA C125: C C125: O C125: CB C125: CG1 C125: CG2 C126: N C126: CA C126: C C126: O C126: CB C126: OG C127: N C127: CA C127: C C127: O C127: CB C127: OG C129: N C129: CA C129: C C129: O C129: CB C130: N C130: CA C130: C C130: O C130: CB C130: OG C131: N C131: CA C131: C C131: O C131: CB C131: OG1 C131: CG2 C132: N C132: CA C132: C C132: O C132: CB C132: CG C132: CD C132: CE C132: NZ C133: N C133: CA C133: C C133: O C134: N C134: CA C134: C C134: O C134: CB C134: CG C134: CD C135: N C135: CA C135: C C135: O C135: CB C135: OG C136: N C136: CA C136: C C136: O C136: CB C136: CG1 C136: CG2 C137: N C137: CA C137: C C137: O C137: CB C137: CG C137: CD1 C137: CD2 C137: CE1 C137: CE2 C137: CZ C138: N C138: CA C138: C C138: O C138: CB C138: CG C138: CD C139: N C139: CA C139: C C139: O C139: CB C139: CG C139: CD1 C139: CD2 C140: N C140: CA C140: C C140: O C140: CB C141: N C141: CA C141: C C141: O C141: CB C141: CG C141: CD C142: N C142: CA C142: C C142: O C142: CB C142: OG C143: N C143: CA C143: C C143: O C143: CB C143: OG C144: N C144: CA C144: C C144: O C144: CB C144: CG C144: CD C144: CE C144: NZ C145: N C145: CA C145: C C145: O C145: CB C145: OG C146: N C146: CA C146: C C146: O C146: CB C146: OG1 C146: CG2 C147: N C147: CA C147: C C147: O C147: CB C147: OG C148: N C148: CA C148: C C148: O C149: N C149: CA C149: C C149: O C150: N C150: CA C150: C C150: O C150: CB C150: OG1 C150: CG2 C151: N C151: CA C151: C C151: O C151: CB C152: N C152: CA C152: C C152: O C152: CB C153: N C153: CA C153: C C153: O C153: CB C153: CG C153: CD1 C153: CD2 C154: N C154: CA C154: C C154: O C155: N C155: CA C155: C C155: O C155: CB C155: SG C156: N C156: CA C156: C C156: O C156: CB C156: CG C156: CD1 C156: CD2 C157: N C157: CA C157: C C157: O C157: CB C157: CG1 C157: CG2 C158: N C158: CA C158: C C158: O C158: CB C158: CG C158: CD C158: CE C158: NZ C159: N C159: CA C159: C C159: O C159: CB C159: CG C159: OD1 C159: OD2 C160: N C160: CA C160: C C160: O C160: CB C160: CG C160: CD1 C160: CD2 C160: CE1 C160: CE2 C160: CZ C160: OH C161: N C161: CA C161: C C161: O C161: CB C161: CG C161: CD1 C161: CD2 C161: CE1 C161: CE2 C161: CZ C162: N C162: CA C162: C C162: O C162: CB C162: CG C162: CD C163: N C163: CA C163: C C163: O C163: CB C163: CG C163: CD C163: OE1 C163: OE2 C164: N C164: CA C164: C C164: O C164: CB C164: CG C164: CD C165: N C165: CA C165: C C165: O C165: CB C165: CG1 C165: CG2 C166: N C166: CA C166: C C166: O C166: CB C166: OG1 C166: CG2 C167: N C167: CA C167: C C167: O C167: CB C167: CG1 C167: CG2 C168: N C168: CA C168: C C168: O C168: CB C168: OG C169: N C169: CA C169: C C169: O C169: CB C169: CG C169: CD1 C169: CD2 C169: NE1 C169: CE2 C169: CE3 C169: CZ2 C169: CZ3 C169: CH2 C170: N C170: CA C170: C C170: O C170: CB C170: CG C170: OD1 C170: ND2 C171: N C171: CA C171: C C171: O C171: CB C171: OG C172: N C172: CA C172: C C172: O C173: N C173: CA C173: C C173: O C173: CB C174: N C174: CA C174: C C174: O C174: CB C174: CG C174: CD1 C174: CD2 C175: N C175: CA C175: C C175: O C175: CB C175: OG1 C175: CG2 C176: N C176: CA C176: C C176: O C176: CB C176: OG C177: N C177: CA C177: C C177: O C178: N C178: CA C178: C C178: O C178: CB C178: CG1 C178: CG2 C179: N C179: CA C179: C C179: O C179: CB C179: CG C179: ND1 C179: CD2 C179: CE1 C179: NE2 C180: N C180: CA C180: C C180: O C180: CB C180: OG1 C180: CG2 C181: N C181: CA C181: C C181: O C181: CB C181: CG C181: CD1 C181: CD2 C181: CE1 C181: CE2 C181: CZ C182: N C182: CA C182: C C182: O C182: CB C182: CG C182: CD C183: N C183: CA C183: C C183: O C183: CB C184: N C184: CA C184: C C184: O C184: CB C184: CG1 C184: CG2 C185: N C185: CA C185: C C185: O C185: CB C185: CG C185: CD1 C185: CD2 C186: N C186: CA C186: C C186: O C186: CB C186: CG C186: CD C186: OE1 C186: NE2 C187: N C187: CA C187: C C187: O C187: CB C187: OG C188: N C188: CA C188: C C188: O C188: CB C188: OG C189: N C189: CA C189: C C189: O C190: N C190: CA C190: C C190: O C190: CB C190: CG C190: CD1 C190: CD2 C191: N C191: CA C191: C C191: O C191: CB C191: CG C191: CD1 C191: CD2 C191: CE1 C191: CE2 C191: CZ C191: OH C192: N C192: CA C192: C C192: O C192: CB C192: OG C193: N C193: CA C193: C C193: O C193: CB C193: CG C193: CD1 C193: CD2 C194: N C194: CA C194: C C194: O C194: CB C194: OG C195: N C195: CA C195: C C195: O C195: CB C195: OG C196: N C196: CA C196: C C196: O C196: CB C196: CG1 C196: CG2 C197: N C197: CA C197: C C197: O C197: CB C197: CG1 C197: CG2 C198: N C198: CA C198: C C198: O C198: CB C198: OG1 C198: CG2 C199: N C199: CA C199: C C199: O C199: CB C199: CG1 C199: CG2 C200: N C200: CA C200: C C200: O C200: CB C200: CG C200: CD C201: N C201: CA C201: C C201: O C201: CB C201: OG C202: N C202: CA C202: C C202: O C202: CB C202: OG C203: N C203: CA C203: C C203: O C203: CB C203: OG C204: N C204: CA C204: C C204: O C204: CB C204: CG C204: CD1 C204: CD2 C205: N C205: CA C205: C C205: O C206: N C206: CA C206: C C206: O C206: CB C206: OG1 C206: CG2 C207: N C207: CA C207: C C207: O C207: CB C207: CG C207: CD C207: OE1 C207: NE2 C208: N C208: CA C208: C C208: O C208: CB C208: OG1 C208: CG2 C209: N C209: CA C209: C C209: O C209: CB C209: CG C209: CD1 C209: CD2 C209: CE1 C209: CE2 C209: CZ C209: OH C210: N C210: CA C210: C C210: O C210: CB C210: CG1 C210: CG2 C210: CD1 C211: N C211: CA C211: C C211: O C211: CB C211: SG C212: N C212: CA C212: C C212: O C212: CB C212: CG C212: OD1 C212: ND2 C213: N C213: CA C213: C C213: O C213: CB C213: CG1 C213: CG2 C214: N C214: CA C214: C C214: O C214: CB C214: CG C214: OD1 C214: ND2 C215: N C215: CA C215: C C215: O C215: CB C215: CG C215: ND1 C215: CD2 C215: CE1 C215: NE2 C216: N C216: CA C216: C C216: O C216: CB C216: CG C216: CD C216: CE C216: NZ C217: N C217: CA C217: C C217: O C217: CB C217: CG C217: CD C218: N C218: CA C218: C C218: O C218: CB C218: OG C219: N C219: CA C219: C C219: O C219: CB C219: CG C219: OD1 C219: ND2 C220: N C220: CA C220: C C220: O C220: CB C220: OG1 C220: CG2 C221: N C221: CA C221: C C221: O C221: CB C221: CG C221: CD C221: CE C221: NZ C222: N C222: CA C222: C C222: O C222: CB C222: CG1 C222: CG2 C223: N C223: CA C223: C C223: O C223: CB C223: CG C223: OD1 C223: OD2 C224: N C224: CA C224: C C224: O C224: CB C224: CG C224: CD C224: CE C224: NZ C225: N C225: CA C225: C C225: O C225: CB C225: CG C225: CD C225: CE C225: NZ C226: N C226: CA C226: C C226: O C226: CB C226: CG1 C226: CG2 C227: N C227: CA C227: C C227: O C227: CB C227: CG C227: CD C227: OE1 C227: OE2 C228: N C228: CA C228: C C228: O C228: CB C228: CG C228: CD C229: N C229: CA C229: C C229: O C229: CB C229: CG C229: CD C229: CE C229: NZ C230: N C230: CA C230: C C230: O C230: CB C230: OG D1: N D1: CA D1: C D1: O D1: CB D1: CG D1: CD D1: OE1 D1: NE2 D2: N D2: CA D2: C D2: O D2: CB D2: CG1 D2: CG2 D3: N D3: CA D3: C D3: O D3: CB D3: CG1 D3: CG2 D4: N D4: CA D4: C D4: O D4: CB D4: CG D4: SD D4: CE D5: N D5: CA D5: C D5: O D5: CB D5: OG1 D5: CG2 D6: N D6: CA D6: C D6: O D6: CB D6: CG D6: CD D6: OE1 D6: NE2 D7: N D7: CA D7: C D7: O D7: CB D7: OG D8: N D8: CA D8: C D8: O D8: CB D8: CG D8: CD D9: N D9: CA D9: C D9: O D9: CB D10: N D10: CA D10: C D10: O D10: CB D10: OG1 D10: CG2 D11: N D11: CA D11: C D11: O D11: CB D11: CG D11: CD1 D11: CD2 D12: N D12: CA D12: C D12: O D12: CB D12: OG D13: N D13: CA D13: C D13: O D13: CB D13: CG D13: CD1 D13: CD2 D14: N D14: CA D14: C D14: O D14: CB D14: OG D15: N D15: CA D15: C D15: O D15: CB D15: CG D15: CD D16: N D16: CA D16: C D16: O D17: N D17: CA D17: C D17: O D17: CB D17: CG D17: CD D17: OE1 D17: OE2 D18: N D18: CA D18: C D18: O D18: CB D18: OG1 D18: CG2 D19: N D19: CA D19: C D19: O D19: CB D20: N D20: CA D20: C D20: O D20: CB D21: N D21: CA D21: C D21: O D21: CB D21: CG1 D21: CG2 D22: N D22: CA D22: C D22: O D22: CB D22: OG D23: N D23: CA D23: C D23: O D23: CB D23: SG D24: N D24: CA D24: C D24: O D24: CB D24: CG D24: CD D24: NE D24: CZ D24: NH1 D24: NH2 D25: N D25: CA D25: C D25: O D25: CB D26: N D26: CA D26: C D26: O D26: CB D26: OG D27: N D27: CA D27: C D27: O D27: CB D27: CG D27: CD D27: OE1 D27: NE2 D28: N D28: CA D28: C D28: O D28: CB D28: CG D28: CD1 D28: CD2 D28: CE1 D28: CE2 D28: CZ D28: OH D29: N D29: CA D29: C D29: O D29: CB D29: CG1 D29: CG2 D30: N D30: CA D30: C D30: O D30: CB D30: CG D30: OD1 D30: OD2 D31: N D31: CA D31: C D31: O D31: CB D31: CG D31: CD D31: NE D31: CZ D31: NH1 D31: NH2 D32: N D32: CA D32: C D32: O D32: CB D32: OG D33: N D33: CA D33: C D33: O D33: CB D33: CG1 D33: CG2 D33: CD1 D34: N D34: CA D34: C D34: O D34: CB D34: OG D35: N D35: CA D35: C D35: O D35: CB D35: CG D35: CD1 D35: CD2 D35: NE1 D35: CE2 D35: CE3 D35: CZ2 D35: CZ3 D35: CH2 D36: N D36: CA D36: C D36: O D36: CB D36: CG D36: CD1 D36: CD2 D36: CE1 D36: CE2 D36: CZ D36: OH D37: N D37: CA D37: C D37: O D37: CB D37: CG D37: CD D37: OE1 D37: NE2 D38: N D38: CA D38: C D38: O D38: CB D38: CG D38: CD1 D38: CD2 D39: N D39: CA D39: C D39: O D39: CB D39: CG D39: CD D39: CE D39: NZ D40: N D40: CA D40: C D40: O D40: CB D40: OG1 D40: CG2 D41: N D41: CA D41: C D41: O D42: N D42: CA D42: C D42: O D42: CB D42: CG D42: CD D42: NE D42: CZ D42: NH1 D42: NH2 D43: N D43: CA D43: C D43: O D43: CB D44: N D44: CA D44: C D44: O D44: CB D44: CG D44: CD D45: N D45: CA D45: C D45: O D45: CB D45: CG D45: CD D45: NE D45: CZ D45: NH1 D45: NH2 D46: N D46: CA D46: C D46: O D46: CB D46: CG D46: CD1 D46: CD2 D47: N D47: CA D47: C D47: O D47: CB D47: CG D47: CD1 D47: CD2 D48: N D48: CA D48: C D48: O D48: CB D48: CG1 D48: CG2 D49: N D49: CA D49: C D49: O D49: CB D49: CG D49: CD1 D49: CD2 D49: CE1 D49: CE2 D49: CZ D49: OH D50: N D50: CA D50: C D50: O D50: CB D51: N D51: CA D51: C D51: O D51: CB D52: N D52: CA D52: C D52: O D52: CB D52: OG D53: N D53: CA D53: C D53: O D53: CB D53: OG D54: N D54: CA D54: C D54: O D54: CB D54: CG D54: CD D54: NE D54: CZ D54: NH1 D54: NH2 D55: N D55: CA D55: C D55: O D55: CB D55: OG D56: N D56: CA D56: C D56: O D56: CB D56: CG1 D56: CG2 D56: CD1 D57: N D57: CA D57: C D57: O D58: N D58: CA D58: C D58: O D58: CB D58: CG1 D58: CG2 D59: N D59: CA D59: C D59: O D59: CB D59: CG D59: CD D60: N D60: CA D60: C D60: O D60: CB D60: CG D60: OD1 D60: OD2 D61: N D61: CA D61: C D61: O D61: CB D61: CG D61: CD D61: NE D61: CZ D61: NH1 D61: NH2 D62: N D62: CA D62: C D62: O D62: CB D62: CG D62: CD1 D62: CD2 D62: CE1 D62: CE2 D62: CZ D63: N D63: CA D63: C D63: O D63: CB D63: OG D64: N D64: CA D64: C D64: O D65: N D65: CA D65: C D65: O D65: CB D65: OG D66: N D66: CA D66: C D66: O D67: N D67: CA D67: C D67: O D67: CB D67: OG D68: N D68: CA D68: C D68: O D69: N D69: CA D69: C D69: O D69: CB D69: CG D69: CD D69: NE D69: CZ D69: NH1 D69: NH2 D70: N D70: CA D70: C D70: O D70: CB D70: CG D70: OD1 D70: OD2 D71: N D71: CA D71: C D71: O D71: CB D71: CG D71: CD1 D71: CD2 D71: CE1 D71: CE2 D71: CZ D72: N D72: CA D72: C D72: O D72: CB D72: OG1 D72: CG2 D73: N D73: CA D73: C D73: O D73: CB D73: CG D73: CD1 D73: CD2 D74: N D74: CA D74: C D74: O D74: CB D74: OG1 D74: CG2 D75: N D75: CA D75: C D75: O D75: CB D75: CG1 D75: CG2 D75: CD1 D76: N D76: CA D76: C D76: O D76: CB D76: CG D76: CD D76: NE D76: CZ D76: NH1 D76: NH2 D77: N D77: CA D77: C D77: O D78: N D78: CA D78: C D78: O D78: CB D78: CG1 D78: CG2 D79: N D79: CA D79: C D79: O D79: CB D79: CG D79: CD D79: OE1 D79: NE2 D80: N D80: CA D80: C D80: O D80: CB D80: OG D81: N D81: CA D81: C D81: O D81: CB D81: CG D81: OD1 D81: OD2 D82: N D82: CA D82: C D82: O D82: CB D82: CG D82: OD1 D82: OD2 D83: N D83: CA D83: C D83: O D83: CB D83: CG D83: CD1 D83: CD2 D83: CE1 D83: CE2 D83: CZ D84: N D84: CA D84: C D84: O D84: CB D85: N D85: CA D85: C D85: O D85: CB D85: CG D85: CD1 D85: CD2 D86: N D86: CA D86: C D86: O D86: CB D86: CG D86: CD1 D86: CD2 D86: CE1 D86: CE2 D86: CZ D86: OH D87: N D87: CA D87: C D87: O D87: CB D87: CG D87: CD1 D87: CD2 D87: CE1 D87: CE2 D87: CZ D87: OH D88: N D88: CA D88: C D88: O D88: CB D88: SG D89: N D89: CA D89: C D89: O D89: CB D89: CG D89: CD D89: OE1 D89: NE2 D90: N D90: CA D90: C D90: O D90: CB D90: CG D90: CD D90: OE1 D90: NE2 D91: N D91: CA D91: C D91: O D91: CB D91: CG D91: OD1 D91: OD2 D92: N D92: CA D92: C D92: O D92: CB D92: CG D92: CD1 D92: CD2 D92: CE1 D92: CE2 D92: CZ D92: OH D93: N D93: CA D93: C D93: O D93: CB D93: CG D93: CD1 D93: CD2 D93: CE1 D93: CE2 D93: CZ D93: OH D94: N D94: CA D94: C D94: O D94: CB D94: CG D94: CD1 D94: CD2 D94: NE1 D94: CE2 D94: CE3 D94: CZ2 D94: CZ3 D94: CH2 D95: N D95: CA D95: C D95: O D95: CB D95: CG D95: CD D96: N D96: CA D96: C D96: O D96: CB D96: CG1 D96: CG2 D97: N D97: CA D97: C D97: O D97: CB D97: OG1 D97: CG2 D98: N D98: CA D98: C D98: O D98: CB D98: CG D98: CD1 D98: CD2 D98: CE1 D98: CE2 D98: CZ D99: N D99: CA D99: C D99: O D100: N D100: CA D100: C D100: O D100: CB D100: CG D100: CD D100: OE1 D100: NE2 D101: N D101: CA D101: C D101: O D102: N D102: CA D102: C D102: O D102: CB D102: OG1 D102: CG2 D103: N D103: CA D103: C D103: O D103: CB D103: CG D103: CD D103: NE D103: CZ D103: NH1 D103: NH2 D104: N D104: CA D104: C D104: O D104: CB D104: CG D104: CD1 D104: CD2 D105: N D105: CA D105: C D105: O D105: CB D105: CG D105: OD1 D105: OD2 D106: N D106: CA D106: C D106: O D106: CB D106: CG D106: SD D106: CE D107: N D107: CA D107: C D107: O D107: CB D107: CG D107: CD D107: CE D107: NZ D108: N D108: CA D108: C D108: O D108: CB D108: CG D108: CD D108: NE D108: CZ D108: NH1 D108: NH2 D109: N D109: CA D109: C D109: O D109: CB D109: OG1 D109: CG2 D110: N D110: CA D110: C D110: O D110: CB D110: CG1 D110: CG2 D111: N D111: CA D111: C D111: O D111: CB D112: N D112: CA D112: C D112: O D112: CB D113: N D113: CA D113: C D113: O D113: CB D113: CG D113: CD D114: N D114: CA D114: C D114: O D114: CB D114: OG D115: N D115: CA D115: C D115: O D115: CB D115: CG1 D115: CG2 D116: N D116: CA D116: C D116: O D116: CB D116: CG D116: CD1 D116: CD2 D116: CE1 D116: CE2 D116: CZ D117: N D117: CA D117: C D117: O D117: CB D117: CG1 D117: CG2 D117: CD1 D118: N D118: CA D118: C D118: O D118: CB D118: CG D118: CD1 D118: CD2 D118: CE1 D118: CE2 D118: CZ D119: N D119: CA D119: C D119: O D119: CB D119: CG D119: CD D120: N D120: CA D120: C D120: O D120: CB D120: CG D120: CD D121: N D121: CA D121: C D121: O D121: CB D121: OG D122: N D122: CA D122: C D122: O D122: CB D122: CG D122: OD1 D122: OD2 D123: N D123: CA D123: C D123: O D123: CB D123: CG D123: CD D123: OE1 D123: OE2 D124: N D124: CA D124: C D124: O D124: CB D124: CG D124: CD D124: OE1 D124: NE2 D125: N D125: CA D125: C D125: O D125: CB D125: CG D125: CD1 D125: CD2 D126: N D126: CA D126: C D126: O D126: CB D126: CG D126: CD D126: CE D126: NZ D127: N D127: CA D127: C D127: O D127: CB D127: OG D128: N D128: CA D128: C D128: O D129: N D129: CA D129: C D129: O D129: CB D129: OG1 D129: CG2 D130: N D130: CA D130: C D130: O D130: CB D131: N D131: CA D131: C D131: O D131: CB D131: OG D132: N D132: CA D132: C D132: O D132: CB D132: CG1 D132: CG2 D133: N D133: CA D133: C D133: O D133: CB D133: CG1 D133: CG2 D134: N D134: CA D134: C D134: O D134: CB D134: SG D135: N D135: CA D135: C D135: O D135: CB D135: CG D135: CD1 D135: CD2 D136: N D136: CA D136: C D136: O D136: CB D136: CG D136: CD1 D136: CD2 D137: N D137: CA D137: C D137: O D137: CB D137: CG D137: OD1 D137: ND2 D138: N D138: CA D138: C D138: O D138: CB D138: CG D138: OD1 D138: ND2 D139: N D139: CA D139: C D139: O D139: CB D139: CG D139: CD1 D139: CD2 D139: CE1 D139: CE2 D139: CZ D140: N D140: CA D140: C D140: O D140: CB D140: CG D140: CD1 D140: CD2 D140: CE1 D140: CE2 D140: CZ D140: OH D141: N D141: CA D141: C D141: O D141: CB D141: CG D141: CD D142: N D142: CA D142: C D142: O D142: CB D142: CG D142: CD D142: NE D142: CZ D142: NH1 D142: NH2 D143: N D143: CA D143: C D143: O D143: CB D143: CG D143: CD D143: OE1 D143: OE2 D144: N D144: CA D144: C D144: O D144: CB D145: N D145: CA D145: C D145: O D145: CB D145: CG D145: CD D145: CE D145: NZ D146: N D146: CA D146: C D146: O D146: CB D146: CG1 D146: CG2 D147: N D147: CA D147: C D147: O D147: CB D147: CG D147: CD D147: OE1 D147: NE2 D148: N D148: CA D148: C D148: O D148: CB D148: CG D148: CD1 D148: CD2 D148: NE1 D148: CE2 D148: CE3 D148: CZ2 D148: CZ3 D148: CH2 D149: N D149: CA D149: C D149: O D149: CB D149: CG D149: CD D149: CE D149: NZ D150: N D150: CA D150: C D150: O D150: CB D150: CG1 D150: CG2 D151: N D151: CA D151: C D151: O D151: CB D151: CG D151: OD1 D151: OD2 D152: N D152: CA D152: C D152: O D152: CB D152: CG D152: OD1 D152: ND2 D153: N D153: CA D153: C D153: O D153: CB D154: N D154: CA D154: C D154: O D154: CB D154: CG D154: CD1 D154: CD2 D155: N D155: CA D155: C D155: O D155: CB D155: CG D155: CD D155: OE1 D155: NE2 D156: N D156: CA D156: C D156: O D156: CB D156: OG D157: N D157: CA D157: C D157: O D158: N D158: CA D158: C D158: O D158: CB D158: CG D158: OD1 D158: ND2 D159: N D159: CA D159: C D159: O D159: CB D159: OG D160: N D160: CA D160: C D160: O D160: CB D160: CG D160: CD D160: OE1 D160: NE2 D161: N D161: CA D161: C D161: O D161: CB D161: CG D161: CD D161: OE1 D161: OE2 D162: N D162: CA D162: C D162: O D162: CB D162: OG D163: N D163: CA D163: C D163: O D163: CB D163: CG1 D163: CG2 D164: N D164: CA D164: C D164: O D164: CB D164: OG1 D164: CG2 D165: N D165: CA D165: C D165: O D165: CB D165: CG D165: CD D165: OE1 D165: OE2 D166: N D166: CA D166: C D166: O D166: CB D166: CG D166: CD D166: OE1 D166: NE2 D167: N D167: CA D167: C D167: O D167: CB D167: CG D167: OD1 D167: OD2 D168: N D168: CA D168: C D168: O D168: CB D168: OG D169: N D169: CA D169: C D169: O D169: CB D169: CG D169: CD D169: CE D169: NZ D170: N D170: CA D170: C D170: O D170: CB D170: CG D170: OD1 D170: OD2 D171: N D171: CA D171: C D171: O D171: CB D171: OG D172: N D172: CA D172: C D172: O D172: CB D172: OG1 D172: CG2 D173: N D173: CA D173: C D173: O D173: CB D173: CG D173: CD1 D173: CD2 D173: CE1 D173: CE2 D173: CZ D173: OH D174: N D174: CA D174: C D174: O D174: CB D174: OG D175: N D175: CA D175: C D175: O D175: CB D175: CG D175: CD1 D175: CD2 D176: N D176: CA D176: C D176: O D176: CB D176: OG D177: N D177: CA D177: C D177: O D177: CB D177: OG D178: N D178: CA D178: C D178: O D178: CB D178: OG1 D178: CG2 D179: N D179: CA D179: C D179: O D179: CB D179: CG D179: CD1 D179: CD2 D180: N D180: CA D180: C D180: O D180: CB D180: OG1 D180: CG2 D181: N D181: CA D181: C D181: O D181: CB D181: CG D181: CD1 D181: CD2 D182: N D182: CA D182: C D182: O D182: CB D182: OG D183: N D183: CA D183: C D183: O D183: CB D183: CG D183: CD D183: CE D183: NZ D184: N D184: CA D184: C D184: O D184: CB D185: N D185: CA D185: C D185: O D185: CB D185: CG D185: OD1 D185: OD2 D186: N D186: CA D186: C D186: O D186: CB D186: CG D186: CD1 D186: CD2 D186: CE1 D186: CE2 D186: CZ D186: OH D187: N D187: CA D187: C D187: O D187: CB D187: CG D187: CD D187: OE1 D187: OE2 D188: N D188: CA D188: C D188: O D188: CB D188: CG D188: CD D188: CE D188: NZ D189: N D189: CA D189: C D189: O D189: CB D189: CG D189: ND1 D189: CD2 D189: CE1 D189: NE2 D190: N D190: CA D190: C D190: O D190: CB D190: CG D190: CD D190: CE D190: NZ D191: N D191: CA D191: C D191: O D191: CB D191: CG1 D191: CG2 D192: N D192: CA D192: C D192: O D192: CB D192: CG D192: CD1 D192: CD2 D192: CE1 D192: CE2 D192: CZ D192: OH D193: N D193: CA D193: C D193: O D193: CB D194: N D194: CA D194: C D194: O D194: CB D194: SG D195: N D195: CA D195: C D195: O D195: CB D195: CG D195: CD D195: OE1 D195: OE2 D196: N D196: CA D196: C D196: O D196: CB D196: CG1 D196: CG2 D197: N D197: CA D197: C D197: O D197: CB D197: OG1 D197: CG2 D198: N D198: CA D198: C D198: O D198: CB D198: CG D198: ND1 D198: CD2 D198: CE1 D198: NE2 D199: N D199: CA D199: C D199: O D199: CB D199: CG D199: CD D199: OE1 D199: NE2 D200: N D200: CA D200: C D200: O D201: N D201: CA D201: C D201: O D201: CB D201: CG D201: CD1 D201: CD2 D202: N D202: CA D202: C D202: O D202: CB D202: OG D203: N D203: CA D203: C D203: O D203: CB D203: OG D204: N D204: CA D204: C D204: O D204: CB D204: CG D204: CD D205: N D205: CA D205: C D205: O D205: CB D205: CG1 D205: CG2 D206: N D206: CA D206: C D206: O D206: CB D206: OG1 D206: CG2 D207: N D207: CA D207: C D207: O D207: CB D207: CG D207: CD D207: CE D207: NZ D208: N D208: CA D208: C D208: O D208: CB D208: OG D209: N D209: CA D209: C D209: O D209: CB D209: CG D209: CD1 D209: CD2 D209: CE1 D209: CE2 D209: CZ D210: N D210: CA D210: C D210: O D210: CB D210: CG D210: OD1 D210: ND2 D211: N D211: CA D211: C D211: O D211: CB D211: CG D211: CD D211: NE D211: CZ D211: NH1 D211: NH2 D212: N D212: CA D212: C D212: O D213: N D213: CA D213: C D213: O D213: CB D213: CG D213: CD D213: OE1 D213: OE2 D214: N D214: CA D214: C D214: O D214: CB D214: SG G1: N G1: CA G1: C G1: O G1: CB G1: CG G1: CD G1: OE1 G1: NE2 G2: N G2: CA G2: C G2: O G2: CB G2: CG1 G2: CG2 G3: N G3: CA G3: C G3: O G3: CB G3: CG G3: CD G3: OE1 G3: NE2 G4: N G4: CA G4: C G4: O G4: CB G4: CG G4: CD1 G4: CD2 G5: N G5: CA G5: C G5: O G5: CB G5: CG1 G5: CG2 G5: CD1 G6: N G6: CA G6: C G6: O G6: CB G6: CG G6: CD G6: OE1 G6: NE2 G7: N G7: CA G7: C G7: O G7: CB G7: OG G8: N G8: CA G8: C G8: O G9: N G9: CA G9: C G9: O G9: CB G9: CG G9: CD G10: N G10: CA G10: C G10: O G10: CB G10: CG G10: CD G10: OE1 G10: NE2 G11: N G11: CA G11: C G11: O G11: CB G11: CG G11: CD1 G11: CD2 G11: CE1 G11: CE2 G11: CZ G12: N G12: CA G12: C G12: O G12: CB G12: CG G12: CD G12: CE G12: NZ G13: N G13: CA G13: C G13: O G13: CB G13: OG1 G13: CG2 G14: N G14: CA G14: C G14: O G14: CB G14: CG G14: CD G15: N G15: CA G15: C G15: O G16: N G16: CA G16: C G16: O G16: CB G17: N G17: CA G17: C G17: O G17: CB G17: OG G18: N G18: CA G18: C G18: O G18: CB G18: CG1 G18: CG2 G19: N G19: CA G19: C G19: O G19: CB G19: OG1 G19: CG2 G20: N G20: CA G20: C G20: O G20: CB G20: CG1 G20: CG2 G21: N G21: CA G21: C G21: O G21: CB G21: OG G22: N G22: CA G22: C G22: O G22: CB G22: SG G23: N G23: CA G23: C G23: O G23: CB G23: CG G23: CD G23: CE G23: NZ G24: N G24: CA G24: C G24: O G24: CB G25: N G25: CA G25: C G25: O G25: CB G25: OG G26: N G26: CA G26: C G26: O G27: N G27: CA G27: C G27: O G27: CB G27: CG G27: CD1 G27: CD2 G27: CE1 G27: CE2 G27: CZ G27: OH G28: N G28: CA G28: C G28: O G28: CB G28: CG1 G28: CG2 G28: CD1 G29: N G29: CA G29: C G29: O G29: CB G29: CG G29: CD1 G29: CD2 G29: CE1 G29: CE2 G29: CZ G30: N G30: CA G30: C G30: O G30: CB G30: OG1 G30: CG2 G31: N G31: CA G31: C G31: O G31: CB G31: CG G31: OD1 G31: OD2 G32: N G32: CA G32: C G32: O G32: CB G32: CG G32: CD1 G32: CD2 G32: CE1 G32: CE2 G32: CZ G32: OH G33: N G33: CA G33: C G33: O G33: CB G33: CG G33: CD1 G33: CD2 G34: N G34: CA G34: C G34: O G34: CB G34: CG1 G34: CG2 G34: CD1 G35: N G35: CA G35: C G35: O G35: CB G35: CG G35: ND1 G35: CD2 G35: CE1 G35: NE2 G36: N G36: CA G36: C G36: O G36: CB G36: CG G36: CD1 G36: CD2 G36: NE1 G36: CE2 G36: CE3 G36: CZ2 G36: CZ3 G36: CH2 G37: N G37: CA G37: C G37: O G37: CB G37: CG1 G37: CG2 G38: N G38: CA G38: C G38: O G38: CB G38: CG G38: CD G38: NE G38: CZ G38: NH1 G38: NH2 G39: N G39: CA G39: C G39: O G39: CB G39: CG G39: CD1 G39: CD2 G40: N G40: CA G40: C G40: O G40: CB G40: CG1 G40: CG2 G41: N G41: CA G41: C G41: O G41: CB G41: CG G41: CD G42: N G42: CA G42: C G42: O G43: N G43: CA G43: C G43: O G43: CB G43: CG G43: CD G43: CE G43: NZ G44: N G44: CA G44: C G44: O G45: N G45: CA G45: C G45: O G45: CB G45: CG G45: CD1 G45: CD2 G46: N G46: CA G46: C G46: O G46: CB G46: CG G46: CD G46: OE1 G46: OE2 G47: N G47: CA G47: C G47: O G47: CB G47: CG G47: CD1 G47: CD2 G47: NE1 G47: CE2 G47: CE3 G47: CZ2 G47: CZ3 G47: CH2 G48: N G48: CA G48: C G48: O G48: CB G48: CG G48: CD1 G48: CD2 G49: N G49: CA G49: C G49: O G50: N G50: CA G50: C G50: O G50: CB G50: CG G50: CD G50: NE G50: CZ G50: NH1 G50: NH2 G51: N G51: CA G51: C G51: O G51: CB G51: CG1 G51: CG2 G51: CD1 G52: N G52: CA G52: C G52: O G52: CB G52: CG G52: OD1 G52: ND2 G53: N G53: CA G53: C G53: O G53: CB G53: OG1 G53: CG2 G54: N G54: CA G54: C G54: O G54: CB G54: CG G54: OD1 G54: ND2 G55: N G55: CA G55: C G55: O G55: CB G56: N G56: CA G56: C G56: O G57: N G57: CA G57: C G57: O G57: CB G57: CG G57: CD1 G57: CD2 G58: N G58: CA G58: C G58: O G58: CB G58: CG G58: SD G58: CE G59: N G59: CA G59: C G59: O G59: CB G59: CG G59: CD1 G59: CD2 G59: CE1 G59: CE2 G59: CZ G59: OH G60: N G60: CA G60: C G60: O G60: CB G60: CG G60: CD1 G60: CD2 G61: N G61: CA G61: C G61: O G61: CB G61: OG G62: N G62: CA G62: C G62: O G62: CB G62: CG G62: ND1 G62: CD2 G62: CE1 G62: NE2 G63: N G63: CA G63: C G63: O G63: CB G63: CG G63: CD G63: CE G63: NZ G64: N G64: CA G64: C G64: O G64: CB G64: CG G64: CD1 G64: CD2 G64: CE1 G64: CE2 G64: CZ G65: N G65: CA G65: C G65: O G65: CB G65: CG G65: CD G65: OE1 G65: OE2 G66: N G66: CA G66: C G66: O G67: N G67: CA G67: C G67: O G67: CB G67: CG G67: CD G67: NE G67: CZ G67: NH1 G67: NH2 G68: N G68: CA G68: C G68: O G68: CB G68: CG G68: CD1 G68: CD2 G69: N G69: CA G69: C G69: O G69: CB G69: CG1 G69: CG2 G69: CD1 G70: N G70: CA G70: C G70: O G70: CB G70: CG G70: CD1 G70: CD2 G71: N G71: CA G71: C G71: O G71: CB G71: CG G71: CD G71: NE G71: CZ G71: NH1 G71: NH2 G72: N G72: CA G72: C G72: O G72: CB G72: CG G72: CD G72: NE G72: CZ G72: NH1 G72: NH2 G73: N G73: CA G73: C G73: O G73: CB G73: CG1 G73: CG2 G74: N G74: CA G74: C G74: O G74: CB G74: CG1 G74: CG2 G75: N G75: CA G75: C G75: O G75: CB G75: CG G75: OD1 G75: OD2 G76: N G76: CA G76: C G76: O G76: CB G76: CG G76: CD1 G76: CD2 G76: NE1 G76: CE2 G76: CE3 G76: CZ2 G76: CZ3 G76: CH2 G77: N G77: CA G77: C G77: O G77: CB G77: CG G77: CD G77: NE G77: CZ G77: NH1 G77: NH2 G78: N G78: CA G78: C G78: O G78: CB G78: OG1 G78: CG2 G79: N G79: CA G79: C G79: O G79: CB G79: CG G79: CD G80: N G80: CA G80: C G80: O G80: CB G80: OG G81: N G81: CA G81: C G81: O G81: CB G81: CG G81: CD1 G81: CD2 G82: N G82: CA G82: C G82: O G83: N G83: CA G83: C G83: O G83: CB G83: OG1 G83: CG2 G84: N G84: CA G84: C G84: O G84: CB G84: CG1 G84: CG2 G85: N G85: CA G85: C G85: O G85: CB G85: CG G85: OD1 G85: ND2 G86: N G86: CA G86: C G86: O G86: CB G86: CG G86: SD G86: CE G87: N G87: CA G87: C G87: O G87: CB G87: CG G87: CD G87: OE1 G87: OE2 G88: N G88: CA G88: C G88: O G88: CB G88: CG G88: CD1 G88: CD2 G89: N G89: CA G89: C G89: O G89: CB G89: CG G89: CD G89: NE G89: CZ G89: NH1 G89: NH2 G90: N G90: CA G90: C G90: O G90: CB G90: CG G90: OD1 G90: ND2 G91: N G91: CA G91: C G91: O G91: CB G91: CG1 G91: CG2 G92: N G92: CA G92: C G92: O G92: CB G92: CG G92: CD G92: NE G92: CZ G92: NH1 G92: NH2 G93: N G93: CA G93: C G93: O G93: CB G93: OG G94: N G94: CA G94: C G94: O G94: CB G94: CG G94: OD1 G94: OD2 G95: N G95: CA G95: C G95: O G95: CB G95: CG G95: OD1 G95: OD2 G96: N G96: CA G96: C G96: O G96: CB G96: OG G97: N G97: CA G97: C G97: O G97: CB G98: N G98: CA G98: C G98: O G98: CB G98: CG1 G98: CG2 G98: CD1 G99: N G99: CA G99: C G99: O G99: CB G99: CG G99: CD1 G99: CD2 G99: CE1 G99: CE2 G99: CZ G99: OH G100: N G100: CA G100: C G100: O G100: CB G100: CG G100: CD1 G100: CD2 G100: CE1 G100: CE2 G100: CZ G101: N G101: CA G101: C G101: O G101: CB G101: SG G102: N G102: CA G102: C G102: O G103: N G103: CA G103: C G103: O G103: CB G103: CG G103: CD G103: NE G103: CZ G103: NH1 G103: NH2 G104: N G104: CA G104: C G104: O G104: CB G104: CG1 G104: CG2 G105: N G105: CA G105: C G105: O G105: CB G105: CG1 G105: CG2 G106: N G106: CA G106: C G106: O G106: CB G106: CG G106: OD1 G106: OD2 G107: N G107: CA G107: C G107: O G108: N G108: CA G108: C G108: O G108: CB G108: CG G108: CD1 G108: CD2 G108: CE1 G108: CE2 G108: CZ G109: N G109: CA G109: C G109: O G109: CB G109: CG G109: OD1 G109: ND2 G110: N G110: CA G110: C G110: O G110: CB G111: N G111: CA G111: C G111: O G111: CB G112: N G112: CA G112: C G112: O G113: N G113: CA G113: C G113: O G113: CB G113: CG G113: CD G114: N G114: CA G114: C G114: O G114: CB G114: CG G114: CD1 G114: CD2 G115: N G115: CA G115: C G115: O G115: CB G115: CG G115: CD G115: OE1 G115: OE2 G116: N G116: CA G116: C G116: O G116: CB G116: CG G116: CD1 G116: CD2 G116: CE1 G116: CE2 G116: CZ G117: N G117: CA G117: C G117: O G117: CB G117: CG G117: CD1 G117: CD2 G117: NE1 G117: CE2 G117: CE3 G117: CZ2 G117: CZ3 G117: CH2 G118: N G118: CA G118: C G118: O G119: N G119: CA G119: C G119: O G119: CB G119: CG G119: CD G119: OE1 G119: NE2 G120: N G120: CA G120: C G120: O G121: N G121: CA G121: C G121: O G121: CB G121: OG G122: N G122: CA G122: C G122: O G122: CB G122: CG G122: CD G123: N G123: CA G123: C G123: O G123: CB G123: CG1 G123: CG2 G124: N G124: CA G124: C G124: O G124: CB G124: CG1 G124: CG2 G124: CD1 G125: N G125: CA G125: C G125: O G125: CB G125: CG1 G125: CG2 G126: N G126: CA G126: C G126: O G126: CB G126: OG G127: N G127: CA G127: C G127: O G127: CB G127: OG G129: N G129: CA G129: C G129: O G129: CB G130: N G130: CA G130: C G130: O G130: CB G130: OG G131: N G131: CA G131: C G131: O G131: CB G131: OG1 G131: CG2 G132: N G132: CA G132: C G132: O G132: CB G132: CG G132: CD G132: CE G132: NZ G133: N G133: CA G133: C G133: O G134: N G134: CA G134: C G134: O G134: CB G134: CG G134: CD G135: N G135: CA G135: C G135: O G135: CB G135: OG G136: N G136: CA G136: C G136: O G136: CB G136: CG1 G136: CG2 G137: N G137: CA G137: C G137: O G137: CB G137: CG G137: CD1 G137: CD2 G137: CE1 G137: CE2 G137: CZ G138: N G138: CA G138: C G138: O G138: CB G138: CG G138: CD G139: N G139: CA G139: C G139: O G139: CB G139: CG G139: CD1 G139: CD2 G140: N G140: CA G140: C G140: O G140: CB G141: N G141: CA G141: C G141: O G141: CB G141: CG G141: CD G142: N G142: CA G142: C G142: O G142: CB G142: OG G143: N G143: CA G143: C G143: O G143: CB G143: OG G144: N G144: CA G144: C G144: O G144: CB G144: CG G144: CD G144: CE G144: NZ G145: N G145: CA G145: C G145: O G145: CB G145: OG G146: N G146: CA G146: C G146: O G146: CB G146: OG1 G146: CG2 G147: N G147: CA G147: C G147: O G147: CB G147: OG G148: N G148: CA G148: C G148: O G149: N G149: CA G149: C G149: O G150: N G150: CA G150: C G150: O G150: CB G150: OG1 G150: CG2 G151: N G151: CA G151: C G151: O G151: CB G152: N G152: CA G152: C G152: O G152: CB G153: N G153: CA G153: C G153: O G153: CB G153: CG G153: CD1 G153: CD2 G154: N G154: CA G154: C G154: O G155: N G155: CA G155: C G155: O G155: CB G155: SG G156: N G156: CA G156: C G156: O G156: CB G156: CG G156: CD1 G156: CD2 G157: N G157: CA G157: C G157: O G157: CB G157: CG1 G157: CG2 G158: N G158: CA G158: C G158: O G158: CB G158: CG G158: CD G158: CE G158: NZ G159: N G159: CA G159: C G159: O G159: CB G159: CG G159: OD1 G159: OD2 G160: N G160: CA G160: C G160: O G160: CB G160: CG G160: CD1 G160: CD2 G160: CE1 G160: CE2 G160: CZ G160: OH G161: N G161: CA G161: C G161: O G161: CB G161: CG G161: CD1 G161: CD2 G161: CE1 G161: CE2 G161: CZ G162: N G162: CA G162: C G162: O G162: CB G162: CG G162: CD G163: N G163: CA G163: C G163: O G163: CB G163: CG G163: CD G163: OE1 G163: OE2 G164: N G164: CA G164: C G164: O G164: CB G164: CG G164: CD G165: N G165: CA G165: C G165: O G165: CB G165: CG1 G165: CG2 G166: N G166: CA G166: C G166: O G166: CB G166: OG1 G166: CG2 G167: N G167: CA G167: C G167: O G167: CB G167: CG1 G167: CG2 G168: N G168: CA G168: C G168: O G168: CB G168: OG G169: N G169: CA G169: C G169: O G169: CB G169: CG G169: CD1 G169: CD2 G169: NE1 G169: CE2 G169: CE3 G169: CZ2 G169: CZ3 G169: CH2 G170: N G170: CA G170: C G170: O G170: CB G170: CG G170: OD1 G170: ND2 G171: N G171: CA G171: C G171: O G171: CB G171: OG G172: N G172: CA G172: C G172: O G173: N G173: CA G173: C G173: O G173: CB G174: N G174: CA G174: C G174: O G174: CB G174: CG G174: CD1 G174: CD2 G175: N G175: CA G175: C G175: O G175: CB G175: OG1 G175: CG2 G176: N G176: CA G176: C G176: O G176: CB G176: OG G177: N G177: CA G177: C G177: O G178: N G178: CA G178: C G178: O G178: CB G178: CG1 G178: CG2 G179: N G179: CA G179: C G179: O G179: CB G179: CG G179: ND1 G179: CD2 G179: CE1 G179: NE2 G180: N G180: CA G180: C G180: O G180: CB G180: OG1 G180: CG2 G181: N G181: CA G181: C G181: O G181: CB G181: CG G181: CD1 G181: CD2 G181: CE1 G181: CE2 G181: CZ G182: N G182: CA G182: C G182: O G182: CB G182: CG G182: CD G183: N G183: CA G183: C G183: O G183: CB G184: N G184: CA G184: C G184: O G184: CB G184: CG1 G184: CG2 G185: N G185: CA G185: C G185: O G185: CB G185: CG G185: CD1 G185: CD2 G186: N G186: CA G186: C G186: O G186: CB G186: CG G186: CD G186: OE1 G186: NE2 G187: N G187: CA G187: C G187: O G187: CB G187: OG G188: N G188: CA G188: C G188: O G188: CB G188: OG G189: N G189: CA G189: C G189: O G190: N G190: CA G190: C G190: O G190: CB G190: CG G190: CD1 G190: CD2 G191: N G191: CA G191: C G191: O G191: CB G191: CG G191: CD1 G191: CD2 G191: CE1 G191: CE2 G191: CZ G191: OH G192: N G192: CA G192: C G192: O G192: CB G192: OG G193: N G193: CA G193: C G193: O G193: CB G193: CG G193: CD1 G193: CD2 G194: N G194: CA G194: C G194: O G194: CB G194: OG G195: N G195: CA G195: C G195: O G195: CB G195: OG G196: N G196: CA G196: C G196: O G196: CB G196: CG1 G196: CG2 G197: N G197: CA G197: C G197: O G197: CB G197: CG1 G197: CG2 G198: N G198: CA G198: C G198: O G198: CB G198: OG1 G198: CG2 G199: N G199: CA G199: C G199: O G199: CB G199: CG1 G199: CG2 G200: N G200: CA G200: C G200: O G200: CB G200: CG G200: CD G201: N G201: CA G201: C G201: O G201: CB G201: OG G202: N G202: CA G202: C G202: O G202: CB G202: OG G203: N G203: CA G203: C G203: O G203: CB G203: OG G204: N G204: CA G204: C G204: O G204: CB G204: CG G204: CD1 G204: CD2 G205: N G205: CA G205: C G205: O G206: N G206: CA G206: C G206: O G206: CB G206: OG1 G206: CG2 G207: N G207: CA G207: C G207: O G207: CB G207: CG G207: CD G207: OE1 G207: NE2 G208: N G208: CA G208: C G208: O G208: CB G208: OG1 G208: CG2 G209: N G209: CA G209: C G209: O G209: CB G209: CG G209: CD1 G209: CD2 G209: CE1 G209: CE2 G209: CZ G209: OH G210: N G210: CA G210: C G210: O G210: CB G210: CG1 G210: CG2 G210: CD1 G211: N G211: CA G211: C G211: O G211: CB G211: SG G212: N G212: CA G212: C G212: O G212: CB G212: CG G212: OD1 G212: ND2 G213: N G213: CA G213: C G213: O G213: CB G213: CG1 G213: CG2 G214: N G214: CA G214: C G214: O G214: CB G214: CG G214: OD1 G214: ND2 G215: N G215: CA G215: C G215: O G215: CB G215: CG G215: ND1 G215: CD2 G215: CE1 G215: NE2 G216: N G216: CA G216: C G216: O G216: CB G216: CG G216: CD G216: CE G216: NZ G217: N G217: CA G217: C G217: O G217: CB G217: CG G217: CD G218: N G218: CA G218: C G218: O G218: CB G218: OG G219: N G219: CA G219: C G219: O G219: CB G219: CG G219: OD1 G219: ND2 G220: N G220: CA G220: C G220: O G220: CB G220: OG1 G220: CG2 G221: N G221: CA G221: C G221: O G221: CB G221: CG G221: CD G221: CE G221: NZ G222: N G222: CA G222: C G222: O G222: CB G222: CG1 G222: CG2 G223: N G223: CA G223: C G223: O G223: CB G223: CG G223: OD1 G223: OD2 G224: N G224: CA G224: C G224: O G224: CB G224: CG G224: CD G224: CE G224: NZ G225: N G225: CA G225: C G225: O G225: CB G225: CG G225: CD G225: CE G225: NZ G226: N G226: CA G226: C G226: O G226: CB G226: CG1 G226: CG2 G227: N G227: CA G227: C G227: O G227: CB G227: CG G227: CD G227: OE1 G227: OE2 G228: N G228: CA G228: C G228: O G228: CB G228: CG G228: CD G229: N G229: CA G229: C G229: O G229: CB G229: CG G229: CD G229: CE G229: NZ G230: N G230: CA G230: C G230: O G230: CB G230: OG H1: N H1: CA H1: C H1: O H1: CB H1: CG H1: CD H1: OE1 H1: NE2 H2: N H2: CA H2: C H2: O H2: CB H2: CG1 H2: CG2 H3: N H3: CA H3: C H3: O H3: CB H3: CG1 H3: CG2 H4: N H4: CA H4: C H4: O H4: CB H4: CG H4: SD H4: CE H5: N H5: CA H5: C H5: O H5: CB H5: OG1 H5: CG2 H6: N H6: CA H6: C H6: O H6: CB H6: CG H6: CD H6: OE1 H6: NE2 H7: N H7: CA H7: C H7: O H7: CB H7: OG H8: N H8: CA H8: C H8: O H8: CB H8: CG H8: CD H9: N H9: CA H9: C H9: O H9: CB H10: N H10: CA H10: C H10: O H10: CB H10: OG1 H10: CG2 H11: N H11: CA H11: C H11: O H11: CB H11: CG H11: CD1 H11: CD2 H12: N H12: CA H12: C H12: O H12: CB H12: OG H13: N H13: CA H13: C H13: O H13: CB H13: CG H13: CD1 H13: CD2 H14: N H14: CA H14: C H14: O H14: CB H14: OG H15: N H15: CA H15: C H15: O H15: CB H15: CG H15: CD H16: N H16: CA H16: C H16: O H17: N H17: CA H17: C H17: O H17: CB H17: CG H17: CD H17: OE1 H17: OE2 H18: N H18: CA H18: C H18: O H18: CB H18: OG1 H18: CG2 H19: N H19: CA H19: C H19: O H19: CB H20: N H20: CA H20: C H20: O H20: CB H21: N H21: CA H21: C H21: O H21: CB H21: CG1 H21: CG2 H22: N H22: CA H22: C H22: O H22: CB H22: OG H23: N H23: CA H23: C H23: O H23: CB H23: SG H24: N H24: CA H24: C H24: O H24: CB H24: CG H24: CD H24: NE H24: CZ H24: NH1 H24: NH2 H25: N H25: CA H25: C H25: O H25: CB H26: N H26: CA H26: C H26: O H26: CB H26: OG H27: N H27: CA H27: C H27: O H27: CB H27: CG H27: CD H27: OE1 H27: NE2 H28: N H28: CA H28: C H28: O H28: CB H28: CG H28: CD1 H28: CD2 H28: CE1 H28: CE2 H28: CZ H28: OH H29: N H29: CA H29: C H29: O H29: CB H29: CG1 H29: CG2 H30: N H30: CA H30: C H30: O H30: CB H30: CG H30: OD1 H30: OD2 H31: N H31: CA H31: C H31: O H31: CB H31: CG H31: CD H31: NE H31: CZ H31: NH1 H31: NH2 H32: N H32: CA H32: C H32: O H32: CB H32: OG H33: N H33: CA H33: C H33: O H33: CB H33: CG1 H33: CG2 H33: CD1 H34: N H34: CA H34: C H34: O H34: CB H34: OG H35: N H35: CA H35: C H35: O H35: CB H35: CG H35: CD1 H35: CD2 H35: NE1 H35: CE2 H35: CE3 H35: CZ2 H35: CZ3 H35: CH2 H36: N H36: CA H36: C H36: O H36: CB H36: CG H36: CD1 H36: CD2 H36: CE1 H36: CE2 H36: CZ H36: OH H37: N H37: CA H37: C H37: O H37: CB H37: CG H37: CD H37: OE1 H37: NE2 H38: N H38: CA H38: C H38: O H38: CB H38: CG H38: CD1 H38: CD2 H39: N H39: CA H39: C H39: O H39: CB H39: CG H39: CD H39: CE H39: NZ H40: N H40: CA H40: C H40: O H40: CB H40: OG1 H40: CG2 H41: N H41: CA H41: C H41: O H42: N H42: CA H42: C H42: O H42: CB H42: CG H42: CD H42: NE H42: CZ H42: NH1 H42: NH2 H43: N H43: CA H43: C H43: O H43: CB H44: N H44: CA H44: C H44: O H44: CB H44: CG H44: CD H45: N H45: CA H45: C H45: O H45: CB H45: CG H45: CD H45: NE H45: CZ H45: NH1 H45: NH2 H46: N H46: CA H46: C H46: O H46: CB H46: CG H46: CD1 H46: CD2 H47: N H47: CA H47: C H47: O H47: CB H47: CG H47: CD1 H47: CD2 H48: N H48: CA H48: C H48: O H48: CB H48: CG1 H48: CG2 H49: N H49: CA H49: C H49: O H49: CB H49: CG H49: CD1 H49: CD2 H49: CE1 H49: CE2 H49: CZ H49: OH H50: N H50: CA H50: C H50: O H50: CB H51: N H51: CA H51: C H51: O H51: CB H52: N H52: CA H52: C H52: O H52: CB H52: OG H53: N H53: CA H53: C H53: O H53: CB H53: OG H54: N H54: CA H54: C H54: O H54: CB H54: CG H54: CD H54: NE H54: CZ H54: NH1 H54: NH2 H55: N H55: CA H55: C H55: O H55: CB H55: OG H56: N H56: CA H56: C H56: O H56: CB H56: CG1 H56: CG2 H56: CD1 H57: N H57: CA H57: C H57: O H58: N H58: CA H58: C H58: O H58: CB H58: CG1 H58: CG2 H59: N H59: CA H59: C H59: O H59: CB H59: CG H59: CD H60: N H60: CA H60: C H60: O H60: CB H60: CG H60: OD1 H60: OD2 H61: N H61: CA H61: C H61: O H61: CB H61: CG H61: CD H61: NE H61: CZ H61: NH1 H61: NH2 H62: N H62: CA H62: C H62: O H62: CB H62: CG H62: CD1 H62: CD2 H62: CE1 H62: CE2 H62: CZ H63: N H63: CA H63: C H63: O H63: CB H63: OG H64: N H64: CA H64: C H64: O H65: N H65: CA H65: C H65: O H65: CB H65: OG H66: N H66: CA H66: C H66: O H67: N H67: CA H67: C H67: O H67: CB H67: OG H68: N H68: CA H68: C H68: O H69: N H69: CA H69: C H69: O H69: CB H69: CG H69: CD H69: NE H69: CZ H69: NH1 H69: NH2 H70: N H70: CA H70: C H70: O H70: CB H70: CG H70: OD1 H70: OD2 H71: N H71: CA H71: C H71: O H71: CB H71: CG H71: CD1 H71: CD2 H71: CE1 H71: CE2 H71: CZ H72: N H72: CA H72: C H72: O H72: CB H72: OG1 H72: CG2 H73: N H73: CA H73: C H73: O H73: CB H73: CG H73: CD1 H73: CD2 H74: N H74: CA H74: C H74: O H74: CB H74: OG1 H74: CG2 H75: N H75: CA H75: C H75: O H75: CB H75: CG1 H75: CG2 H75: CD1 H76: N H76: CA H76: C H76: O H76: CB H76: CG H76: CD H76: NE H76: CZ H76: NH1 H76: NH2 H77: N H77: CA H77: C H77: O H78: N H78: CA H78: C H78: O H78: CB H78: CG1 H78: CG2 H79: N H79: CA H79: C H79: O H79: CB H79: CG H79: CD H79: OE1 H79: NE2 H80: N H80: CA H80: C H80: O H80: CB H80: OG H81: N H81: CA H81: C H81: O H81: CB H81: CG H81: OD1 H81: OD2 H82: N H82: CA H82: C H82: O H82: CB H82: CG H82: OD1 H82: OD2 H83: N H83: CA H83: C H83: O H83: CB H83: CG H83: CD1 H83: CD2 H83: CE1 H83: CE2 H83: CZ H84: N H84: CA H84: C H84: O H84: CB H85: N H85: CA H85: C H85: O H85: CB H85: CG H85: CD1 H85: CD2 H86: N H86: CA H86: C H86: O H86: CB H86: CG H86: CD1 H86: CD2 H86: CE1 H86: CE2 H86: CZ H86: OH H87: N H87: CA H87: C H87: O H87: CB H87: CG H87: CD1 H87: CD2 H87: CE1 H87: CE2 H87: CZ H87: OH H88: N H88: CA H88: C H88: O H88: CB H88: SG H89: N H89: CA H89: C H89: O H89: CB H89: CG H89: CD H89: OE1 H89: NE2 H90: N H90: CA H90: C H90: O H90: CB H90: CG H90: CD H90: OE1 H90: NE2 H91: N H91: CA H91: C H91: O H91: CB H91: CG H91: OD1 H91: OD2 H92: N H92: CA H92: C H92: O H92: CB H92: CG H92: CD1 H92: CD2 H92: CE1 H92: CE2 H92: CZ H92: OH H93: N H93: CA H93: C H93: O H93: CB H93: CG H93: CD1 H93: CD2 H93: CE1 H93: CE2 H93: CZ H93: OH H94: N H94: CA H94: C H94: O H94: CB H94: CG H94: CD1 H94: CD2 H94: NE1 H94: CE2 H94: CE3 H94: CZ2 H94: CZ3 H94: CH2 H95: N H95: CA H95: C H95: O H95: CB H95: CG H95: CD H96: N H96: CA H96: C H96: O H96: CB H96: CG1 H96: CG2 H97: N H97: CA H97: C H97: O H97: CB H97: OG1 H97: CG2 H98: N H98: CA H98: C H98: O H98: CB H98: CG H98: CD1 H98: CD2 H98: CE1 H98: CE2 H98: CZ H99: N H99: CA H99: C H99: O H100: N H100: CA H100: C H100: O H100: CB H100: CG H100: CD H100: OE1 H100: NE2 H101: N H101: CA H101: C H101: O H102: N H102: CA H102: C H102: O H102: CB H102: OG1 H102: CG2 H103: N H103: CA H103: C H103: O H103: CB H103: CG H103: CD H103: NE H103: CZ H103: NH1 H103: NH2 H104: N H104: CA H104: C H104: O H104: CB H104: CG H104: CD1 H104: CD2 H105: N H105: CA H105: C H105: O H105: CB H105: CG H105: OD1 H105: OD2 H106: N H106: CA H106: C H106: O H106: CB H106: CG H106: SD H106: CE H107: N H107: CA H107: C H107: O H107: CB H107: CG H107: CD H107: CE H107: NZ H108: N H108: CA H108: C H108: O H108: CB H108: CG H108: CD H108: NE H108: CZ H108: NH1 H108: NH2 H109: N H109: CA H109: C H109: O H109: CB H109: OG1 H109: CG2 H110: N H110: CA H110: C H110: O H110: CB H110: CG1 H110: CG2 H111: N H111: CA H111: C H111: O H111: CB H112: N H112: CA H112: C H112: O H112: CB H113: N H113: CA H113: C H113: O H113: CB H113: CG H113: CD H114: N H114: CA H114: C H114: O H114: CB H114: OG H115: N H115: CA H115: C H115: O H115: CB H115: CG1 H115: CG2 H116: N H116: CA H116: C H116: O H116: CB H116: CG H116: CD1 H116: CD2 H116: CE1 H116: CE2 H116: CZ H117: N H117: CA H117: C H117: O H117: CB H117: CG1 H117: CG2 H117: CD1 H118: N H118: CA H118: C H118: O H118: CB H118: CG H118: CD1 H118: CD2 H118: CE1 H118: CE2 H118: CZ H119: N H119: CA H119: C H119: O H119: CB H119: CG H119: CD H120: N H120: CA H120: C H120: O H120: CB H120: CG H120: CD H121: N H121: CA H121: C H121: O H121: CB H121: OG H122: N H122: CA H122: C H122: O H122: CB H122: CG H122: OD1 H122: OD2 H123: N H123: CA H123: C H123: O H123: CB H123: CG H123: CD H123: OE1 H123: OE2 H124: N H124: CA H124: C H124: O H124: CB H124: CG H124: CD H124: OE1 H124: NE2 H125: N H125: CA H125: C H125: O H125: CB H125: CG H125: CD1 H125: CD2 H126: N H126: CA H126: C H126: O H126: CB H126: CG H126: CD H126: CE H126: NZ H127: N H127: CA H127: C H127: O H127: CB H127: OG H128: N H128: CA H128: C H128: O H129: N H129: CA H129: C H129: O H129: CB H129: OG1 H129: CG2 H130: N H130: CA H130: C H130: O H130: CB H131: N H131: CA H131: C H131: O H131: CB H131: OG H132: N H132: CA H132: C H132: O H132: CB H132: CG1 H132: CG2 H133: N H133: CA H133: C H133: O H133: CB H133: CG1 H133: CG2 H134: N H134: CA H134: C H134: O H134: CB H134: SG H135: N H135: CA H135: C H135: O H135: CB H135: CG H135: CD1 H135: CD2 H136: N H136: CA H136: C H136: O H136: CB H136: CG H136: CD1 H136: CD2 H137: N H137: CA H137: C H137: O H137: CB H137: CG H137: OD1 H137: ND2 H138: N H138: CA H138: C H138: O H138: CB H138: CG H138: OD1 H138: ND2 H139: N H139: CA H139: C H139: O H139: CB H139: CG H139: CD1 H139: CD2 H139: CE1 H139: CE2 H139: CZ H140: N H140: CA H140: C H140: O H140: CB H140: CG H140: CD1 H140: CD2 H140: CE1 H140: CE2 H140: CZ H140: OH H141: N H141: CA H141: C H141: O H141: CB H141: CG H141: CD H142: N H142: CA H142: C H142: O H142: CB H142: CG H142: CD H142: NE H142: CZ H142: NH1 H142: NH2 H143: N H143: CA H143: C H143: O H143: CB H143: CG H143: CD H143: OE1 H143: OE2 H144: N H144: CA H144: C H144: O H144: CB H145: N H145: CA H145: C H145: O H145: CB H145: CG H145: CD H145: CE H145: NZ H146: N H146: CA H146: C H146: O H146: CB H146: CG1 H146: CG2 H147: N H147: CA H147: C H147: O H147: CB H147: CG H147: CD H147: OE1 H147: NE2 H148: N H148: CA H148: C H148: O H148: CB H148: CG H148: CD1 H148: CD2 H148: NE1 H148: CE2 H148: CE3 H148: CZ2 H148: CZ3 H148: CH2 H149: N H149: CA H149: C H149: O H149: CB H149: CG H149: CD H149: CE H149: NZ H150: N H150: CA H150: C H150: O H150: CB H150: CG1 H150: CG2 H151: N H151: CA H151: C H151: O H151: CB H151: CG H151: OD1 H151: OD2 H152: N H152: CA H152: C H152: O H152: CB H152: CG H152: OD1 H152: ND2 H153: N H153: CA H153: C H153: O H153: CB H154: N H154: CA H154: C H154: O H154: CB H154: CG H154: CD1 H154: CD2 H155: N H155: CA H155: C H155: O H155: CB H155: CG H155: CD H155: OE1 H155: NE2 H156: N H156: CA H156: C H156: O H156: CB H156: OG H157: N H157: CA H157: C H157: O H158: N H158: CA H158: C H158: O H158: CB H158: CG H158: OD1 H158: ND2 H159: N H159: CA H159: C H159: O H159: CB H159: OG H160: N H160: CA H160: C H160: O H160: CB H160: CG H160: CD H160: OE1 H160: NE2 H161: N H161: CA H161: C H161: O H161: CB H161: CG H161: CD H161: OE1 H161: OE2 H162: N H162: CA H162: C H162: O H162: CB H162: OG H163: N H163: CA H163: C H163: O H163: CB H163: CG1 H163: CG2 H164: N H164: CA H164: C H164: O H164: CB H164: OG1 H164: CG2 H165: N H165: CA H165: C H165: O H165: CB H165: CG H165: CD H165: OE1 H165: OE2 H166: N H166: CA H166: C H166: O H166: CB H166: CG H166: CD H166: OE1 H166: NE2 H167: N H167: CA H167: C H167: O H167: CB H167: CG H167: OD1 H167: OD2 H168: N H168: CA H168: C H168: O H168: CB H168: OG H169: N H169: CA H169: C H169: O H169: CB H169: CG H169: CD H169: CE H169: NZ H170: N H170: CA H170: C H170: O H170: CB H170: CG H170: OD1 H170: OD2 H171: N H171: CA H171: C H171: O H171: CB H171: OG H172: N H172: CA H172: C H172: O H172: CB H172: OG1 H172: CG2 H173: N H173: CA H173: C H173: O H173: CB H173: CG H173: CD1 H173: CD2 H173: CE1 H173: CE2 H173: CZ H173: OH H174: N H174: CA H174: C H174: O H174: CB H174: OG H175: N H175: CA H175: C H175: O H175: CB H175: CG H175: CD1 H175: CD2 H176: N H176: CA H176: C H176: O H176: CB H176: OG H177: N H177: CA H177: C H177: O H177: CB H177: OG H178: N H178: CA H178: C H178: O H178: CB H178: OG1 H178: CG2 H179: N H179: CA H179: C H179: O H179: CB H179: CG H179: CD1 H179: CD2 H180: N H180: CA H180: C H180: O H180: CB H180: OG1 H180: CG2 H181: N H181: CA H181: C H181: O H181: CB H181: CG H181: CD1 H181: CD2 H182: N H182: CA H182: C H182: O H182: CB H182: OG H183: N H183: CA H183: C H183: O H183: CB H183: CG H183: CD H183: CE H183: NZ H184: N H184: CA H184: C H184: O H184: CB H185: N H185: CA H185: C H185: O H185: CB H185: CG H185: OD1 H185: OD2 H186: N H186: CA H186: C H186: O H186: CB H186: CG H186: CD1 H186: CD2 H186: CE1 H186: CE2 H186: CZ H186: OH H187: N H187: CA H187: C H187: O H187: CB H187: CG H187: CD H187: OE1 H187: OE2 H188: N H188: CA H188: C H188: O H188: CB H188: CG H188: CD H188: CE H188: NZ H189: N H189: CA H189: C H189: O H189: CB H189: CG H189: ND1 H189: CD2 H189: CE1 H189: NE2 H190: N H190: CA H190: C H190: O H190: CB H190: CG H190: CD H190: CE H190: NZ H191: N H191: CA H191: C H191: O H191: CB H191: CG1 H191: CG2 H192: N H192: CA H192: C H192: O H192: CB H192: CG H192: CD1 H192: CD2 H192: CE1 H192: CE2 H192: CZ H192: OH H193: N H193: CA H193: C H193: O H193: CB H194: N H194: CA H194: C H194: O H194: CB H194: SG H195: N H195: CA H195: C H195: O H195: CB H195: CG H195: CD H195: OE1 H195: OE2 H196: N H196: CA H196: C H196: O H196: CB H196: CG1 H196: CG2 H197: N H197: CA H197: C H197: O H197: CB H197: OG1 H197: CG2 H198: N H198: CA H198: C H198: O H198: CB H198: CG H198: ND1 H198: CD2 H198: CE1 H198: NE2 H199: N H199: CA H199: C H199: O H199: CB H199: CG H199: CD H199: OE1 H199: NE2 H200: N H200: CA H200: C H200: O H201: N H201: CA H201: C H201: O H201: CB H201: CG H201: CD1 H201: CD2 H202: N H202: CA H202: C H202: O H202: CB H202: OG H203: N H203: CA H203: C H203: O H203: CB H203: OG H204: N H204: CA H204: C H204: O H204: CB H204: CG H204: CD H205: N H205: CA H205: C H205: O H205: CB H205: CG1 H205: CG2 H206: N H206: CA H206: C H206: O H206: CB H206: OG1 H206: CG2 H207: N H207: CA H207: C H207: O H207: CB H207: CG H207: CD H207: CE H207: NZ H208: N H208: CA H208: C H208: O H208: CB H208: OG H209: N H209: CA H209: C H209: O H209: CB H209: CG H209: CD1 H209: CD2 H209: CE1 H209: CE2 H209: CZ H210: N H210: CA H210: C H210: O H210: CB H210: CG H210: OD1 H210: ND2 H211: N H211: CA H211: C H211: O H211: CB H211: CG H211: CD H211: NE H211: CZ H211: NH1 H211: NH2 H212: N H212: CA H212: C H212: O H213: N H213: CA H213: C H213: O H213: CB H213: CG H213: CD H213: OE1 H213: OE2 H214: N H214: CA H214: C H214: O H214: CB H214: SG K1: N K1: CA K1: C K1: O K1: CB K1: CG K1: CD K1: OE1 K1: NE2 K2: N K2: CA K2: C K2: O K2: CB K2: CG1 K2: CG2 K3: N K3: CA K3: C K3: O K3: CB K3: CG K3: CD K3: OE1 K3: NE2 K4: N K4: CA K4: C K4: O K4: CB K4: CG K4: CD1 K4: CD2 K5: N K5: CA K5: C K5: O K5: CB K5: CG1 K5: CG2 K5: CD1 K6: N K6: CA K6: C K6: O K6: CB K6: CG K6: CD K6: OE1 K6: NE2 K7: N K7: CA K7: C K7: O K7: CB K7: OG K8: N K8: CA K8: C K8: O K9: N K9: CA K9: C K9: O K9: CB K9: CG K9: CD K10: N K10: CA K10: C K10: O K10: CB K10: CG K10: CD K10: OE1 K10: NE2 K11: N K11: CA K11: C K11: O K11: CB K11: CG K11: CD1 K11: CD2 K11: CE1 K11: CE2 K11: CZ K12: N K12: CA K12: C K12: O K12: CB K12: CG K12: CD K12: CE K12: NZ K13: N K13: CA K13: C K13: O K13: CB K13: OG1 K13: CG2 K14: N K14: CA K14: C K14: O K14: CB K14: CG K14: CD K15: N K15: CA K15: C K15: O K16: N K16: CA K16: C K16: O K16: CB K17: N K17: CA K17: C K17: O K17: CB K17: OG K18: N K18: CA K18: C K18: O K18: CB K18: CG1 K18: CG2 K19: N K19: CA K19: C K19: O K19: CB K19: OG1 K19: CG2 K20: N K20: CA K20: C K20: O K20: CB K20: CG1 K20: CG2 K21: N K21: CA K21: C K21: O K21: CB K21: OG K22: N K22: CA K22: C K22: O K22: CB K22: SG K23: N K23: CA K23: C K23: O K23: CB K23: CG K23: CD K23: CE K23: NZ K24: N K24: CA K24: C K24: O K24: CB K25: N K25: CA K25: C K25: O K25: CB K25: OG K26: N K26: CA K26: C K26: O K27: N K27: CA K27: C K27: O K27: CB K27: CG K27: CD1 K27: CD2 K27: CE1 K27: CE2 K27: CZ K27: OH K28: N K28: CA K28: C K28: O K28: CB K28: CG1 K28: CG2 K28: CD1 K29: N K29: CA K29: C K29: O K29: CB K29: CG K29: CD1 K29: CD2 K29: CE1 K29: CE2 K29: CZ K30: N K30: CA K30: C K30: O K30: CB K30: OG1 K30: CG2 K31: N K31: CA K31: C K31: O K31: CB K31: CG K31: OD1 K31: OD2 K32: N K32: CA K32: C K32: O K32: CB K32: CG K32: CD1 K32: CD2 K32: CE1 K32: CE2 K32: CZ K32: OH K33: N K33: CA K33: C K33: O K33: CB K33: CG K33: CD1 K33: CD2 K34: N K34: CA K34: C K34: O K34: CB K34: CG1 K34: CG2 K34: CD1 K35: N K35: CA K35: C K35: O K35: CB K35: CG K35: ND1 K35: CD2 K35: CE1 K35: NE2 K36: N K36: CA K36: C K36: O K36: CB K36: CG K36: CD1 K36: CD2 K36: NE1 K36: CE2 K36: CE3 K36: CZ2 K36: CZ3 K36: CH2 K37: N K37: CA K37: C K37: O K37: CB K37: CG1 K37: CG2 K38: N K38: CA K38: C K38: O K38: CB K38: CG K38: CD K38: NE K38: CZ K38: NH1 K38: NH2 K39: N K39: CA K39: C K39: O K39: CB K39: CG K39: CD1 K39: CD2 K40: N K40: CA K40: C K40: O K40: CB K40: CG1 K40: CG2 K41: N K41: CA K41: C K41: O K41: CB K41: CG K41: CD K42: N K42: CA K42: C K42: O K43: N K43: CA K43: C K43: O K43: CB K43: CG K43: CD K43: CE K43: NZ K44: N K44: CA K44: C K44: O K45: N K45: CA K45: C K45: O K45: CB K45: CG K45: CD1 K45: CD2 K46: N K46: CA K46: C K46: O K46: CB K46: CG K46: CD K46: OE1 K46: OE2 K47: N K47: CA K47: C K47: O K47: CB K47: CG K47: CD1 K47: CD2 K47: NE1 K47: CE2 K47: CE3 K47: CZ2 K47: CZ3 K47: CH2 K48: N K48: CA K48: C K48: O K48: CB K48: CG K48: CD1 K48: CD2 K49: N K49: CA K49: C K49: O K50: N K50: CA K50: C K50: O K50: CB K50: CG K50: CD K50: NE K50: CZ K50: NH1 K50: NH2 K51: N K51: CA K51: C K51: O K51: CB K51: CG1 K51: CG2 K51: CD1 K52: N K52: CA K52: C K52: O K52: CB K52: CG K52: OD1 K52: ND2 K53: N K53: CA K53: C K53: O K53: CB K53: OG1 K53: CG2 K54: N K54: CA K54: C K54: O K54: CB K54: CG K54: OD1 K54: ND2 K55: N K55: CA K55: C K55: O K55: CB K56: N K56: CA K56: C K56: O K57: N K57: CA K57: C K57: O K57: CB K57: CG K57: CD1 K57: CD2 K58: N K58: CA K58: C K58: O K58: CB K58: CG K58: SD K58: CE K59: N K59: CA K59: C K59: O K59: CB K59: CG K59: CD1 K59: CD2 K59: CE1 K59: CE2 K59: CZ K59: OH K60: N K60: CA K60: C K60: O K60: CB K60: CG K60: CD1 K60: CD2 K61: N K61: CA K61: C K61: O K61: CB K61: OG K62: N K62: CA K62: C K62: O K62: CB K62: CG K62: ND1 K62: CD2 K62: CE1 K62: NE2 K63: N K63: CA K63: C K63: O K63: CB K63: CG K63: CD K63: CE K63: NZ K64: N K64: CA K64: C K64: O K64: CB K64: CG K64: CD1 K64: CD2 K64: CE1 K64: CE2 K64: CZ K65: N K65: CA K65: C K65: O K65: CB K65: CG K65: CD K65: OE1 K65: OE2 K66: N K66: CA K66: C K66: O K67: N K67: CA K67: C K67: O K67: CB K67: CG K67: CD K67: NE K67: CZ K67: NH1 K67: NH2 K68: N K68: CA K68: C K68: O K68: CB K68: CG K68: CD1 K68: CD2 K69: N K69: CA K69: C K69: O K69: CB K69: CG1 K69: CG2 K69: CD1 K70: N K70: CA K70: C K70: O K70: CB K70: CG K70: CD1 K70: CD2 K71: N K71: CA K71: C K71: O K71: CB K71: CG K71: CD K71: NE K71: CZ K71: NH1 K71: NH2 K72: N K72: CA K72: C K72: O K72: CB K72: CG K72: CD K72: NE K72: CZ K72: NH1 K72: NH2 K73: N K73: CA K73: C K73: O K73: CB K73: CG1 K73: CG2 K74: N K74: CA K74: C K74: O K74: CB K74: CG1 K74: CG2 K75: N K75: CA K75: C K75: O K75: CB K75: CG K75: OD1 K75: OD2 K76: N K76: CA K76: C K76: O K76: CB K76: CG K76: CD1 K76: CD2 K76: NE1 K76: CE2 K76: CE3 K76: CZ2 K76: CZ3 K76: CH2 K77: N K77: CA K77: C K77: O K77: CB K77: CG K77: CD K77: NE K77: CZ K77: NH1 K77: NH2 K78: N K78: CA K78: C K78: O K78: CB K78: OG1 K78: CG2 K79: N K79: CA K79: C K79: O K79: CB K79: CG K79: CD K80: N K80: CA K80: C K80: O K80: CB K80: OG K81: N K81: CA K81: C K81: O K81: CB K81: CG K81: CD1 K81: CD2 K82: N K82: CA K82: C K82: O K83: N K83: CA K83: C K83: O K83: CB K83: OG1 K83: CG2 K84: N K84: CA K84: C K84: O K84: CB K84: CG1 K84: CG2 K85: N K85: CA K85: C K85: O K85: CB K85: CG K85: OD1 K85: ND2 K86: N K86: CA K86: C K86: O K86: CB K86: CG K86: SD K86: CE K87: N K87: CA K87: C K87: O K87: CB K87: CG K87: CD K87: OE1 K87: OE2 K88: N K88: CA K88: C K88: O K88: CB K88: CG K88: CD1 K88: CD2 K89: N K89: CA K89: C K89: O K89: CB K89: CG K89: CD K89: NE K89: CZ K89: NH1 K89: NH2 K90: N K90: CA K90: C K90: O K90: CB K90: CG K90: OD1 K90: ND2 K91: N K91: CA K91: C K91: O K91: CB K91: CG1 K91: CG2 K92: N K92: CA K92: C K92: O K92: CB K92: CG K92: CD K92: NE K92: CZ K92: NH1 K92: NH2 K93: N K93: CA K93: C K93: O K93: CB K93: OG K94: N K94: CA K94: C K94: O K94: CB K94: CG K94: OD1 K94: OD2 K95: N K95: CA K95: C K95: O K95: CB K95: CG K95: OD1 K95: OD2 K96: N K96: CA K96: C K96: O K96: CB K96: OG K97: N K97: CA K97: C K97: O K97: CB K98: N K98: CA K98: C K98: O K98: CB K98: CG1 K98: CG2 K98: CD1 K99: N K99: CA K99: C K99: O K99: CB K99: CG K99: CD1 K99: CD2 K99: CE1 K99: CE2 K99: CZ K99: OH K100: N K100: CA K100: C K100: O K100: CB K100: CG K100: CD1 K100: CD2 K100: CE1 K100: CE2 K100: CZ K101: N K101: CA K101: C K101: O K101: CB K101: SG K102: N K102: CA K102: C K102: O K103: N K103: CA K103: C K103: O K103: CB K103: CG K103: CD K103: NE K103: CZ K103: NH1 K103: NH2 K104: N K104: CA K104: C K104: O K104: CB K104: CG1 K104: CG2 K105: N K105: CA K105: C K105: O K105: CB K105: CG1 K105: CG2 K106: N K106: CA K106: C K106: O K106: CB K106: CG K106: OD1 K106: OD2 K107: N K107: CA K107: C K107: O K108: N K108: CA K108: C K108: O K108: CB K108: CG K108: CD1 K108: CD2 K108: CE1 K108: CE2 K108: CZ K109: N K109: CA K109: C K109: O K109: CB K109: CG K109: OD1 K109: ND2 K110: N K110: CA K110: C K110: O K110: CB K111: N K111: CA K111: C K111: O K111: CB K112: N K112: CA K112: C K112: O K113: N K113: CA K113: C K113: O K113: CB K113: CG K113: CD K114: N K114: CA K114: C K114: O K114: CB K114: CG K114: CD1 K114: CD2 K115: N K115: CA K115: C K115: O K115: CB K115: CG K115: CD K115: OE1 K115: OE2 K116: N K116: CA K116: C K116: O K116: CB K116: CG K116: CD1 K116: CD2 K116: CE1 K116: CE2 K116: CZ K117: N K117: CA K117: C K117: O K117: CB K117: CG K117: CD1 K117: CD2 K117: NE1 K117: CE2 K117: CE3 K117: CZ2 K117: CZ3 K117: CH2 K118: N K118: CA K118: C K118: O K119: N K119: CA K119: C K119: O K119: CB K119: CG K119: CD K119: OE1 K119: NE2 K120: N K120: CA K120: C K120: O K121: N K121: CA K121: C K121: O K121: CB K121: OG K122: N K122: CA K122: C K122: O K122: CB K122: CG K122: CD K123: N K123: CA K123: C K123: O K123: CB K123: CG1 K123: CG2 K124: N K124: CA K124: C K124: O K124: CB K124: CG1 K124: CG2 K124: CD1 K125: N K125: CA K125: C K125: O K125: CB K125: CG1 K125: CG2 K126: N K126: CA K126: C K126: O K126: CB K126: OG K127: N K127: CA K127: C K127: O K127: CB K127: OG K129: N K129: CA K129: C K129: O K129: CB K130: N K130: CA K130: C K130: O K130: CB K130: OG K131: N K131: CA K131: C K131: O K131: CB K131: OG1 K131: CG2 K132: N K132: CA K132: C K132: O K132: CB K132: CG K132: CD K132: CE K132: NZ K133: N K133: CA K133: C K133: O K134: N K134: CA K134: C K134: O K134: CB K134: CG K134: CD K135: N K135: CA K135: C K135: O K135: CB K135: OG K136: N K136: CA K136: C K136: O K136: CB K136: CG1 K136: CG2 K137: N K137: CA K137: C K137: O K137: CB K137: CG K137: CD1 K137: CD2 K137: CE1 K137: CE2 K137: CZ K138: N K138: CA K138: C K138: O K138: CB K138: CG K138: CD K139: N K139: CA K139: C K139: O K139: CB K139: CG K139: CD1 K139: CD2 K140: N K140: CA K140: C K140: O K140: CB K141: N K141: CA K141: C K141: O K141: CB K141: CG K141: CD K142: N K142: CA K142: C K142: O K142: CB K142: OG K143: N K143: CA K143: C K143: O K143: CB K143: OG K144: N K144: CA K144: C K144: O K144: CB K144: CG K144: CD K144: CE K144: NZ K145: N K145: CA K145: C K145: O K145: CB K145: OG K146: N K146: CA K146: C K146: O K146: CB K146: OG1 K146: CG2 K147: N K147: CA K147: C K147: O K147: CB K147: OG K148: N K148: CA K148: C K148: O K149: N K149: CA K149: C K149: O K150: N K150: CA K150: C K150: O K150: CB K150: OG1 K150: CG2 K151: N K151: CA K151: C K151: O K151: CB K152: N K152: CA K152: C K152: O K152: CB K153: N K153: CA K153: C K153: O K153: CB K153: CG K153: CD1 K153: CD2 K154: N K154: CA K154: C K154: O K155: N K155: CA K155: C K155: O K155: CB K155: SG K156: N K156: CA K156: C K156: O K156: CB K156: CG K156: CD1 K156: CD2 K157: N K157: CA K157: C K157: O K157: CB K157: CG1 K157: CG2 K158: N K158: CA K158: C K158: O K158: CB K158: CG K158: CD K158: CE K158: NZ K159: N K159: CA K159: C K159: O K159: CB K159: CG K159: OD1 K159: OD2 K160: N K160: CA K160: C K160: O K160: CB K160: CG K160: CD1 K160: CD2 K160: CE1 K160: CE2 K160: CZ K160: OH K161: N K161: CA K161: C K161: O K161: CB K161: CG K161: CD1 K161: CD2 K161: CE1 K161: CE2 K161: CZ K162: N K162: CA K162: C K162: O K162: CB K162: CG K162: CD K163: N K163: CA K163: C K163: O K163: CB K163: CG K163: CD K163: OE1 K163: OE2 K164: N K164: CA K164: C K164: O K164: CB K164: CG K164: CD K165: N K165: CA K165: C K165: O K165: CB K165: CG1 K165: CG2 K166: N K166: CA K166: C K166: O K166: CB K166: OG1 K166: CG2 K167: N K167: CA K167: C K167: O K167: CB K167: CG1 K167: CG2 K168: N K168: CA K168: C K168: O K168: CB K168: OG K169: N K169: CA K169: C K169: O K169: CB K169: CG K169: CD1 K169: CD2 K169: NE1 K169: CE2 K169: CE3 K169: CZ2 K169: CZ3 K169: CH2 K170: N K170: CA K170: C K170: O K170: CB K170: CG K170: OD1 K170: ND2 K171: N K171: CA K171: C K171: O K171: CB K171: OG K172: N K172: CA K172: C K172: O K173: N K173: CA K173: C K173: O K173: CB K174: N K174: CA K174: C K174: O K174: CB K174: CG K174: CD1 K174: CD2 K175: N K175: CA K175: C K175: O K175: CB K175: OG1 K175: CG2 K176: N K176: CA K176: C K176: O K176: CB K176: OG K177: N K177: CA K177: C K177: O K178: N K178: CA K178: C K178: O K178: CB K178: CG1 K178: CG2 K179: N K179: CA K179: C K179: O K179: CB K179: CG K179: ND1 K179: CD2 K179: CE1 K179: NE2 K180: N K180: CA K180: C K180: O K180: CB K180: OG1 K180: CG2 K181: N K181: CA K181: C K181: O K181: CB K181: CG K181: CD1 K181: CD2 K181: CE1 K181: CE2 K181: CZ K182: N K182: CA K182: C K182: O K182: CB K182: CG K182: CD K183: N K183: CA K183: C K183: O K183: CB K184: N K184: CA K184: C K184: O K184: CB K184: CG1 K184: CG2 K185: N K185: CA K185: C K185: O K185: CB K185: CG K185: CD1 K185: CD2 K186: N K186: CA K186: C K186: O K186: CB K186: CG K186: CD K186: OE1 K186: NE2 K187: N K187: CA K187: C K187: O K187: CB K187: OG K188: N K188: CA K188: C K188: O K188: CB K188: OG K189: N K189: CA K189: C K189: O K190: N K190: CA K190: C K190: O K190: CB K190: CG K190: CD1 K190: CD2 K191: N K191: CA K191: C K191: O K191: CB K191: CG K191: CD1 K191: CD2 K191: CE1 K191: CE2 K191: CZ K191: OH K192: N K192: CA K192: C K192: O K192: CB K192: OG K193: N K193: CA K193: C K193: O K193: CB K193: CG K193: CD1 K193: CD2 K194: N K194: CA K194: C K194: O K194: CB K194: OG K195: N K195: CA K195: C K195: O K195: CB K195: OG K196: N K196: CA K196: C K196: O K196: CB K196: CG1 K196: CG2 K197: N K197: CA K197: C K197: O K197: CB K197: CG1 K197: CG2 K198: N K198: CA K198: C K198: O K198: CB K198: OG1 K198: CG2 K199: N K199: CA K199: C K199: O K199: CB K199: CG1 K199: CG2 K200: N K200: CA K200: C K200: O K200: CB K200: CG K200: CD K201: N K201: CA K201: C K201: O K201: CB K201: OG K202: N K202: CA K202: C K202: O K202: CB K202: OG K203: N K203: CA K203: C K203: O K203: CB K203: OG K204: N K204: CA K204: C K204: O K204: CB K204: CG K204: CD1 K204: CD2 K205: N K205: CA K205: C K205: O K206: N K206: CA K206: C K206: O K206: CB K206: OG1 K206: CG2 K207: N K207: CA K207: C K207: O K207: CB K207: CG K207: CD K207: OE1 K207: NE2 K208: N K208: CA K208: C K208: O K208: CB K208: OG1 K208: CG2 K209: N K209: CA K209: C K209: O K209: CB K209: CG K209: CD1 K209: CD2 K209: CE1 K209: CE2 K209: CZ K209: OH K210: N K210: CA K210: C K210: O K210: CB K210: CG1 K210: CG2 K210: CD1 K211: N K211: CA K211: C K211: O K211: CB K211: SG K212: N K212: CA K212: C K212: O K212: CB K212: CG K212: OD1 K212: ND2 K213: N K213: CA K213: C K213: O K213: CB K213: CG1 K213: CG2 K214: N K214: CA K214: C K214: O K214: CB K214: CG K214: OD1 K214: ND2 K215: N K215: CA K215: C K215: O K215: CB K215: CG K215: ND1 K215: CD2 K215: CE1 K215: NE2 K216: N K216: CA K216: C K216: O K216: CB K216: CG K216: CD K216: CE K216: NZ K217: N K217: CA K217: C K217: O K217: CB K217: CG K217: CD K218: N K218: CA K218: C K218: O K218: CB K218: OG K219: N K219: CA K219: C K219: O K219: CB K219: CG K219: OD1 K219: ND2 K220: N K220: CA K220: C K220: O K220: CB K220: OG1 K220: CG2 K221: N K221: CA K221: C K221: O K221: CB K221: CG K221: CD K221: CE K221: NZ K222: N K222: CA K222: C K222: O K222: CB K222: CG1 K222: CG2 K223: N K223: CA K223: C K223: O K223: CB K223: CG K223: OD1 K223: OD2 K224: N K224: CA K224: C K224: O K224: CB K224: CG K224: CD K224: CE K224: NZ K225: N K225: CA K225: C K225: O K225: CB K225: CG K225: CD K225: CE K225: NZ K226: N K226: CA K226: C K226: O K226: CB K226: CG1 K226: CG2 K227: N K227: CA K227: C K227: O K227: CB K227: CG K227: CD K227: OE1 K227: OE2 K228: N K228: CA K228: C K228: O K228: CB K228: CG K228: CD K229: N K229: CA K229: C K229: O K229: CB K229: CG K229: CD K229: CE K229: NZ K230: N K230: CA K230: C K230: O K230: CB K230: OG L1: N L1: CA L1: C L1: O L1: CB L1: CG L1: CD L1: OE1 L1: NE2 L2: N L2: CA L2: C L2: O L2: CB L2: CG1 L2: CG2 L3: N L3: CA L3: C L3: O L3: CB L3: CG1 L3: CG2 L4: N L4: CA L4: C L4: O L4: CB L4: CG L4: SD L4: CE L5: N L5: CA L5: C L5: O L5: CB L5: OG1 L5: CG2 L6: N L6: CA L6: C L6: O L6: CB L6: CG L6: CD L6: OE1 L6: NE2 L7: N L7: CA L7: C L7: O L7: CB L7: OG L8: N L8: CA L8: C L8: O L8: CB L8: CG L8: CD L9: N L9: CA L9: C L9: O L9: CB L10: N L10: CA L10: C L10: O L10: CB L10: OG1 L10: CG2 L11: N L11: CA L11: C L11: O L11: CB L11: CG L11: CD1 L11: CD2 L12: N L12: CA L12: C L12: O L12: CB L12: OG L13: N L13: CA L13: C L13: O L13: CB L13: CG L13: CD1 L13: CD2 L14: N L14: CA L14: C L14: O L14: CB L14: OG L15: N L15: CA L15: C L15: O L15: CB L15: CG L15: CD L16: N L16: CA L16: C L16: O L17: N L17: CA L17: C L17: O L17: CB L17: CG L17: CD L17: OE1 L17: OE2 L18: N L18: CA L18: C L18: O L18: CB L18: OG1 L18: CG2 L19: N L19: CA L19: C L19: O L19: CB L20: N L20: CA L20: C L20: O L20: CB L21: N L21: CA L21: C L21: O L21: CB L21: CG1 L21: CG2 L22: N L22: CA L22: C L22: O L22: CB L22: OG L23: N L23: CA L23: C L23: O L23: CB L23: SG L24: N L24: CA L24: C L24: O L24: CB L24: CG L24: CD L24: NE L24: CZ L24: NH1 L24: NH2 L25: N L25: CA L25: C L25: O L25: CB L26: N L26: CA L26: C L26: O L26: CB L26: OG L27: N L27: CA L27: C L27: O L27: CB L27: CG L27: CD L27: OE1 L27: NE2 L28: N L28: CA L28: C L28: O L28: CB L28: CG L28: CD1 L28: CD2 L28: CE1 L28: CE2 L28: CZ L28: OH L29: N L29: CA L29: C L29: O L29: CB L29: CG1 L29: CG2 L30: N L30: CA L30: C L30: O L30: CB L30: CG L30: OD1 L30: OD2 L31: N L31: CA L31: C L31: O L31: CB L31: CG L31: CD L31: NE L31: CZ L31: NH1 L31: NH2 L32: N L32: CA L32: C L32: O L32: CB L32: OG L33: N L33: CA L33: C L33: O L33: CB L33: CG1 L33: CG2 L33: CD1 L34: N L34: CA L34: C L34: O L34: CB L34: OG L35: N L35: CA L35: C L35: O L35: CB L35: CG L35: CD1 L35: CD2 L35: NE1 L35: CE2 L35: CE3 L35: CZ2 L35: CZ3 L35: CH2 L36: N L36: CA L36: C L36: O L36: CB L36: CG L36: CD1 L36: CD2 L36: CE1 L36: CE2 L36: CZ L36: OH L37: N L37: CA L37: C L37: O L37: CB L37: CG L37: CD L37: OE1 L37: NE2 L38: N L38: CA L38: C L38: O L38: CB L38: CG L38: CD1 L38: CD2 L39: N L39: CA L39: C L39: O L39: CB L39: CG L39: CD L39: CE L39: NZ L40: N L40: CA L40: C L40: O L40: CB L40: OG1 L40: CG2 L41: N L41: CA L41: C L41: O L42: N L42: CA L42: C L42: O L42: CB L42: CG L42: CD L42: NE L42: CZ L42: NH1 L42: NH2 L43: N L43: CA L43: C L43: O L43: CB L44: N L44: CA L44: C L44: O L44: CB L44: CG L44: CD L45: N L45: CA L45: C L45: O L45: CB L45: CG L45: CD L45: NE L45: CZ L45: NH1 L45: NH2 L46: N L46: CA L46: C L46: O L46: CB L46: CG L46: CD1 L46: CD2 L47: N L47: CA L47: C L47: O L47: CB L47: CG L47: CD1 L47: CD2 L48: N L48: CA L48: C L48: O L48: CB L48: CG1 L48: CG2 L49: N L49: CA L49: C L49: O L49: CB L49: CG L49: CD1 L49: CD2 L49: CE1 L49: CE2 L49: CZ L49: OH L50: N L50: CA L50: C L50: O L50: CB L51: N L51: CA L51: C L51: O L51: CB L52: N L52: CA L52: C L52: O L52: CB L52: OG L53: N L53: CA L53: C L53: O L53: CB L53: OG L54: N L54: CA L54: C L54: O L54: CB L54: CG L54: CD L54: NE L54: CZ L54: NH1 L54: NH2 L55: N L55: CA L55: C L55: O L55: CB L55: OG L56: N L56: CA L56: C L56: O L56: CB L56: CG1 L56: CG2 L56: CD1 L57: N L57: CA L57: C L57: O L58: N L58: CA L58: C L58: O L58: CB L58: CG1 L58: CG2 L59: N L59: CA L59: C L59: O L59: CB L59: CG L59: CD L60: N L60: CA L60: C L60: O L60: CB L60: CG L60: OD1 L60: OD2 L61: N L61: CA L61: C L61: O L61: CB L61: CG L61: CD L61: NE L61: CZ L61: NH1 L61: NH2 L62: N L62: CA L62: C L62: O L62: CB L62: CG L62: CD1 L62: CD2 L62: CE1 L62: CE2 L62: CZ L63: N L63: CA L63: C L63: O L63: CB L63: OG L64: N L64: CA L64: C L64: O L65: N L65: CA L65: C L65: O L65: CB L65: OG L66: N L66: CA L66: C L66: O L67: N L67: CA L67: C L67: O L67: CB L67: OG L68: N L68: CA L68: C L68: O L69: N L69: CA L69: C L69: O L69: CB L69: CG L69: CD L69: NE L69: CZ L69: NH1 L69: NH2 L70: N L70: CA L70: C L70: O L70: CB L70: CG L70: OD1 L70: OD2 L71: N L71: CA L71: C L71: O L71: CB L71: CG L71: CD1 L71: CD2 L71: CE1 L71: CE2 L71: CZ L72: N L72: CA L72: C L72: O L72: CB L72: OG1 L72: CG2 L73: N L73: CA L73: C L73: O L73: CB L73: CG L73: CD1 L73: CD2 L74: N L74: CA L74: C L74: O L74: CB L74: OG1 L74: CG2 L75: N L75: CA L75: C L75: O L75: CB L75: CG1 L75: CG2 L75: CD1 L76: N L76: CA L76: C L76: O L76: CB L76: CG L76: CD L76: NE L76: CZ L76: NH1 L76: NH2 L77: N L77: CA L77: C L77: O L78: N L78: CA L78: C L78: O L78: CB L78: CG1 L78: CG2 L79: N L79: CA L79: C L79: O L79: CB L79: CG L79: CD L79: OE1 L79: NE2 L80: N L80: CA L80: C L80: O L80: CB L80: OG L81: N L81: CA L81: C L81: O L81: CB L81: CG L81: OD1 L81: OD2 L82: N L82: CA L82: C L82: O L82: CB L82: CG L82: OD1 L82: OD2 L83: N L83: CA L83: C L83: O L83: CB L83: CG L83: CD1 L83: CD2 L83: CE1 L83: CE2 L83: CZ L84: N L84: CA L84: C L84: O L84: CB L85: N L85: CA L85: C L85: O L85: CB L85: CG L85: CD1 L85: CD2 L86: N L86: CA L86: C L86: O L86: CB L86: CG L86: CD1 L86: CD2 L86: CE1 L86: CE2 L86: CZ L86: OH L87: N L87: CA L87: C L87: O L87: CB L87: CG L87: CD1 L87: CD2 L87: CE1 L87: CE2 L87: CZ L87: OH L88: N L88: CA L88: C L88: O L88: CB L88: SG L89: N L89: CA L89: C L89: O L89: CB L89: CG L89: CD L89: OE1 L89: NE2 L90: N L90: CA L90: C L90: O L90: CB L90: CG L90: CD L90: OE1 L90: NE2 L91: N L91: CA L91: C L91: O L91: CB L91: CG L91: OD1 L91: OD2 L92: N L92: CA L92: C L92: O L92: CB L92: CG L92: CD1 L92: CD2 L92: CE1 L92: CE2 L92: CZ L92: OH L93: N L93: CA L93: C L93: O L93: CB L93: CG L93: CD1 L93: CD2 L93: CE1 L93: CE2 L93: CZ L93: OH L94: N L94: CA L94: C L94: O L94: CB L94: CG L94: CD1 L94: CD2 L94: NE1 L94: CE2 L94: CE3 L94: CZ2 L94: CZ3 L94: CH2 L95: N L95: CA L95: C L95: O L95: CB L95: CG L95: CD L96: N L96: CA L96: C L96: O L96: CB L96: CG1 L96: CG2 L97: N L97: CA L97: C L97: O L97: CB L97: OG1 L97: CG2 L98: N L98: CA L98: C L98: O L98: CB L98: CG L98: CD1 L98: CD2 L98: CE1 L98: CE2 L98: CZ L99: N L99: CA L99: C L99: O L100: N L100: CA L100: C L100: O L100: CB L100: CG L100: CD L100: OE1 L100: NE2 L101: N L101: CA L101: C L101: O L102: N L102: CA L102: C L102: O L102: CB L102: OG1 L102: CG2 L103: N L103: CA L103: C L103: O L103: CB L103: CG L103: CD L103: NE L103: CZ L103: NH1 L103: NH2 L104: N L104: CA L104: C L104: O L104: CB L104: CG L104: CD1 L104: CD2 L105: N L105: CA L105: C L105: O L105: CB L105: CG L105: OD1 L105: OD2 L106: N L106: CA L106: C L106: O L106: CB L106: CG L106: SD L106: CE L107: N L107: CA L107: C L107: O L107: CB L107: CG L107: CD L107: CE L107: NZ L108: N L108: CA L108: C L108: O L108: CB L108: CG L108: CD L108: NE L108: CZ L108: NH1 L108: NH2 L109: N L109: CA L109: C L109: O L109: CB L109: OG1 L109: CG2 L110: N L110: CA L110: C L110: O L110: CB L110: CG1 L110: CG2 L111: N L111: CA L111: C L111: O L111: CB L112: N L112: CA L112: C L112: O L112: CB L113: N L113: CA L113: C L113: O L113: CB L113: CG L113: CD L114: N L114: CA L114: C L114: O L114: CB L114: OG L115: N L115: CA L115: C L115: O L115: CB L115: CG1 L115: CG2 L116: N L116: CA L116: C L116: O L116: CB L116: CG L116: CD1 L116: CD2 L116: CE1 L116: CE2 L116: CZ L117: N L117: CA L117: C L117: O L117: CB L117: CG1 L117: CG2 L117: CD1 L118: N L118: CA L118: C L118: O L118: CB L118: CG L118: CD1 L118: CD2 L118: CE1 L118: CE2 L118: CZ L119: N L119: CA L119: C L119: O L119: CB L119: CG L119: CD L120: N L120: CA L120: C L120: O L120: CB L120: CG L120: CD L121: N L121: CA L121: C L121: O L121: CB L121: OG L122: N L122: CA L122: C L122: O L122: CB L122: CG L122: OD1 L122: OD2 L123: N L123: CA L123: C L123: O L123: CB L123: CG L123: CD L123: OE1 L123: OE2 L124: N L124: CA L124: C L124: O L124: CB L124: CG L124: CD L124: OE1 L124: NE2 L125: N L125: CA L125: C L125: O L125: CB L125: CG L125: CD1 L125: CD2 L126: N L126: CA L126: C L126: O L126: CB L126: CG L126: CD L126: CE L126: NZ L127: N L127: CA L127: C L127: O L127: CB L127: OG L128: N L128: CA L128: C L128: O L129: N L129: CA L129: C L129: O L129: CB L129: OG1 L129: CG2 L130: N L130: CA L130: C L130: O L130: CB L131: N L131: CA L131: C L131: O L131: CB L131: OG L132: N L132: CA L132: C L132: O L132: CB L132: CG1 L132: CG2 L133: N L133: CA L133: C L133: O L133: CB L133: CG1 L133: CG2 L134: N L134: CA L134: C L134: O L134: CB L134: SG L135: N L135: CA L135: C L135: O L135: CB L135: CG L135: CD1 L135: CD2 L136: N L136: CA L136: C L136: O L136: CB L136: CG L136: CD1 L136: CD2 L137: N L137: CA L137: C L137: O L137: CB L137: CG L137: OD1 L137: ND2 L138: N L138: CA L138: C L138: O L138: CB L138: CG L138: OD1 L138: ND2 L139: N L139: CA L139: C L139: O L139: CB L139: CG L139: CD1 L139: CD2 L139: CE1 L139: CE2 L139: CZ L140: N L140: CA L140: C L140: O L140: CB L140: CG L140: CD1 L140: CD2 L140: CE1 L140: CE2 L140: CZ L140: OH L141: N L141: CA L141: C L141: O L141: CB L141: CG L141: CD L142: N L142: CA L142: C L142: O L142: CB L142: CG L142: CD L142: NE L142: CZ L142: NH1 L142: NH2 L143: N L143: CA L143: C L143: O L143: CB L143: CG L143: CD L143: OE1 L143: OE2 L144: N L144: CA L144: C L144: O L144: CB L145: N L145: CA L145: C L145: O L145: CB L145: CG L145: CD L145: CE L145: NZ L146: N L146: CA L146: C L146: O L146: CB L146: CG1 L146: CG2 L147: N L147: CA L147: C L147: O L147: CB L147: CG L147: CD L147: OE1 L147: NE2 L148: N L148: CA L148: C L148: O L148: CB L148: CG L148: CD1 L148: CD2 L148: NE1 L148: CE2 L148: CE3 L148: CZ2 L148: CZ3 L148: CH2 L149: N L149: CA L149: C L149: O L149: CB L149: CG L149: CD L149: CE L149: NZ L150: N L150: CA L150: C L150: O L150: CB L150: CG1 L150: CG2 L151: N L151: CA L151: C L151: O L151: CB L151: CG L151: OD1 L151: OD2 L152: N L152: CA L152: C L152: O L152: CB L152: CG L152: OD1 L152: ND2 L153: N L153: CA L153: C L153: O L153: CB L154: N L154: CA L154: C L154: O L154: CB L154: CG L154: CD1 L154: CD2 L155: N L155: CA L155: C L155: O L155: CB L155: CG L155: CD L155: OE1 L155: NE2 L156: N L156: CA L156: C L156: O L156: CB L156: OG L157: N L157: CA L157: C L157: O L158: N L158: CA L158: C L158: O L158: CB L158: CG L158: OD1 L158: ND2 L159: N L159: CA L159: C L159: O L159: CB L159: OG L160: N L160: CA L160: C L160: O L160: CB L160: CG L160: CD L160: OE1 L160: NE2 L161: N L161: CA L161: C L161: O L161: CB L161: CG L161: CD L161: OE1 L161: OE2 L162: N L162: CA L162: C L162: O L162: CB L162: OG L163: N L163: CA L163: C L163: O L163: CB L163: CG1 L163: CG2 L164: N L164: CA L164: C L164: O L164: CB L164: OG1 L164: CG2 L165: N L165: CA L165: C L165: O L165: CB L165: CG L165: CD L165: OE1 L165: OE2 L166: N L166: CA L166: C L166: O L166: CB L166: CG L166: CD L166: OE1 L166: NE2 L167: N L167: CA L167: C L167: O L167: CB L167: CG L167: OD1 L167: OD2 L168: N L168: CA L168: C L168: O L168: CB L168: OG L169: N L169: CA L169: C L169: O L169: CB L169: CG L169: CD L169: CE L169: NZ L170: N L170: CA L170: C L170: O L170: CB L170: CG L170: OD1 L170: OD2 L171: N L171: CA L171: C L171: O L171: CB L171: OG L172: N L172: CA L172: C L172: O L172: CB L172: OG1 L172: CG2 L173: N L173: CA L173: C L173: O L173: CB L173: CG L173: CD1 L173: CD2 L173: CE1 L173: CE2 L173: CZ L173: OH L174: N L174: CA L174: C L174: O L174: CB L174: OG L175: N L175: CA L175: C L175: O L175: CB L175: CG L175: CD1 L175: CD2 L176: N L176: CA L176: C L176: O L176: CB L176: OG L177: N L177: CA L177: C L177: O L177: CB L177: OG L178: N L178: CA L178: C L178: O L178: CB L178: OG1 L178: CG2 L179: N L179: CA L179: C L179: O L179: CB L179: CG L179: CD1 L179: CD2 L180: N L180: CA L180: C L180: O L180: CB L180: OG1 L180: CG2 L181: N L181: CA L181: C L181: O L181: CB L181: CG L181: CD1 L181: CD2 L182: N L182: CA L182: C L182: O L182: CB L182: OG L183: N L183: CA L183: C L183: O L183: CB L183: CG L183: CD L183: CE L183: NZ L184: N L184: CA L184: C L184: O L184: CB L185: N L185: CA L185: C L185: O L185: CB L185: CG L185: OD1 L185: OD2 L186: N L186: CA L186: C L186: O L186: CB L186: CG L186: CD1 L186: CD2 L186: CE1 L186: CE2 L186: CZ L186: OH L187: N L187: CA L187: C L187: O L187: CB L187: CG L187: CD L187: OE1 L187: OE2 L188: N L188: CA L188: C L188: O L188: CB L188: CG L188: CD L188: CE L188: NZ L189: N L189: CA L189: C L189: O L189: CB L189: CG L189: ND1 L189: CD2 L189: CE1 L189: NE2 L190: N L190: CA L190: C L190: O L190: CB L190: CG L190: CD L190: CE L190: NZ L191: N L191: CA L191: C L191: O L191: CB L191: CG1 L191: CG2 L192: N L192: CA L192: C L192: O L192: CB L192: CG L192: CD1 L192: CD2 L192: CE1 L192: CE2 L192: CZ L192: OH L193: N L193: CA L193: C L193: O L193: CB L194: N L194: CA L194: C L194: O L194: CB L194: SG L195: N L195: CA L195: C L195: O L195: CB L195: CG L195: CD L195: OE1 L195: OE2 L196: N L196: CA L196: C L196: O L196: CB L196: CG1 L196: CG2 L197: N L197: CA L197: C L197: O L197: CB L197: OG1 L197: CG2 L198: N L198: CA L198: C L198: O L198: CB L198: CG L198: ND1 L198: CD2 L198: CE1 L198: NE2 L199: N L199: CA L199: C L199: O L199: CB L199: CG L199: CD L199: OE1 L199: NE2 L200: N L200: CA L200: C L200: O L201: N L201: CA L201: C L201: O L201: CB L201: CG L201: CD1 L201: CD2 L202: N L202: CA L202: C L202: O L202: CB L202: OG L203: N L203: CA L203: C L203: O L203: CB L203: OG L204: N L204: CA L204: C L204: O L204: CB L204: CG L204: CD L205: N L205: CA L205: C L205: O L205: CB L205: CG1 L205: CG2 L206: N L206: CA L206: C L206: O L206: CB L206: OG1 L206: CG2 L207: N L207: CA L207: C L207: O L207: CB L207: CG L207: CD L207: CE L207: NZ L208: N L208: CA L208: C L208: O L208: CB L208: OG L209: N L209: CA L209: C L209: O L209: CB L209: CG L209: CD1 L209: CD2 L209: CE1 L209: CE2 L209: CZ L210: N L210: CA L210: C L210: O L210: CB L210: CG L210: OD1 L210: ND2 L211: N L211: CA L211: C L211: O L211: CB L211: CG L211: CD L211: NE L211: CZ L211: NH1 L211: NH2 L212: N L212: CA L212: C L212: O L213: N L213: CA L213: C L213: O L213: CB L213: CG L213: CD L213: OE1 L213: OE2 L214: N L214: CA L214: C L214: O L214: CB L214: SG Chain information for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb --- Chain | Description 1.1/A 1.1/E 1.1/I | No description available 1.1/B 1.1/F 1.1/J | No description available 1.1/C 1.1/G 1.1/K | No description available 1.1/D 1.1/H 1.1/L | No description available > close #1 > open "/Users/km503/Documents/VRC40/higher resolution/VRC40-trimer- > rsr40_real_space_refined-coot-0.pdb" Summary of feedback from opening /Users/km503/Documents/VRC40/higher resolution/VRC40-trimer-rsr40_real_space_refined-coot-0.pdb --- warnings | Start residue of secondary structure not found: HELIX 16 16 PHE H 29 ASP H 31 5 3 Start residue of secondary structure not found: HELIX 17 17 HIS H 62 PHE H 64 5 3 Start residue of secondary structure not found: HELIX 18 18 SER H 93 ASP H 95 5 3 Start residue of secondary structure not found: HELIX 19 19 ASN H 170 GLY H 172 5 3 Start residue of secondary structure not found: HELIX 20 20 SER H 201 SER H 203 5 3 43 messages similar to the above omitted End residue of secondary structure not found: HELIX 67 67 SER K 80 ASP K 82 5 3 Start residue of secondary structure not found: HELIX 68 68 ASP K 122 LEU K 125 1 4 Start residue of secondary structure not found: HELIX 69 69 LYS K 183 LYS K 188 1 6 Start residue of secondary structure not found: SHEET 1 K 4 GLN H 3 GLN H 6 0 Start residue of secondary structure not found: SHEET 2 K 4 VAL H 18 SER H 25 -1 N SER H 25 O GLN H 3 Start residue of secondary structure not found: SHEET 3 K 4 LEU H 81 LEU H 88 -1 N LEU H 88 O VAL H 18 2 messages similar to the above omitted End residue of secondary structure not found: SHEET 2 L 6 SER H 121 VAL H 125 1 N ILE H 124 O GLN H 10 Start residue of secondary structure not found: SHEET 3 L 6 ALA H 97 ARG H 103 -1 N TYR H 99 O SER H 121 Start residue of secondary structure not found: SHEET 4 L 6 LEU H 33 LEU H 39 -1 N LEU H 39 O ILE H 98 Start residue of secondary structure not found: SHEET 5 L 6 LEU H 45 ASN H 52 -1 N ILE H 51 O ILE H 34 Start residue of secondary structure not found: SHEET 6 L 6 MET H 58 LEU H 60 -1 N TYR H 59 O ARG H 50 Start residue of secondary structure not found: SHEET 1 M 4 SER H 135 LEU H 139 0 6 messages similar to the above omitted End residue of secondary structure not found: SHEET 1 T 2 TRP C 36 TYR C 41 0 Start residue of secondary structure not found: SHEET 2 T 2 LEU C 494 THR C 499 -1 N THR C 499 O TRP C 36 Start residue of secondary structure not found: SHEET 1 U 2 CYS C 55 SER C 57 0 Start residue of secondary structure not found: SHEET 2 U 2 ILE C 216 TYR C 218 -1 N HIS C 217 O ALA C 56 Start residue of secondary structure not found: SHEET 1 V 4 GLU C 84 HIS C 86 0 Start residue of secondary structure not found: SHEET 2 V 4 VAL C 243 VAL C 246 -1 N THR C 245 O ILE C 85 52 messages similar to the above omitted End residue of secondary structure not found: SHEET 1 AM 2 TRP G 36 TYR G 41 0 Start residue of secondary structure not found: SHEET 2 AM 2 LEU G 494 THR G 499 -1 N THR G 499 O TRP G 36 Start residue of secondary structure not found: SHEET 1 AN 2 CYS G 55 SER G 57 0 Start residue of secondary structure not found: SHEET 2 AN 2 ILE G 216 TYR G 218 -1 N HIS G 217 O ALA G 56 Start residue of secondary structure not found: SHEET 1 AO 4 GLU G 84 HIS G 86 0 Start residue of secondary structure not found: SHEET 2 AO 4 VAL G 243 VAL G 246 -1 N THR G 245 O ILE G 85 41 messages similar to the above omitted End residue of secondary structure not found: SHEET 2 BB 2 ARG K 103 MET K 106 1 N ARG K 103 O LEU K 11 Start residue of secondary structure not found: SHEET 1 BC 3 LEU K 85 GLN K 90 0 Start residue of secondary structure not found: SHEET 2 BC 3 ILE K 33 LEU K 38 -1 N LEU K 38 O LEU K 85 Start residue of secondary structure not found: SHEET 3 BC 3 ARG K 45 VAL K 48 -1 N VAL K 48 O TRP K 35 Start residue of secondary structure not found: SHEET 1 BD 4 SER K 114 PHE K 118 0 Start residue of secondary structure not found: SHEET 2 BD 4 THR K 129 ASN K 137 -1 N ASN K 137 O SER K 114 5 messages similar to the above omitted Cannot find LINK/SSBOND residue CYS (22 ) Cannot find LINK/SSBOND residue CYS (155 ) Cannot find LINK/SSBOND residue CYS (120 ) Cannot find LINK/SSBOND residue CYS (127 ) Cannot find LINK/SSBOND residue CYS (132 ) 27 messages similar to the above omitted Chain information for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb #1 --- Chain | Description A E I | No description available B F J | No description available C G K | No description available D H L | No description available > open "/Users/km503/Documents/VRC40/higher > resolution/cryosparc_P4_J12_008_volume_map_sharp_local-zflip.mrc" Opened cryosparc_P4_J12_008_volume_map_sharp_local-zflip.mrc, grid size 320,320,320, pixel 1.08, shown at level 0.667, step 2, values float32 > clipper associate #2 toModel #1 The following atoms were found to have physically impossible anisotropic B-factor (ANISOU) entries. These have been removed in favour of their isotropic B-factors. C1: N C1: CA C1: C C1: O C1: CB C1: CG C1: CD C1: OE1 C1: NE2 C2: N C2: CA C2: C C2: O C2: CB C2: CG1 C2: CG2 C3: N C3: CA C3: C C3: O C3: CB C3: CG C3: CD C3: OE1 C3: NE2 C4: N C4: CA C4: C C4: O C4: CB C4: CG C4: CD1 C4: CD2 C5: N C5: CA C5: C C5: O C5: CB C5: CG1 C5: CG2 C5: CD1 C6: N C6: CA C6: C C6: O C6: CB C6: CG C6: CD C6: OE1 C6: NE2 C7: N C7: CA C7: C C7: O C7: CB C7: OG C8: N C8: CA C8: C C8: O C9: N C9: CA C9: C C9: O C9: CB C9: CG C9: CD C10: N C10: CA C10: C C10: O C10: CB C10: CG C10: CD C10: OE1 C10: NE2 C11: N C11: CA C11: C C11: O C11: CB C11: CG C11: CD1 C11: CD2 C11: CE1 C11: CE2 C11: CZ C12: N C12: CA C12: C C12: O C12: CB C12: CG C12: CD C12: CE C12: NZ C13: N C13: CA C13: C C13: O C13: CB C13: OG1 C13: CG2 C14: N C14: CA C14: C C14: O C14: CB C14: CG C14: CD C15: N C15: CA C15: C C15: O C16: N C16: CA C16: C C16: O C16: CB C17: N C17: CA C17: C C17: O C17: CB C17: OG C18: N C18: CA C18: C C18: O C18: CB C18: CG1 C18: CG2 C19: N C19: CA C19: C C19: O C19: CB C19: OG1 C19: CG2 C20: N C20: CA C20: C C20: O C20: CB C20: CG1 C20: CG2 C21: N C21: CA C21: C C21: O C21: CB C21: OG C22: N C22: CA C22: C C22: O C22: CB C22: SG C23: N C23: CA C23: C C23: O C23: CB C23: CG C23: CD C23: CE C23: NZ C24: N C24: CA C24: C C24: O C24: CB C25: N C25: CA C25: C C25: O C25: CB C25: OG C26: N C26: CA C26: C C26: O C27: N C27: CA C27: C C27: O C27: CB C27: CG C27: CD1 C27: CD2 C27: CE1 C27: CE2 C27: CZ C27: OH C28: N C28: CA C28: C C28: O C28: CB C28: CG1 C28: CG2 C28: CD1 C29: N C29: CA C29: C C29: O C29: CB C29: CG C29: CD1 C29: CD2 C29: CE1 C29: CE2 C29: CZ C30: N C30: CA C30: C C30: O C30: CB C30: OG1 C30: CG2 C31: N C31: CA C31: C C31: O C31: CB C31: CG C31: OD1 C31: OD2 C32: N C32: CA C32: C C32: O C32: CB C32: CG C32: CD1 C32: CD2 C32: CE1 C32: CE2 C32: CZ C32: OH C33: N C33: CA C33: C C33: O C33: CB C33: CG C33: CD1 C33: CD2 C34: N C34: CA C34: C C34: O C34: CB C34: CG1 C34: CG2 C34: CD1 C35: N C35: CA C35: C C35: O C35: CB C35: CG C35: ND1 C35: CD2 C35: CE1 C35: NE2 C36: N C36: CA C36: C C36: O C36: CB C36: CG C36: CD1 C36: CD2 C36: NE1 C36: CE2 C36: CE3 C36: CZ2 C36: CZ3 C36: CH2 C37: N C37: CA C37: C C37: O C37: CB C37: CG1 C37: CG2 C38: N C38: CA C38: C C38: O C38: CB C38: CG C38: CD C38: NE C38: CZ C38: NH1 C38: NH2 C39: N C39: CA C39: C C39: O C39: CB C39: CG C39: CD1 C39: CD2 C40: N C40: CA C40: C C40: O C40: CB C40: CG1 C40: CG2 C41: N C41: CA C41: C C41: O C41: CB C41: CG C41: CD C42: N C42: CA C42: C C42: O C43: N C43: CA C43: C C43: O C43: CB C43: CG C43: CD C43: CE C43: NZ C44: N C44: CA C44: C C44: O C45: N C45: CA C45: C C45: O C45: CB C45: CG C45: CD1 C45: CD2 C46: N C46: CA C46: C C46: O C46: CB C46: CG C46: CD C46: OE1 C46: OE2 C47: N C47: CA C47: C C47: O C47: CB C47: CG C47: CD1 C47: CD2 C47: NE1 C47: CE2 C47: CE3 C47: CZ2 C47: CZ3 C47: CH2 C48: N C48: CA C48: C C48: O C48: CB C48: CG C48: CD1 C48: CD2 C49: N C49: CA C49: C C49: O C50: N C50: CA C50: C C50: O C50: CB C50: CG C50: CD C50: NE C50: CZ C50: NH1 C50: NH2 C51: N C51: CA C51: C C51: O C51: CB C51: CG1 C51: CG2 C51: CD1 C52: N C52: CA C52: C C52: O C52: CB C52: CG C52: OD1 C52: ND2 C53: N C53: CA C53: C C53: O C53: CB C53: OG1 C53: CG2 C54: N C54: CA C54: C C54: O C54: CB C54: CG C54: OD1 C54: ND2 C55: N C55: CA C55: C C55: O C55: CB C56: N C56: CA C56: C C56: O C57: N C57: CA C57: C C57: O C57: CB C57: CG C57: CD1 C57: CD2 C58: N C58: CA C58: C C58: O C58: CB C58: CG C58: SD C58: CE C59: N C59: CA C59: C C59: O C59: CB C59: CG C59: CD1 C59: CD2 C59: CE1 C59: CE2 C59: CZ C59: OH C60: N C60: CA C60: C C60: O C60: CB C60: CG C60: CD1 C60: CD2 C61: N C61: CA C61: C C61: O C61: CB C61: OG C62: N C62: CA C62: C C62: O C62: CB C62: CG C62: ND1 C62: CD2 C62: CE1 C62: NE2 C63: N C63: CA C63: C C63: O C63: CB C63: CG C63: CD C63: CE C63: NZ C64: N C64: CA C64: C C64: O C64: CB C64: CG C64: CD1 C64: CD2 C64: CE1 C64: CE2 C64: CZ C65: N C65: CA C65: C C65: O C65: CB C65: CG C65: CD C65: OE1 C65: OE2 C66: N C66: CA C66: C C66: O C67: N C67: CA C67: C C67: O C67: CB C67: CG C67: CD C67: NE C67: CZ C67: NH1 C67: NH2 C68: N C68: CA C68: C C68: O C68: CB C68: CG C68: CD1 C68: CD2 C69: N C69: CA C69: C C69: O C69: CB C69: CG1 C69: CG2 C69: CD1 C70: N C70: CA C70: C C70: O C70: CB C70: CG C70: CD1 C70: CD2 C71: N C71: CA C71: C C71: O C71: CB C71: CG C71: CD C71: NE C71: CZ C71: NH1 C71: NH2 C72: N C72: CA C72: C C72: O C72: CB C72: CG C72: CD C72: NE C72: CZ C72: NH1 C72: NH2 C73: N C73: CA C73: C C73: O C73: CB C73: CG1 C73: CG2 C74: N C74: CA C74: C C74: O C74: CB C74: CG1 C74: CG2 C75: N C75: CA C75: C C75: O C75: CB C75: CG C75: OD1 C75: OD2 C76: N C76: CA C76: C C76: O C76: CB C76: CG C76: CD1 C76: CD2 C76: NE1 C76: CE2 C76: CE3 C76: CZ2 C76: CZ3 C76: CH2 C77: N C77: CA C77: C C77: O C77: CB C77: CG C77: CD C77: NE C77: CZ C77: NH1 C77: NH2 C78: N C78: CA C78: C C78: O C78: CB C78: OG1 C78: CG2 C79: N C79: CA C79: C C79: O C79: CB C79: CG C79: CD C80: N C80: CA C80: C C80: O C80: CB C80: OG C81: N C81: CA C81: C C81: O C81: CB C81: CG C81: CD1 C81: CD2 C82: N C82: CA C82: C C82: O C83: N C83: CA C83: C C83: O C83: CB C83: OG1 C83: CG2 C84: N C84: CA C84: C C84: O C84: CB C84: CG1 C84: CG2 C85: N C85: CA C85: C C85: O C85: CB C85: CG C85: OD1 C85: ND2 C86: N C86: CA C86: C C86: O C86: CB C86: CG C86: SD C86: CE C87: N C87: CA C87: C C87: O C87: CB C87: CG C87: CD C87: OE1 C87: OE2 C88: N C88: CA C88: C C88: O C88: CB C88: CG C88: CD1 C88: CD2 C89: N C89: CA C89: C C89: O C89: CB C89: CG C89: CD C89: NE C89: CZ C89: NH1 C89: NH2 C90: N C90: CA C90: C C90: O C90: CB C90: CG C90: OD1 C90: ND2 C91: N C91: CA C91: C C91: O C91: CB C91: CG1 C91: CG2 C92: N C92: CA C92: C C92: O C92: CB C92: CG C92: CD C92: NE C92: CZ C92: NH1 C92: NH2 C93: N C93: CA C93: C C93: O C93: CB C93: OG C94: N C94: CA C94: C C94: O C94: CB C94: CG C94: OD1 C94: OD2 C95: N C95: CA C95: C C95: O C95: CB C95: CG C95: OD1 C95: OD2 C96: N C96: CA C96: C C96: O C96: CB C96: OG C97: N C97: CA C97: C C97: O C97: CB C98: N C98: CA C98: C C98: O C98: CB C98: CG1 C98: CG2 C98: CD1 C99: N C99: CA C99: C C99: O C99: CB C99: CG C99: CD1 C99: CD2 C99: CE1 C99: CE2 C99: CZ C99: OH C100: N C100: CA C100: C C100: O C100: CB C100: CG C100: CD1 C100: CD2 C100: CE1 C100: CE2 C100: CZ C101: N C101: CA C101: C C101: O C101: CB C101: SG C102: N C102: CA C102: C C102: O C103: N C103: CA C103: C C103: O C103: CB C103: CG C103: CD C103: NE C103: CZ C103: NH1 C103: NH2 C104: N C104: CA C104: C C104: O C104: CB C104: CG1 C104: CG2 C105: N C105: CA C105: C C105: O C105: CB C105: CG1 C105: CG2 C106: N C106: CA C106: C C106: O C106: CB C106: CG C106: OD1 C106: OD2 C107: N C107: CA C107: C C107: O C108: N C108: CA C108: C C108: O C108: CB C108: CG C108: CD1 C108: CD2 C108: CE1 C108: CE2 C108: CZ C109: N C109: CA C109: C C109: O C109: CB C109: CG C109: OD1 C109: ND2 C110: N C110: CA C110: C C110: O C110: CB C111: N C111: CA C111: C C111: O C111: CB C112: N C112: CA C112: C C112: O C113: N C113: CA C113: C C113: O C113: CB C113: CG C113: CD C114: N C114: CA C114: C C114: O C114: CB C114: CG C114: CD1 C114: CD2 C115: N C115: CA C115: C C115: O C115: CB C115: CG C115: CD C115: OE1 C115: OE2 C116: N C116: CA C116: C C116: O C116: CB C116: CG C116: CD1 C116: CD2 C116: CE1 C116: CE2 C116: CZ C117: N C117: CA C117: C C117: O C117: CB C117: CG C117: CD1 C117: CD2 C117: NE1 C117: CE2 C117: CE3 C117: CZ2 C117: CZ3 C117: CH2 C118: N C118: CA C118: C C118: O C119: N C119: CA C119: C C119: O C119: CB C119: CG C119: CD C119: OE1 C119: NE2 C120: N C120: CA C120: C C120: O C121: N C121: CA C121: C C121: O C121: CB C121: OG C122: N C122: CA C122: C C122: O C122: CB C122: CG C122: CD C123: N C123: CA C123: C C123: O C123: CB C123: CG1 C123: CG2 C124: N C124: CA C124: C C124: O C124: CB C124: CG1 C124: CG2 C124: CD1 C125: N C125: CA C125: C C125: O C125: CB C125: CG1 C125: CG2 C126: N C126: CA C126: C C126: O C126: CB C126: OG C127: N C127: CA C127: C C127: O C127: CB C127: OG C129: N C129: CA C129: C C129: O C129: CB C130: N C130: CA C130: C C130: O C130: CB C130: OG C131: N C131: CA C131: C C131: O C131: CB C131: OG1 C131: CG2 C132: N C132: CA C132: C C132: O C132: CB C132: CG C132: CD C132: CE C132: NZ C133: N C133: CA C133: C C133: O C134: N C134: CA C134: C C134: O C134: CB C134: CG C134: CD C135: N C135: CA C135: C C135: O C135: CB C135: OG C136: N C136: CA C136: C C136: O C136: CB C136: CG1 C136: CG2 C137: N C137: CA C137: C C137: O C137: CB C137: CG C137: CD1 C137: CD2 C137: CE1 C137: CE2 C137: CZ C138: N C138: CA C138: C C138: O C138: CB C138: CG C138: CD C139: N C139: CA C139: C C139: O C139: CB C139: CG C139: CD1 C139: CD2 C140: N C140: CA C140: C C140: O C140: CB C141: N C141: CA C141: C C141: O C141: CB C141: CG C141: CD C142: N C142: CA C142: C C142: O C142: CB C142: OG C143: N C143: CA C143: C C143: O C143: CB C143: OG C144: N C144: CA C144: C C144: O C144: CB C144: CG C144: CD C144: CE C144: NZ C145: N C145: CA C145: C C145: O C145: CB C145: OG C146: N C146: CA C146: C C146: O C146: CB C146: OG1 C146: CG2 C147: N C147: CA C147: C C147: O C147: CB C147: OG C148: N C148: CA C148: C C148: O C149: N C149: CA C149: C C149: O C150: N C150: CA C150: C C150: O C150: CB C150: OG1 C150: CG2 C151: N C151: CA C151: C C151: O C151: CB C152: N C152: CA C152: C C152: O C152: CB C153: N C153: CA C153: C C153: O C153: CB C153: CG C153: CD1 C153: CD2 C154: N C154: CA C154: C C154: O C155: N C155: CA C155: C C155: O C155: CB C155: SG C156: N C156: CA C156: C C156: O C156: CB C156: CG C156: CD1 C156: CD2 C157: N C157: CA C157: C C157: O C157: CB C157: CG1 C157: CG2 C158: N C158: CA C158: C C158: O C158: CB C158: CG C158: CD C158: CE C158: NZ C159: N C159: CA C159: C C159: O C159: CB C159: CG C159: OD1 C159: OD2 C160: N C160: CA C160: C C160: O C160: CB C160: CG C160: CD1 C160: CD2 C160: CE1 C160: CE2 C160: CZ C160: OH C161: N C161: CA C161: C C161: O C161: CB C161: CG C161: CD1 C161: CD2 C161: CE1 C161: CE2 C161: CZ C162: N C162: CA C162: C C162: O C162: CB C162: CG C162: CD C163: N C163: CA C163: C C163: O C163: CB C163: CG C163: CD C163: OE1 C163: OE2 C164: N C164: CA C164: C C164: O C164: CB C164: CG C164: CD C165: N C165: CA C165: C C165: O C165: CB C165: CG1 C165: CG2 C166: N C166: CA C166: C C166: O C166: CB C166: OG1 C166: CG2 C167: N C167: CA C167: C C167: O C167: CB C167: CG1 C167: CG2 C168: N C168: CA C168: C C168: O C168: CB C168: OG C169: N C169: CA C169: C C169: O C169: CB C169: CG C169: CD1 C169: CD2 C169: NE1 C169: CE2 C169: CE3 C169: CZ2 C169: CZ3 C169: CH2 C170: N C170: CA C170: C C170: O C170: CB C170: CG C170: OD1 C170: ND2 C171: N C171: CA C171: C C171: O C171: CB C171: OG C172: N C172: CA C172: C C172: O C173: N C173: CA C173: C C173: O C173: CB C174: N C174: CA C174: C C174: O C174: CB C174: CG C174: CD1 C174: CD2 C175: N C175: CA C175: C C175: O C175: CB C175: OG1 C175: CG2 C176: N C176: CA C176: C C176: O C176: CB C176: OG C177: N C177: CA C177: C C177: O C178: N C178: CA C178: C C178: O C178: CB C178: CG1 C178: CG2 C179: N C179: CA C179: C C179: O C179: CB C179: CG C179: ND1 C179: CD2 C179: CE1 C179: NE2 C180: N C180: CA C180: C C180: O C180: CB C180: OG1 C180: CG2 C181: N C181: CA C181: C C181: O C181: CB C181: CG C181: CD1 C181: CD2 C181: CE1 C181: CE2 C181: CZ C182: N C182: CA C182: C C182: O C182: CB C182: CG C182: CD C183: N C183: CA C183: C C183: O C183: CB C184: N C184: CA C184: C C184: O C184: CB C184: CG1 C184: CG2 C185: N C185: CA C185: C C185: O C185: CB C185: CG C185: CD1 C185: CD2 C186: N C186: CA C186: C C186: O C186: CB C186: CG C186: CD C186: OE1 C186: NE2 C187: N C187: CA C187: C C187: O C187: CB C187: OG C188: N C188: CA C188: C C188: O C188: CB C188: OG C189: N C189: CA C189: C C189: O C190: N C190: CA C190: C C190: O C190: CB C190: CG C190: CD1 C190: CD2 C191: N C191: CA C191: C C191: O C191: CB C191: CG C191: CD1 C191: CD2 C191: CE1 C191: CE2 C191: CZ C191: OH C192: N C192: CA C192: C C192: O C192: CB C192: OG C193: N C193: CA C193: C C193: O C193: CB C193: CG C193: CD1 C193: CD2 C194: N C194: CA C194: C C194: O C194: CB C194: OG C195: N C195: CA C195: C C195: O C195: CB C195: OG C196: N C196: CA C196: C C196: O C196: CB C196: CG1 C196: CG2 C197: N C197: CA C197: C C197: O C197: CB C197: CG1 C197: CG2 C198: N C198: CA C198: C C198: O C198: CB C198: OG1 C198: CG2 C199: N C199: CA C199: C C199: O C199: CB C199: CG1 C199: CG2 C200: N C200: CA C200: C C200: O C200: CB C200: CG C200: CD C201: N C201: CA C201: C C201: O C201: CB C201: OG C202: N C202: CA C202: C C202: O C202: CB C202: OG C203: N C203: CA C203: C C203: O C203: CB C203: OG C204: N C204: CA C204: C C204: O C204: CB C204: CG C204: CD1 C204: CD2 C205: N C205: CA C205: C C205: O C206: N C206: CA C206: C C206: O C206: CB C206: OG1 C206: CG2 C207: N C207: CA C207: C C207: O C207: CB C207: CG C207: CD C207: OE1 C207: NE2 C208: N C208: CA C208: C C208: O C208: CB C208: OG1 C208: CG2 C209: N C209: CA C209: C C209: O C209: CB C209: CG C209: CD1 C209: CD2 C209: CE1 C209: CE2 C209: CZ C209: OH C210: N C210: CA C210: C C210: O C210: CB C210: CG1 C210: CG2 C210: CD1 C211: N C211: CA C211: C C211: O C211: CB C211: SG C212: N C212: CA C212: C C212: O C212: CB C212: CG C212: OD1 C212: ND2 C213: N C213: CA C213: C C213: O C213: CB C213: CG1 C213: CG2 C214: N C214: CA C214: C C214: O C214: CB C214: CG C214: OD1 C214: ND2 C215: N C215: CA C215: C C215: O C215: CB C215: CG C215: ND1 C215: CD2 C215: CE1 C215: NE2 C216: N C216: CA C216: C C216: O C216: CB C216: CG C216: CD C216: CE C216: NZ C217: N C217: CA C217: C C217: O C217: CB C217: CG C217: CD C218: N C218: CA C218: C C218: O C218: CB C218: OG C219: N C219: CA C219: C C219: O C219: CB C219: CG C219: OD1 C219: ND2 C220: N C220: CA C220: C C220: O C220: CB C220: OG1 C220: CG2 C221: N C221: CA C221: C C221: O C221: CB C221: CG C221: CD C221: CE C221: NZ C222: N C222: CA C222: C C222: O C222: CB C222: CG1 C222: CG2 C223: N C223: CA C223: C C223: O C223: CB C223: CG C223: OD1 C223: OD2 C224: N C224: CA C224: C C224: O C224: CB C224: CG C224: CD C224: CE C224: NZ C225: N C225: CA C225: C C225: O C225: CB C225: CG C225: CD C225: CE C225: NZ C226: N C226: CA C226: C C226: O C226: CB C226: CG1 C226: CG2 C227: N C227: CA C227: C C227: O C227: CB C227: CG C227: CD C227: OE1 C227: OE2 C228: N C228: CA C228: C C228: O C228: CB C228: CG C228: CD C229: N C229: CA C229: C C229: O C229: CB C229: CG C229: CD C229: CE C229: NZ C230: N C230: CA C230: C C230: O C230: CB C230: OG D1: N D1: CA D1: C D1: O D1: CB D1: CG D1: CD D1: OE1 D1: NE2 D2: N D2: CA D2: C D2: O D2: CB D2: CG1 D2: CG2 D3: N D3: CA D3: C D3: O D3: CB D3: CG1 D3: CG2 D4: N D4: CA D4: C D4: O D4: CB D4: CG D4: SD D4: CE D5: N D5: CA D5: C D5: O D5: CB D5: OG1 D5: CG2 D6: N D6: CA D6: C D6: O D6: CB D6: CG D6: CD D6: OE1 D6: NE2 D7: N D7: CA D7: C D7: O D7: CB D7: OG D8: N D8: CA D8: C D8: O D8: CB D8: CG D8: CD D9: N D9: CA D9: C D9: O D9: CB D10: N D10: CA D10: C D10: O D10: CB D10: OG1 D10: CG2 D11: N D11: CA D11: C D11: O D11: CB D11: CG D11: CD1 D11: CD2 D12: N D12: CA D12: C D12: O D12: CB D12: OG D13: N D13: CA D13: C D13: O D13: CB D13: CG D13: CD1 D13: CD2 D14: N D14: CA D14: C D14: O D14: CB D14: OG D15: N D15: CA D15: C D15: O D15: CB D15: CG D15: CD D16: N D16: CA D16: C D16: O D17: N D17: CA D17: C D17: O D17: CB D17: CG D17: CD D17: OE1 D17: OE2 D18: N D18: CA D18: C D18: O D18: CB D18: OG1 D18: CG2 D19: N D19: CA D19: C D19: O D19: CB D20: N D20: CA D20: C D20: O D20: CB D21: N D21: CA D21: C D21: O D21: CB D21: CG1 D21: CG2 D22: N D22: CA D22: C D22: O D22: CB D22: OG D23: N D23: CA D23: C D23: O D23: CB D23: SG D24: N D24: CA D24: C D24: O D24: CB D24: CG D24: CD D24: NE D24: CZ D24: NH1 D24: NH2 D25: N D25: CA D25: C D25: O D25: CB D26: N D26: CA D26: C D26: O D26: CB D26: OG D27: N D27: CA D27: C D27: O D27: CB D27: CG D27: CD D27: OE1 D27: NE2 D28: N D28: CA D28: C D28: O D28: CB D28: CG D28: CD1 D28: CD2 D28: CE1 D28: CE2 D28: CZ D28: OH D29: N D29: CA D29: C D29: O D29: CB D29: CG1 D29: CG2 D30: N D30: CA D30: C D30: O D30: CB D30: CG D30: OD1 D30: OD2 D31: N D31: CA D31: C D31: O D31: CB D31: CG D31: CD D31: NE D31: CZ D31: NH1 D31: NH2 D32: N D32: CA D32: C D32: O D32: CB D32: OG D33: N D33: CA D33: C D33: O D33: CB D33: CG1 D33: CG2 D33: CD1 D34: N D34: CA D34: C D34: O D34: CB D34: OG D35: N D35: CA D35: C D35: O D35: CB D35: CG D35: CD1 D35: CD2 D35: NE1 D35: CE2 D35: CE3 D35: CZ2 D35: CZ3 D35: CH2 D36: N D36: CA D36: C D36: O D36: CB D36: CG D36: CD1 D36: CD2 D36: CE1 D36: CE2 D36: CZ D36: OH D37: N D37: CA D37: C D37: O D37: CB D37: CG D37: CD D37: OE1 D37: NE2 D38: N D38: CA D38: C D38: O D38: CB D38: CG D38: CD1 D38: CD2 D39: N D39: CA D39: C D39: O D39: CB D39: CG D39: CD D39: CE D39: NZ D40: N D40: CA D40: C D40: O D40: CB D40: OG1 D40: CG2 D41: N D41: CA D41: C D41: O D42: N D42: CA D42: C D42: O D42: CB D42: CG D42: CD D42: NE D42: CZ D42: NH1 D42: NH2 D43: N D43: CA D43: C D43: O D43: CB D44: N D44: CA D44: C D44: O D44: CB D44: CG D44: CD D45: N D45: CA D45: C D45: O D45: CB D45: CG D45: CD D45: NE D45: CZ D45: NH1 D45: NH2 D46: N D46: CA D46: C D46: O D46: CB D46: CG D46: CD1 D46: CD2 D47: N D47: CA D47: C D47: O D47: CB D47: CG D47: CD1 D47: CD2 D48: N D48: CA D48: C D48: O D48: CB D48: CG1 D48: CG2 D49: N D49: CA D49: C D49: O D49: CB D49: CG D49: CD1 D49: CD2 D49: CE1 D49: CE2 D49: CZ D49: OH D50: N D50: CA D50: C D50: O D50: CB D51: N D51: CA D51: C D51: O D51: CB D52: N D52: CA D52: C D52: O D52: CB D52: OG D53: N D53: CA D53: C D53: O D53: CB D53: OG D54: N D54: CA D54: C D54: O D54: CB D54: CG D54: CD D54: NE D54: CZ D54: NH1 D54: NH2 D55: N D55: CA D55: C D55: O D55: CB D55: OG D56: N D56: CA D56: C D56: O D56: CB D56: CG1 D56: CG2 D56: CD1 D57: N D57: CA D57: C D57: O D58: N D58: CA D58: C D58: O D58: CB D58: CG1 D58: CG2 D59: N D59: CA D59: C D59: O D59: CB D59: CG D59: CD D60: N D60: CA D60: C D60: O D60: CB D60: CG D60: OD1 D60: OD2 D61: N D61: CA D61: C D61: O D61: CB D61: CG D61: CD D61: NE D61: CZ D61: NH1 D61: NH2 D62: N D62: CA D62: C D62: O D62: CB D62: CG D62: CD1 D62: CD2 D62: CE1 D62: CE2 D62: CZ D63: N D63: CA D63: C D63: O D63: CB D63: OG D64: N D64: CA D64: C D64: O D65: N D65: CA D65: C D65: O D65: CB D65: OG D66: N D66: CA D66: C D66: O D67: N D67: CA D67: C D67: O D67: CB D67: OG D68: N D68: CA D68: C D68: O D69: N D69: CA D69: C D69: O D69: CB D69: CG D69: CD D69: NE D69: CZ D69: NH1 D69: NH2 D70: N D70: CA D70: C D70: O D70: CB D70: CG D70: OD1 D70: OD2 D71: N D71: CA D71: C D71: O D71: CB D71: CG D71: CD1 D71: CD2 D71: CE1 D71: CE2 D71: CZ D72: N D72: CA D72: C D72: O D72: CB D72: OG1 D72: CG2 D73: N D73: CA D73: C D73: O D73: CB D73: CG D73: CD1 D73: CD2 D74: N D74: CA D74: C D74: O D74: CB D74: OG1 D74: CG2 D75: N D75: CA D75: C D75: O D75: CB D75: CG1 D75: CG2 D75: CD1 D76: N D76: CA D76: C D76: O D76: CB D76: CG D76: CD D76: NE D76: CZ D76: NH1 D76: NH2 D77: N D77: CA D77: C D77: O D78: N D78: CA D78: C D78: O D78: CB D78: CG1 D78: CG2 D79: N D79: CA D79: C D79: O D79: CB D79: CG D79: CD D79: OE1 D79: NE2 D80: N D80: CA D80: C D80: O D80: CB D80: OG D81: N D81: CA D81: C D81: O D81: CB D81: CG D81: OD1 D81: OD2 D82: N D82: CA D82: C D82: O D82: CB D82: CG D82: OD1 D82: OD2 D83: N D83: CA D83: C D83: O D83: CB D83: CG D83: CD1 D83: CD2 D83: CE1 D83: CE2 D83: CZ D84: N D84: CA D84: C D84: O D84: CB D85: N D85: CA D85: C D85: O D85: CB D85: CG D85: CD1 D85: CD2 D86: N D86: CA D86: C D86: O D86: CB D86: CG D86: CD1 D86: CD2 D86: CE1 D86: CE2 D86: CZ D86: OH D87: N D87: CA D87: C D87: O D87: CB D87: CG D87: CD1 D87: CD2 D87: CE1 D87: CE2 D87: CZ D87: OH D88: N D88: CA D88: C D88: O D88: CB D88: SG D89: N D89: CA D89: C D89: O D89: CB D89: CG D89: CD D89: OE1 D89: NE2 D90: N D90: CA D90: C D90: O D90: CB D90: CG D90: CD D90: OE1 D90: NE2 D91: N D91: CA D91: C D91: O D91: CB D91: CG D91: OD1 D91: OD2 D92: N D92: CA D92: C D92: O D92: CB D92: CG D92: CD1 D92: CD2 D92: CE1 D92: CE2 D92: CZ D92: OH D93: N D93: CA D93: C D93: O D93: CB D93: CG D93: CD1 D93: CD2 D93: CE1 D93: CE2 D93: CZ D93: OH D94: N D94: CA D94: C D94: O D94: CB D94: CG D94: CD1 D94: CD2 D94: NE1 D94: CE2 D94: CE3 D94: CZ2 D94: CZ3 D94: CH2 D95: N D95: CA D95: C D95: O D95: CB D95: CG D95: CD D96: N D96: CA D96: C D96: O D96: CB D96: CG1 D96: CG2 D97: N D97: CA D97: C D97: O D97: CB D97: OG1 D97: CG2 D98: N D98: CA D98: C D98: O D98: CB D98: CG D98: CD1 D98: CD2 D98: CE1 D98: CE2 D98: CZ D99: N D99: CA D99: C D99: O D100: N D100: CA D100: C D100: O D100: CB D100: CG D100: CD D100: OE1 D100: NE2 D101: N D101: CA D101: C D101: O D102: N D102: CA D102: C D102: O D102: CB D102: OG1 D102: CG2 D103: N D103: CA D103: C D103: O D103: CB D103: CG D103: CD D103: NE D103: CZ D103: NH1 D103: NH2 D104: N D104: CA D104: C D104: O D104: CB D104: CG D104: CD1 D104: CD2 D105: N D105: CA D105: C D105: O D105: CB D105: CG D105: OD1 D105: OD2 D106: N D106: CA D106: C D106: O D106: CB D106: CG D106: SD D106: CE D107: N D107: CA D107: C D107: O D107: CB D107: CG D107: CD D107: CE D107: NZ D108: N D108: CA D108: C D108: O D108: CB D108: CG D108: CD D108: NE D108: CZ D108: NH1 D108: NH2 D109: N D109: CA D109: C D109: O D109: CB D109: OG1 D109: CG2 D110: N D110: CA D110: C D110: O D110: CB D110: CG1 D110: CG2 D111: N D111: CA D111: C D111: O D111: CB D112: N D112: CA D112: C D112: O D112: CB D113: N D113: CA D113: C D113: O D113: CB D113: CG D113: CD D114: N D114: CA D114: C D114: O D114: CB D114: OG D115: N D115: CA D115: C D115: O D115: CB D115: CG1 D115: CG2 D116: N D116: CA D116: C D116: O D116: CB D116: CG D116: CD1 D116: CD2 D116: CE1 D116: CE2 D116: CZ D117: N D117: CA D117: C D117: O D117: CB D117: CG1 D117: CG2 D117: CD1 D118: N D118: CA D118: C D118: O D118: CB D118: CG D118: CD1 D118: CD2 D118: CE1 D118: CE2 D118: CZ D119: N D119: CA D119: C D119: O D119: CB D119: CG D119: CD D120: N D120: CA D120: C D120: O D120: CB D120: CG D120: CD D121: N D121: CA D121: C D121: O D121: CB D121: OG D122: N D122: CA D122: C D122: O D122: CB D122: CG D122: OD1 D122: OD2 D123: N D123: CA D123: C D123: O D123: CB D123: CG D123: CD D123: OE1 D123: OE2 D124: N D124: CA D124: C D124: O D124: CB D124: CG D124: CD D124: OE1 D124: NE2 D125: N D125: CA D125: C D125: O D125: CB D125: CG D125: CD1 D125: CD2 D126: N D126: CA D126: C D126: O D126: CB D126: CG D126: CD D126: CE D126: NZ D127: N D127: CA D127: C D127: O D127: CB D127: OG D128: N D128: CA D128: C D128: O D129: N D129: CA D129: C D129: O D129: CB D129: OG1 D129: CG2 D130: N D130: CA D130: C D130: O D130: CB D131: N D131: CA D131: C D131: O D131: CB D131: OG D132: N D132: CA D132: C D132: O D132: CB D132: CG1 D132: CG2 D133: N D133: CA D133: C D133: O D133: CB D133: CG1 D133: CG2 D134: N D134: CA D134: C D134: O D134: CB D134: SG D135: N D135: CA D135: C D135: O D135: CB D135: CG D135: CD1 D135: CD2 D136: N D136: CA D136: C D136: O D136: CB D136: CG D136: CD1 D136: CD2 D137: N D137: CA D137: C D137: O D137: CB D137: CG D137: OD1 D137: ND2 D138: N D138: CA D138: C D138: O D138: CB D138: CG D138: OD1 D138: ND2 D139: N D139: CA D139: C D139: O D139: CB D139: CG D139: CD1 D139: CD2 D139: CE1 D139: CE2 D139: CZ D140: N D140: CA D140: C D140: O D140: CB D140: CG D140: CD1 D140: CD2 D140: CE1 D140: CE2 D140: CZ D140: OH D141: N D141: CA D141: C D141: O D141: CB D141: CG D141: CD D142: N D142: CA D142: C D142: O D142: CB D142: CG D142: CD D142: NE D142: CZ D142: NH1 D142: NH2 D143: N D143: CA D143: C D143: O D143: CB D143: CG D143: CD D143: OE1 D143: OE2 D144: N D144: CA D144: C D144: O D144: CB D145: N D145: CA D145: C D145: O D145: CB D145: CG D145: CD D145: CE D145: NZ D146: N D146: CA D146: C D146: O D146: CB D146: CG1 D146: CG2 D147: N D147: CA D147: C D147: O D147: CB D147: CG D147: CD D147: OE1 D147: NE2 D148: N D148: CA D148: C D148: O D148: CB D148: CG D148: CD1 D148: CD2 D148: NE1 D148: CE2 D148: CE3 D148: CZ2 D148: CZ3 D148: CH2 D149: N D149: CA D149: C D149: O D149: CB D149: CG D149: CD D149: CE D149: NZ D150: N D150: CA D150: C D150: O D150: CB D150: CG1 D150: CG2 D151: N D151: CA D151: C D151: O D151: CB D151: CG D151: OD1 D151: OD2 D152: N D152: CA D152: C D152: O D152: CB D152: CG D152: OD1 D152: ND2 D153: N D153: CA D153: C D153: O D153: CB D154: N D154: CA D154: C D154: O D154: CB D154: CG D154: CD1 D154: CD2 D155: N D155: CA D155: C D155: O D155: CB D155: CG D155: CD D155: OE1 D155: NE2 D156: N D156: CA D156: C D156: O D156: CB D156: OG D157: N D157: CA D157: C D157: O D158: N D158: CA D158: C D158: O D158: CB D158: CG D158: OD1 D158: ND2 D159: N D159: CA D159: C D159: O D159: CB D159: OG D160: N D160: CA D160: C D160: O D160: CB D160: CG D160: CD D160: OE1 D160: NE2 D161: N D161: CA D161: C D161: O D161: CB D161: CG D161: CD D161: OE1 D161: OE2 D162: N D162: CA D162: C D162: O D162: CB D162: OG D163: N D163: CA D163: C D163: O D163: CB D163: CG1 D163: CG2 D164: N D164: CA D164: C D164: O D164: CB D164: OG1 D164: CG2 D165: N D165: CA D165: C D165: O D165: CB D165: CG D165: CD D165: OE1 D165: OE2 D166: N D166: CA D166: C D166: O D166: CB D166: CG D166: CD D166: OE1 D166: NE2 D167: N D167: CA D167: C D167: O D167: CB D167: CG D167: OD1 D167: OD2 D168: N D168: CA D168: C D168: O D168: CB D168: OG D169: N D169: CA D169: C D169: O D169: CB D169: CG D169: CD D169: CE D169: NZ D170: N D170: CA D170: C D170: O D170: CB D170: CG D170: OD1 D170: OD2 D171: N D171: CA D171: C D171: O D171: CB D171: OG D172: N D172: CA D172: C D172: O D172: CB D172: OG1 D172: CG2 D173: N D173: CA D173: C D173: O D173: CB D173: CG D173: CD1 D173: CD2 D173: CE1 D173: CE2 D173: CZ D173: OH D174: N D174: CA D174: C D174: O D174: CB D174: OG D175: N D175: CA D175: C D175: O D175: CB D175: CG D175: CD1 D175: CD2 D176: N D176: CA D176: C D176: O D176: CB D176: OG D177: N D177: CA D177: C D177: O D177: CB D177: OG D178: N D178: CA D178: C D178: O D178: CB D178: OG1 D178: CG2 D179: N D179: CA D179: C D179: O D179: CB D179: CG D179: CD1 D179: CD2 D180: N D180: CA D180: C D180: O D180: CB D180: OG1 D180: CG2 D181: N D181: CA D181: C D181: O D181: CB D181: CG D181: CD1 D181: CD2 D182: N D182: CA D182: C D182: O D182: CB D182: OG D183: N D183: CA D183: C D183: O D183: CB D183: CG D183: CD D183: CE D183: NZ D184: N D184: CA D184: C D184: O D184: CB D185: N D185: CA D185: C D185: O D185: CB D185: CG D185: OD1 D185: OD2 D186: N D186: CA D186: C D186: O D186: CB D186: CG D186: CD1 D186: CD2 D186: CE1 D186: CE2 D186: CZ D186: OH D187: N D187: CA D187: C D187: O D187: CB D187: CG D187: CD D187: OE1 D187: OE2 D188: N D188: CA D188: C D188: O D188: CB D188: CG D188: CD D188: CE D188: NZ D189: N D189: CA D189: C D189: O D189: CB D189: CG D189: ND1 D189: CD2 D189: CE1 D189: NE2 D190: N D190: CA D190: C D190: O D190: CB D190: CG D190: CD D190: CE D190: NZ D191: N D191: CA D191: C D191: O D191: CB D191: CG1 D191: CG2 D192: N D192: CA D192: C D192: O D192: CB D192: CG D192: CD1 D192: CD2 D192: CE1 D192: CE2 D192: CZ D192: OH D193: N D193: CA D193: C D193: O D193: CB D194: N D194: CA D194: C D194: O D194: CB D194: SG D195: N D195: CA D195: C D195: O D195: CB D195: CG D195: CD D195: OE1 D195: OE2 D196: N D196: CA D196: C D196: O D196: CB D196: CG1 D196: CG2 D197: N D197: CA D197: C D197: O D197: CB D197: OG1 D197: CG2 D198: N D198: CA D198: C D198: O D198: CB D198: CG D198: ND1 D198: CD2 D198: CE1 D198: NE2 D199: N D199: CA D199: C D199: O D199: CB D199: CG D199: CD D199: OE1 D199: NE2 D200: N D200: CA D200: C D200: O D201: N D201: CA D201: C D201: O D201: CB D201: CG D201: CD1 D201: CD2 D202: N D202: CA D202: C D202: O D202: CB D202: OG D203: N D203: CA D203: C D203: O D203: CB D203: OG D204: N D204: CA D204: C D204: O D204: CB D204: CG D204: CD D205: N D205: CA D205: C D205: O D205: CB D205: CG1 D205: CG2 D206: N D206: CA D206: C D206: O D206: CB D206: OG1 D206: CG2 D207: N D207: CA D207: C D207: O D207: CB D207: CG D207: CD D207: CE D207: NZ D208: N D208: CA D208: C D208: O D208: CB D208: OG D209: N D209: CA D209: C D209: O D209: CB D209: CG D209: CD1 D209: CD2 D209: CE1 D209: CE2 D209: CZ D210: N D210: CA D210: C D210: O D210: CB D210: CG D210: OD1 D210: ND2 D211: N D211: CA D211: C D211: O D211: CB D211: CG D211: CD D211: NE D211: CZ D211: NH1 D211: NH2 D212: N D212: CA D212: C D212: O D213: N D213: CA D213: C D213: O D213: CB D213: CG D213: CD D213: OE1 D213: OE2 D214: N D214: CA D214: C D214: O D214: CB D214: SG G1: N G1: CA G1: C G1: O G1: CB G1: CG G1: CD G1: OE1 G1: NE2 G2: N G2: CA G2: C G2: O G2: CB G2: CG1 G2: CG2 G3: N G3: CA G3: C G3: O G3: CB G3: CG G3: CD G3: OE1 G3: NE2 G4: N G4: CA G4: C G4: O G4: CB G4: CG G4: CD1 G4: CD2 G5: N G5: CA G5: C G5: O G5: CB G5: CG1 G5: CG2 G5: CD1 G6: N G6: CA G6: C G6: O G6: CB G6: CG G6: CD G6: OE1 G6: NE2 G7: N G7: CA G7: C G7: O G7: CB G7: OG G8: N G8: CA G8: C G8: O G9: N G9: CA G9: C G9: O G9: CB G9: CG G9: CD G10: N G10: CA G10: C G10: O G10: CB G10: CG G10: CD G10: OE1 G10: NE2 G11: N G11: CA G11: C G11: O G11: CB G11: CG G11: CD1 G11: CD2 G11: CE1 G11: CE2 G11: CZ G12: N G12: CA G12: C G12: O G12: CB G12: CG G12: CD G12: CE G12: NZ G13: N G13: CA G13: C G13: O G13: CB G13: OG1 G13: CG2 G14: N G14: CA G14: C G14: O G14: CB G14: CG G14: CD G15: N G15: CA G15: C G15: O G16: N G16: CA G16: C G16: O G16: CB G17: N G17: CA G17: C G17: O G17: CB G17: OG G18: N G18: CA G18: C G18: O G18: CB G18: CG1 G18: CG2 G19: N G19: CA G19: C G19: O G19: CB G19: OG1 G19: CG2 G20: N G20: CA G20: C G20: O G20: CB G20: CG1 G20: CG2 G21: N G21: CA G21: C G21: O G21: CB G21: OG G22: N G22: CA G22: C G22: O G22: CB G22: SG G23: N G23: CA G23: C G23: O G23: CB G23: CG G23: CD G23: CE G23: NZ G24: N G24: CA G24: C G24: O G24: CB G25: N G25: CA G25: C G25: O G25: CB G25: OG G26: N G26: CA G26: C G26: O G27: N G27: CA G27: C G27: O G27: CB G27: CG G27: CD1 G27: CD2 G27: CE1 G27: CE2 G27: CZ G27: OH G28: N G28: CA G28: C G28: O G28: CB G28: CG1 G28: CG2 G28: CD1 G29: N G29: CA G29: C G29: O G29: CB G29: CG G29: CD1 G29: CD2 G29: CE1 G29: CE2 G29: CZ G30: N G30: CA G30: C G30: O G30: CB G30: OG1 G30: CG2 G31: N G31: CA G31: C G31: O G31: CB G31: CG G31: OD1 G31: OD2 G32: N G32: CA G32: C G32: O G32: CB G32: CG G32: CD1 G32: CD2 G32: CE1 G32: CE2 G32: CZ G32: OH G33: N G33: CA G33: C G33: O G33: CB G33: CG G33: CD1 G33: CD2 G34: N G34: CA G34: C G34: O G34: CB G34: CG1 G34: CG2 G34: CD1 G35: N G35: CA G35: C G35: O G35: CB G35: CG G35: ND1 G35: CD2 G35: CE1 G35: NE2 G36: N G36: CA G36: C G36: O G36: CB G36: CG G36: CD1 G36: CD2 G36: NE1 G36: CE2 G36: CE3 G36: CZ2 G36: CZ3 G36: CH2 G37: N G37: CA G37: C G37: O G37: CB G37: CG1 G37: CG2 G38: N G38: CA G38: C G38: O G38: CB G38: CG G38: CD G38: NE G38: CZ G38: NH1 G38: NH2 G39: N G39: CA G39: C G39: O G39: CB G39: CG G39: CD1 G39: CD2 G40: N G40: CA G40: C G40: O G40: CB G40: CG1 G40: CG2 G41: N G41: CA G41: C G41: O G41: CB G41: CG G41: CD G42: N G42: CA G42: C G42: O G43: N G43: CA G43: C G43: O G43: CB G43: CG G43: CD G43: CE G43: NZ G44: N G44: CA G44: C G44: O G45: N G45: CA G45: C G45: O G45: CB G45: CG G45: CD1 G45: CD2 G46: N G46: CA G46: C G46: O G46: CB G46: CG G46: CD G46: OE1 G46: OE2 G47: N G47: CA G47: C G47: O G47: CB G47: CG G47: CD1 G47: CD2 G47: NE1 G47: CE2 G47: CE3 G47: CZ2 G47: CZ3 G47: CH2 G48: N G48: CA G48: C G48: O G48: CB G48: CG G48: CD1 G48: CD2 G49: N G49: CA G49: C G49: O G50: N G50: CA G50: C G50: O G50: CB G50: CG G50: CD G50: NE G50: CZ G50: NH1 G50: NH2 G51: N G51: CA G51: C G51: O G51: CB G51: CG1 G51: CG2 G51: CD1 G52: N G52: CA G52: C G52: O G52: CB G52: CG G52: OD1 G52: ND2 G53: N G53: CA G53: C G53: O G53: CB G53: OG1 G53: CG2 G54: N G54: CA G54: C G54: O G54: CB G54: CG G54: OD1 G54: ND2 G55: N G55: CA G55: C G55: O G55: CB G56: N G56: CA G56: C G56: O G57: N G57: CA G57: C G57: O G57: CB G57: CG G57: CD1 G57: CD2 G58: N G58: CA G58: C G58: O G58: CB G58: CG G58: SD G58: CE G59: N G59: CA G59: C G59: O G59: CB G59: CG G59: CD1 G59: CD2 G59: CE1 G59: CE2 G59: CZ G59: OH G60: N G60: CA G60: C G60: O G60: CB G60: CG G60: CD1 G60: CD2 G61: N G61: CA G61: C G61: O G61: CB G61: OG G62: N G62: CA G62: C G62: O G62: CB G62: CG G62: ND1 G62: CD2 G62: CE1 G62: NE2 G63: N G63: CA G63: C G63: O G63: CB G63: CG G63: CD G63: CE G63: NZ G64: N G64: CA G64: C G64: O G64: CB G64: CG G64: CD1 G64: CD2 G64: CE1 G64: CE2 G64: CZ G65: N G65: CA G65: C G65: O G65: CB G65: CG G65: CD G65: OE1 G65: OE2 G66: N G66: CA G66: C G66: O G67: N G67: CA G67: C G67: O G67: CB G67: CG G67: CD G67: NE G67: CZ G67: NH1 G67: NH2 G68: N G68: CA G68: C G68: O G68: CB G68: CG G68: CD1 G68: CD2 G69: N G69: CA G69: C G69: O G69: CB G69: CG1 G69: CG2 G69: CD1 G70: N G70: CA G70: C G70: O G70: CB G70: CG G70: CD1 G70: CD2 G71: N G71: CA G71: C G71: O G71: CB G71: CG G71: CD G71: NE G71: CZ G71: NH1 G71: NH2 G72: N G72: CA G72: C G72: O G72: CB G72: CG G72: CD G72: NE G72: CZ G72: NH1 G72: NH2 G73: N G73: CA G73: C G73: O G73: CB G73: CG1 G73: CG2 G74: N G74: CA G74: C G74: O G74: CB G74: CG1 G74: CG2 G75: N G75: CA G75: C G75: O G75: CB G75: CG G75: OD1 G75: OD2 G76: N G76: CA G76: C G76: O G76: CB G76: CG G76: CD1 G76: CD2 G76: NE1 G76: CE2 G76: CE3 G76: CZ2 G76: CZ3 G76: CH2 G77: N G77: CA G77: C G77: O G77: CB G77: CG G77: CD G77: NE G77: CZ G77: NH1 G77: NH2 G78: N G78: CA G78: C G78: O G78: CB G78: OG1 G78: CG2 G79: N G79: CA G79: C G79: O G79: CB G79: CG G79: CD G80: N G80: CA G80: C G80: O G80: CB G80: OG G81: N G81: CA G81: C G81: O G81: CB G81: CG G81: CD1 G81: CD2 G82: N G82: CA G82: C G82: O G83: N G83: CA G83: C G83: O G83: CB G83: OG1 G83: CG2 G84: N G84: CA G84: C G84: O G84: CB G84: CG1 G84: CG2 G85: N G85: CA G85: C G85: O G85: CB G85: CG G85: OD1 G85: ND2 G86: N G86: CA G86: C G86: O G86: CB G86: CG G86: SD G86: CE G87: N G87: CA G87: C G87: O G87: CB G87: CG G87: CD G87: OE1 G87: OE2 G88: N G88: CA G88: C G88: O G88: CB G88: CG G88: CD1 G88: CD2 G89: N G89: CA G89: C G89: O G89: CB G89: CG G89: CD G89: NE G89: CZ G89: NH1 G89: NH2 G90: N G90: CA G90: C G90: O G90: CB G90: CG G90: OD1 G90: ND2 G91: N G91: CA G91: C G91: O G91: CB G91: CG1 G91: CG2 G92: N G92: CA G92: C G92: O G92: CB G92: CG G92: CD G92: NE G92: CZ G92: NH1 G92: NH2 G93: N G93: CA G93: C G93: O G93: CB G93: OG G94: N G94: CA G94: C G94: O G94: CB G94: CG G94: OD1 G94: OD2 G95: N G95: CA G95: C G95: O G95: CB G95: CG G95: OD1 G95: OD2 G96: N G96: CA G96: C G96: O G96: CB G96: OG G97: N G97: CA G97: C G97: O G97: CB G98: N G98: CA G98: C G98: O G98: CB G98: CG1 G98: CG2 G98: CD1 G99: N G99: CA G99: C G99: O G99: CB G99: CG G99: CD1 G99: CD2 G99: CE1 G99: CE2 G99: CZ G99: OH G100: N G100: CA G100: C G100: O G100: CB G100: CG G100: CD1 G100: CD2 G100: CE1 G100: CE2 G100: CZ G101: N G101: CA G101: C G101: O G101: CB G101: SG G102: N G102: CA G102: C G102: O G103: N G103: CA G103: C G103: O G103: CB G103: CG G103: CD G103: NE G103: CZ G103: NH1 G103: NH2 G104: N G104: CA G104: C G104: O G104: CB G104: CG1 G104: CG2 G105: N G105: CA G105: C G105: O G105: CB G105: CG1 G105: CG2 G106: N G106: CA G106: C G106: O G106: CB G106: CG G106: OD1 G106: OD2 G107: N G107: CA G107: C G107: O G108: N G108: CA G108: C G108: O G108: CB G108: CG G108: CD1 G108: CD2 G108: CE1 G108: CE2 G108: CZ G109: N G109: CA G109: C G109: O G109: CB G109: CG G109: OD1 G109: ND2 G110: N G110: CA G110: C G110: O G110: CB G111: N G111: CA G111: C G111: O G111: CB G112: N G112: CA G112: C G112: O G113: N G113: CA G113: C G113: O G113: CB G113: CG G113: CD G114: N G114: CA G114: C G114: O G114: CB G114: CG G114: CD1 G114: CD2 G115: N G115: CA G115: C G115: O G115: CB G115: CG G115: CD G115: OE1 G115: OE2 G116: N G116: CA G116: C G116: O G116: CB G116: CG G116: CD1 G116: CD2 G116: CE1 G116: CE2 G116: CZ G117: N G117: CA G117: C G117: O G117: CB G117: CG G117: CD1 G117: CD2 G117: NE1 G117: CE2 G117: CE3 G117: CZ2 G117: CZ3 G117: CH2 G118: N G118: CA G118: C G118: O G119: N G119: CA G119: C G119: O G119: CB G119: CG G119: CD G119: OE1 G119: NE2 G120: N G120: CA G120: C G120: O G121: N G121: CA G121: C G121: O G121: CB G121: OG G122: N G122: CA G122: C G122: O G122: CB G122: CG G122: CD G123: N G123: CA G123: C G123: O G123: CB G123: CG1 G123: CG2 G124: N G124: CA G124: C G124: O G124: CB G124: CG1 G124: CG2 G124: CD1 G125: N G125: CA G125: C G125: O G125: CB G125: CG1 G125: CG2 G126: N G126: CA G126: C G126: O G126: CB G126: OG G127: N G127: CA G127: C G127: O G127: CB G127: OG G129: N G129: CA G129: C G129: O G129: CB G130: N G130: CA G130: C G130: O G130: CB G130: OG G131: N G131: CA G131: C G131: O G131: CB G131: OG1 G131: CG2 G132: N G132: CA G132: C G132: O G132: CB G132: CG G132: CD G132: CE G132: NZ G133: N G133: CA G133: C G133: O G134: N G134: CA G134: C G134: O G134: CB G134: CG G134: CD G135: N G135: CA G135: C G135: O G135: CB G135: OG G136: N G136: CA G136: C G136: O G136: CB G136: CG1 G136: CG2 G137: N G137: CA G137: C G137: O G137: CB G137: CG G137: CD1 G137: CD2 G137: CE1 G137: CE2 G137: CZ G138: N G138: CA G138: C G138: O G138: CB G138: CG G138: CD G139: N G139: CA G139: C G139: O G139: CB G139: CG G139: CD1 G139: CD2 G140: N G140: CA G140: C G140: O G140: CB G141: N G141: CA G141: C G141: O G141: CB G141: CG G141: CD G142: N G142: CA G142: C G142: O G142: CB G142: OG G143: N G143: CA G143: C G143: O G143: CB G143: OG G144: N G144: CA G144: C G144: O G144: CB G144: CG G144: CD G144: CE G144: NZ G145: N G145: CA G145: C G145: O G145: CB G145: OG G146: N G146: CA G146: C G146: O G146: CB G146: OG1 G146: CG2 G147: N G147: CA G147: C G147: O G147: CB G147: OG G148: N G148: CA G148: C G148: O G149: N G149: CA G149: C G149: O G150: N G150: CA G150: C G150: O G150: CB G150: OG1 G150: CG2 G151: N G151: CA G151: C G151: O G151: CB G152: N G152: CA G152: C G152: O G152: CB G153: N G153: CA G153: C G153: O G153: CB G153: CG G153: CD1 G153: CD2 G154: N G154: CA G154: C G154: O G155: N G155: CA G155: C G155: O G155: CB G155: SG G156: N G156: CA G156: C G156: O G156: CB G156: CG G156: CD1 G156: CD2 G157: N G157: CA G157: C G157: O G157: CB G157: CG1 G157: CG2 G158: N G158: CA G158: C G158: O G158: CB G158: CG G158: CD G158: CE G158: NZ G159: N G159: CA G159: C G159: O G159: CB G159: CG G159: OD1 G159: OD2 G160: N G160: CA G160: C G160: O G160: CB G160: CG G160: CD1 G160: CD2 G160: CE1 G160: CE2 G160: CZ G160: OH G161: N G161: CA G161: C G161: O G161: CB G161: CG G161: CD1 G161: CD2 G161: CE1 G161: CE2 G161: CZ G162: N G162: CA G162: C G162: O G162: CB G162: CG G162: CD G163: N G163: CA G163: C G163: O G163: CB G163: CG G163: CD G163: OE1 G163: OE2 G164: N G164: CA G164: C G164: O G164: CB G164: CG G164: CD G165: N G165: CA G165: C G165: O G165: CB G165: CG1 G165: CG2 G166: N G166: CA G166: C G166: O G166: CB G166: OG1 G166: CG2 G167: N G167: CA G167: C G167: O G167: CB G167: CG1 G167: CG2 G168: N G168: CA G168: C G168: O G168: CB G168: OG G169: N G169: CA G169: C G169: O G169: CB G169: CG G169: CD1 G169: CD2 G169: NE1 G169: CE2 G169: CE3 G169: CZ2 G169: CZ3 G169: CH2 G170: N G170: CA G170: C G170: O G170: CB G170: CG G170: OD1 G170: ND2 G171: N G171: CA G171: C G171: O G171: CB G171: OG G172: N G172: CA G172: C G172: O G173: N G173: CA G173: C G173: O G173: CB G174: N G174: CA G174: C G174: O G174: CB G174: CG G174: CD1 G174: CD2 G175: N G175: CA G175: C G175: O G175: CB G175: OG1 G175: CG2 G176: N G176: CA G176: C G176: O G176: CB G176: OG G177: N G177: CA G177: C G177: O G178: N G178: CA G178: C G178: O G178: CB G178: CG1 G178: CG2 G179: N G179: CA G179: C G179: O G179: CB G179: CG G179: ND1 G179: CD2 G179: CE1 G179: NE2 G180: N G180: CA G180: C G180: O G180: CB G180: OG1 G180: CG2 G181: N G181: CA G181: C G181: O G181: CB G181: CG G181: CD1 G181: CD2 G181: CE1 G181: CE2 G181: CZ G182: N G182: CA G182: C G182: O G182: CB G182: CG G182: CD G183: N G183: CA G183: C G183: O G183: CB G184: N G184: CA G184: C G184: O G184: CB G184: CG1 G184: CG2 G185: N G185: CA G185: C G185: O G185: CB G185: CG G185: CD1 G185: CD2 G186: N G186: CA G186: C G186: O G186: CB G186: CG G186: CD G186: OE1 G186: NE2 G187: N G187: CA G187: C G187: O G187: CB G187: OG G188: N G188: CA G188: C G188: O G188: CB G188: OG G189: N G189: CA G189: C G189: O G190: N G190: CA G190: C G190: O G190: CB G190: CG G190: CD1 G190: CD2 G191: N G191: CA G191: C G191: O G191: CB G191: CG G191: CD1 G191: CD2 G191: CE1 G191: CE2 G191: CZ G191: OH G192: N G192: CA G192: C G192: O G192: CB G192: OG G193: N G193: CA G193: C G193: O G193: CB G193: CG G193: CD1 G193: CD2 G194: N G194: CA G194: C G194: O G194: CB G194: OG G195: N G195: CA G195: C G195: O G195: CB G195: OG G196: N G196: CA G196: C G196: O G196: CB G196: CG1 G196: CG2 G197: N G197: CA G197: C G197: O G197: CB G197: CG1 G197: CG2 G198: N G198: CA G198: C G198: O G198: CB G198: OG1 G198: CG2 G199: N G199: CA G199: C G199: O G199: CB G199: CG1 G199: CG2 G200: N G200: CA G200: C G200: O G200: CB G200: CG G200: CD G201: N G201: CA G201: C G201: O G201: CB G201: OG G202: N G202: CA G202: C G202: O G202: CB G202: OG G203: N G203: CA G203: C G203: O G203: CB G203: OG G204: N G204: CA G204: C G204: O G204: CB G204: CG G204: CD1 G204: CD2 G205: N G205: CA G205: C G205: O G206: N G206: CA G206: C G206: O G206: CB G206: OG1 G206: CG2 G207: N G207: CA G207: C G207: O G207: CB G207: CG G207: CD G207: OE1 G207: NE2 G208: N G208: CA G208: C G208: O G208: CB G208: OG1 G208: CG2 G209: N G209: CA G209: C G209: O G209: CB G209: CG G209: CD1 G209: CD2 G209: CE1 G209: CE2 G209: CZ G209: OH G210: N G210: CA G210: C G210: O G210: CB G210: CG1 G210: CG2 G210: CD1 G211: N G211: CA G211: C G211: O G211: CB G211: SG G212: N G212: CA G212: C G212: O G212: CB G212: CG G212: OD1 G212: ND2 G213: N G213: CA G213: C G213: O G213: CB G213: CG1 G213: CG2 G214: N G214: CA G214: C G214: O G214: CB G214: CG G214: OD1 G214: ND2 G215: N G215: CA G215: C G215: O G215: CB G215: CG G215: ND1 G215: CD2 G215: CE1 G215: NE2 G216: N G216: CA G216: C G216: O G216: CB G216: CG G216: CD G216: CE G216: NZ G217: N G217: CA G217: C G217: O G217: CB G217: CG G217: CD G218: N G218: CA G218: C G218: O G218: CB G218: OG G219: N G219: CA G219: C G219: O G219: CB G219: CG G219: OD1 G219: ND2 G220: N G220: CA G220: C G220: O G220: CB G220: OG1 G220: CG2 G221: N G221: CA G221: C G221: O G221: CB G221: CG G221: CD G221: CE G221: NZ G222: N G222: CA G222: C G222: O G222: CB G222: CG1 G222: CG2 G223: N G223: CA G223: C G223: O G223: CB G223: CG G223: OD1 G223: OD2 G224: N G224: CA G224: C G224: O G224: CB G224: CG G224: CD G224: CE G224: NZ G225: N G225: CA G225: C G225: O G225: CB G225: CG G225: CD G225: CE G225: NZ G226: N G226: CA G226: C G226: O G226: CB G226: CG1 G226: CG2 G227: N G227: CA G227: C G227: O G227: CB G227: CG G227: CD G227: OE1 G227: OE2 G228: N G228: CA G228: C G228: O G228: CB G228: CG G228: CD G229: N G229: CA G229: C G229: O G229: CB G229: CG G229: CD G229: CE G229: NZ G230: N G230: CA G230: C G230: O G230: CB G230: OG H1: N H1: CA H1: C H1: O H1: CB H1: CG H1: CD H1: OE1 H1: NE2 H2: N H2: CA H2: C H2: O H2: CB H2: CG1 H2: CG2 H3: N H3: CA H3: C H3: O H3: CB H3: CG1 H3: CG2 H4: N H4: CA H4: C H4: O H4: CB H4: CG H4: SD H4: CE H5: N H5: CA H5: C H5: O H5: CB H5: OG1 H5: CG2 H6: N H6: CA H6: C H6: O H6: CB H6: CG H6: CD H6: OE1 H6: NE2 H7: N H7: CA H7: C H7: O H7: CB H7: OG H8: N H8: CA H8: C H8: O H8: CB H8: CG H8: CD H9: N H9: CA H9: C H9: O H9: CB H10: N H10: CA H10: C H10: O H10: CB H10: OG1 H10: CG2 H11: N H11: CA H11: C H11: O H11: CB H11: CG H11: CD1 H11: CD2 H12: N H12: CA H12: C H12: O H12: CB H12: OG H13: N H13: CA H13: C H13: O H13: CB H13: CG H13: CD1 H13: CD2 H14: N H14: CA H14: C H14: O H14: CB H14: OG H15: N H15: CA H15: C H15: O H15: CB H15: CG H15: CD H16: N H16: CA H16: C H16: O H17: N H17: CA H17: C H17: O H17: CB H17: CG H17: CD H17: OE1 H17: OE2 H18: N H18: CA H18: C H18: O H18: CB H18: OG1 H18: CG2 H19: N H19: CA H19: C H19: O H19: CB H20: N H20: CA H20: C H20: O H20: CB H21: N H21: CA H21: C H21: O H21: CB H21: CG1 H21: CG2 H22: N H22: CA H22: C H22: O H22: CB H22: OG H23: N H23: CA H23: C H23: O H23: CB H23: SG H24: N H24: CA H24: C H24: O H24: CB H24: CG H24: CD H24: NE H24: CZ H24: NH1 H24: NH2 H25: N H25: CA H25: C H25: O H25: CB H26: N H26: CA H26: C H26: O H26: CB H26: OG H27: N H27: CA H27: C H27: O H27: CB H27: CG H27: CD H27: OE1 H27: NE2 H28: N H28: CA H28: C H28: O H28: CB H28: CG H28: CD1 H28: CD2 H28: CE1 H28: CE2 H28: CZ H28: OH H29: N H29: CA H29: C H29: O H29: CB H29: CG1 H29: CG2 H30: N H30: CA H30: C H30: O H30: CB H30: CG H30: OD1 H30: OD2 H31: N H31: CA H31: C H31: O H31: CB H31: CG H31: CD H31: NE H31: CZ H31: NH1 H31: NH2 H32: N H32: CA H32: C H32: O H32: CB H32: OG H33: N H33: CA H33: C H33: O H33: CB H33: CG1 H33: CG2 H33: CD1 H34: N H34: CA H34: C H34: O H34: CB H34: OG H35: N H35: CA H35: C H35: O H35: CB H35: CG H35: CD1 H35: CD2 H35: NE1 H35: CE2 H35: CE3 H35: CZ2 H35: CZ3 H35: CH2 H36: N H36: CA H36: C H36: O H36: CB H36: CG H36: CD1 H36: CD2 H36: CE1 H36: CE2 H36: CZ H36: OH H37: N H37: CA H37: C H37: O H37: CB H37: CG H37: CD H37: OE1 H37: NE2 H38: N H38: CA H38: C H38: O H38: CB H38: CG H38: CD1 H38: CD2 H39: N H39: CA H39: C H39: O H39: CB H39: CG H39: CD H39: CE H39: NZ H40: N H40: CA H40: C H40: O H40: CB H40: OG1 H40: CG2 H41: N H41: CA H41: C H41: O H42: N H42: CA H42: C H42: O H42: CB H42: CG H42: CD H42: NE H42: CZ H42: NH1 H42: NH2 H43: N H43: CA H43: C H43: O H43: CB H44: N H44: CA H44: C H44: O H44: CB H44: CG H44: CD H45: N H45: CA H45: C H45: O H45: CB H45: CG H45: CD H45: NE H45: CZ H45: NH1 H45: NH2 H46: N H46: CA H46: C H46: O H46: CB H46: CG H46: CD1 H46: CD2 H47: N H47: CA H47: C H47: O H47: CB H47: CG H47: CD1 H47: CD2 H48: N H48: CA H48: C H48: O H48: CB H48: CG1 H48: CG2 H49: N H49: CA H49: C H49: O H49: CB H49: CG H49: CD1 H49: CD2 H49: CE1 H49: CE2 H49: CZ H49: OH H50: N H50: CA H50: C H50: O H50: CB H51: N H51: CA H51: C H51: O H51: CB H52: N H52: CA H52: C H52: O H52: CB H52: OG H53: N H53: CA H53: C H53: O H53: CB H53: OG H54: N H54: CA H54: C H54: O H54: CB H54: CG H54: CD H54: NE H54: CZ H54: NH1 H54: NH2 H55: N H55: CA H55: C H55: O H55: CB H55: OG H56: N H56: CA H56: C H56: O H56: CB H56: CG1 H56: CG2 H56: CD1 H57: N H57: CA H57: C H57: O H58: N H58: CA H58: C H58: O H58: CB H58: CG1 H58: CG2 H59: N H59: CA H59: C H59: O H59: CB H59: CG H59: CD H60: N H60: CA H60: C H60: O H60: CB H60: CG H60: OD1 H60: OD2 H61: N H61: CA H61: C H61: O H61: CB H61: CG H61: CD H61: NE H61: CZ H61: NH1 H61: NH2 H62: N H62: CA H62: C H62: O H62: CB H62: CG H62: CD1 H62: CD2 H62: CE1 H62: CE2 H62: CZ H63: N H63: CA H63: C H63: O H63: CB H63: OG H64: N H64: CA H64: C H64: O H65: N H65: CA H65: C H65: O H65: CB H65: OG H66: N H66: CA H66: C H66: O H67: N H67: CA H67: C H67: O H67: CB H67: OG H68: N H68: CA H68: C H68: O H69: N H69: CA H69: C H69: O H69: CB H69: CG H69: CD H69: NE H69: CZ H69: NH1 H69: NH2 H70: N H70: CA H70: C H70: O H70: CB H70: CG H70: OD1 H70: OD2 H71: N H71: CA H71: C H71: O H71: CB H71: CG H71: CD1 H71: CD2 H71: CE1 H71: CE2 H71: CZ H72: N H72: CA H72: C H72: O H72: CB H72: OG1 H72: CG2 H73: N H73: CA H73: C H73: O H73: CB H73: CG H73: CD1 H73: CD2 H74: N H74: CA H74: C H74: O H74: CB H74: OG1 H74: CG2 H75: N H75: CA H75: C H75: O H75: CB H75: CG1 H75: CG2 H75: CD1 H76: N H76: CA H76: C H76: O H76: CB H76: CG H76: CD H76: NE H76: CZ H76: NH1 H76: NH2 H77: N H77: CA H77: C H77: O H78: N H78: CA H78: C H78: O H78: CB H78: CG1 H78: CG2 H79: N H79: CA H79: C H79: O H79: CB H79: CG H79: CD H79: OE1 H79: NE2 H80: N H80: CA H80: C H80: O H80: CB H80: OG H81: N H81: CA H81: C H81: O H81: CB H81: CG H81: OD1 H81: OD2 H82: N H82: CA H82: C H82: O H82: CB H82: CG H82: OD1 H82: OD2 H83: N H83: CA H83: C H83: O H83: CB H83: CG H83: CD1 H83: CD2 H83: CE1 H83: CE2 H83: CZ H84: N H84: CA H84: C H84: O H84: CB H85: N H85: CA H85: C H85: O H85: CB H85: CG H85: CD1 H85: CD2 H86: N H86: CA H86: C H86: O H86: CB H86: CG H86: CD1 H86: CD2 H86: CE1 H86: CE2 H86: CZ H86: OH H87: N H87: CA H87: C H87: O H87: CB H87: CG H87: CD1 H87: CD2 H87: CE1 H87: CE2 H87: CZ H87: OH H88: N H88: CA H88: C H88: O H88: CB H88: SG H89: N H89: CA H89: C H89: O H89: CB H89: CG H89: CD H89: OE1 H89: NE2 H90: N H90: CA H90: C H90: O H90: CB H90: CG H90: CD H90: OE1 H90: NE2 H91: N H91: CA H91: C H91: O H91: CB H91: CG H91: OD1 H91: OD2 H92: N H92: CA H92: C H92: O H92: CB H92: CG H92: CD1 H92: CD2 H92: CE1 H92: CE2 H92: CZ H92: OH H93: N H93: CA H93: C H93: O H93: CB H93: CG H93: CD1 H93: CD2 H93: CE1 H93: CE2 H93: CZ H93: OH H94: N H94: CA H94: C H94: O H94: CB H94: CG H94: CD1 H94: CD2 H94: NE1 H94: CE2 H94: CE3 H94: CZ2 H94: CZ3 H94: CH2 H95: N H95: CA H95: C H95: O H95: CB H95: CG H95: CD H96: N H96: CA H96: C H96: O H96: CB H96: CG1 H96: CG2 H97: N H97: CA H97: C H97: O H97: CB H97: OG1 H97: CG2 H98: N H98: CA H98: C H98: O H98: CB H98: CG H98: CD1 H98: CD2 H98: CE1 H98: CE2 H98: CZ H99: N H99: CA H99: C H99: O H100: N H100: CA H100: C H100: O H100: CB H100: CG H100: CD H100: OE1 H100: NE2 H101: N H101: CA H101: C H101: O H102: N H102: CA H102: C H102: O H102: CB H102: OG1 H102: CG2 H103: N H103: CA H103: C H103: O H103: CB H103: CG H103: CD H103: NE H103: CZ H103: NH1 H103: NH2 H104: N H104: CA H104: C H104: O H104: CB H104: CG H104: CD1 H104: CD2 H105: N H105: CA H105: C H105: O H105: CB H105: CG H105: OD1 H105: OD2 H106: N H106: CA H106: C H106: O H106: CB H106: CG H106: SD H106: CE H107: N H107: CA H107: C H107: O H107: CB H107: CG H107: CD H107: CE H107: NZ H108: N H108: CA H108: C H108: O H108: CB H108: CG H108: CD H108: NE H108: CZ H108: NH1 H108: NH2 H109: N H109: CA H109: C H109: O H109: CB H109: OG1 H109: CG2 H110: N H110: CA H110: C H110: O H110: CB H110: CG1 H110: CG2 H111: N H111: CA H111: C H111: O H111: CB H112: N H112: CA H112: C H112: O H112: CB H113: N H113: CA H113: C H113: O H113: CB H113: CG H113: CD H114: N H114: CA H114: C H114: O H114: CB H114: OG H115: N H115: CA H115: C H115: O H115: CB H115: CG1 H115: CG2 H116: N H116: CA H116: C H116: O H116: CB H116: CG H116: CD1 H116: CD2 H116: CE1 H116: CE2 H116: CZ H117: N H117: CA H117: C H117: O H117: CB H117: CG1 H117: CG2 H117: CD1 H118: N H118: CA H118: C H118: O H118: CB H118: CG H118: CD1 H118: CD2 H118: CE1 H118: CE2 H118: CZ H119: N H119: CA H119: C H119: O H119: CB H119: CG H119: CD H120: N H120: CA H120: C H120: O H120: CB H120: CG H120: CD H121: N H121: CA H121: C H121: O H121: CB H121: OG H122: N H122: CA H122: C H122: O H122: CB H122: CG H122: OD1 H122: OD2 H123: N H123: CA H123: C H123: O H123: CB H123: CG H123: CD H123: OE1 H123: OE2 H124: N H124: CA H124: C H124: O H124: CB H124: CG H124: CD H124: OE1 H124: NE2 H125: N H125: CA H125: C H125: O H125: CB H125: CG H125: CD1 H125: CD2 H126: N H126: CA H126: C H126: O H126: CB H126: CG H126: CD H126: CE H126: NZ H127: N H127: CA H127: C H127: O H127: CB H127: OG H128: N H128: CA H128: C H128: O H129: N H129: CA H129: C H129: O H129: CB H129: OG1 H129: CG2 H130: N H130: CA H130: C H130: O H130: CB H131: N H131: CA H131: C H131: O H131: CB H131: OG H132: N H132: CA H132: C H132: O H132: CB H132: CG1 H132: CG2 H133: N H133: CA H133: C H133: O H133: CB H133: CG1 H133: CG2 H134: N H134: CA H134: C H134: O H134: CB H134: SG H135: N H135: CA H135: C H135: O H135: CB H135: CG H135: CD1 H135: CD2 H136: N H136: CA H136: C H136: O H136: CB H136: CG H136: CD1 H136: CD2 H137: N H137: CA H137: C H137: O H137: CB H137: CG H137: OD1 H137: ND2 H138: N H138: CA H138: C H138: O H138: CB H138: CG H138: OD1 H138: ND2 H139: N H139: CA H139: C H139: O H139: CB H139: CG H139: CD1 H139: CD2 H139: CE1 H139: CE2 H139: CZ H140: N H140: CA H140: C H140: O H140: CB H140: CG H140: CD1 H140: CD2 H140: CE1 H140: CE2 H140: CZ H140: OH H141: N H141: CA H141: C H141: O H141: CB H141: CG H141: CD H142: N H142: CA H142: C H142: O H142: CB H142: CG H142: CD H142: NE H142: CZ H142: NH1 H142: NH2 H143: N H143: CA H143: C H143: O H143: CB H143: CG H143: CD H143: OE1 H143: OE2 H144: N H144: CA H144: C H144: O H144: CB H145: N H145: CA H145: C H145: O H145: CB H145: CG H145: CD H145: CE H145: NZ H146: N H146: CA H146: C H146: O H146: CB H146: CG1 H146: CG2 H147: N H147: CA H147: C H147: O H147: CB H147: CG H147: CD H147: OE1 H147: NE2 H148: N H148: CA H148: C H148: O H148: CB H148: CG H148: CD1 H148: CD2 H148: NE1 H148: CE2 H148: CE3 H148: CZ2 H148: CZ3 H148: CH2 H149: N H149: CA H149: C H149: O H149: CB H149: CG H149: CD H149: CE H149: NZ H150: N H150: CA H150: C H150: O H150: CB H150: CG1 H150: CG2 H151: N H151: CA H151: C H151: O H151: CB H151: CG H151: OD1 H151: OD2 H152: N H152: CA H152: C H152: O H152: CB H152: CG H152: OD1 H152: ND2 H153: N H153: CA H153: C H153: O H153: CB H154: N H154: CA H154: C H154: O H154: CB H154: CG H154: CD1 H154: CD2 H155: N H155: CA H155: C H155: O H155: CB H155: CG H155: CD H155: OE1 H155: NE2 H156: N H156: CA H156: C H156: O H156: CB H156: OG H157: N H157: CA H157: C H157: O H158: N H158: CA H158: C H158: O H158: CB H158: CG H158: OD1 H158: ND2 H159: N H159: CA H159: C H159: O H159: CB H159: OG H160: N H160: CA H160: C H160: O H160: CB H160: CG H160: CD H160: OE1 H160: NE2 H161: N H161: CA H161: C H161: O H161: CB H161: CG H161: CD H161: OE1 H161: OE2 H162: N H162: CA H162: C H162: O H162: CB H162: OG H163: N H163: CA H163: C H163: O H163: CB H163: CG1 H163: CG2 H164: N H164: CA H164: C H164: O H164: CB H164: OG1 H164: CG2 H165: N H165: CA H165: C H165: O H165: CB H165: CG H165: CD H165: OE1 H165: OE2 H166: N H166: CA H166: C H166: O H166: CB H166: CG H166: CD H166: OE1 H166: NE2 H167: N H167: CA H167: C H167: O H167: CB H167: CG H167: OD1 H167: OD2 H168: N H168: CA H168: C H168: O H168: CB H168: OG H169: N H169: CA H169: C H169: O H169: CB H169: CG H169: CD H169: CE H169: NZ H170: N H170: CA H170: C H170: O H170: CB H170: CG H170: OD1 H170: OD2 H171: N H171: CA H171: C H171: O H171: CB H171: OG H172: N H172: CA H172: C H172: O H172: CB H172: OG1 H172: CG2 H173: N H173: CA H173: C H173: O H173: CB H173: CG H173: CD1 H173: CD2 H173: CE1 H173: CE2 H173: CZ H173: OH H174: N H174: CA H174: C H174: O H174: CB H174: OG H175: N H175: CA H175: C H175: O H175: CB H175: CG H175: CD1 H175: CD2 H176: N H176: CA H176: C H176: O H176: CB H176: OG H177: N H177: CA H177: C H177: O H177: CB H177: OG H178: N H178: CA H178: C H178: O H178: CB H178: OG1 H178: CG2 H179: N H179: CA H179: C H179: O H179: CB H179: CG H179: CD1 H179: CD2 H180: N H180: CA H180: C H180: O H180: CB H180: OG1 H180: CG2 H181: N H181: CA H181: C H181: O H181: CB H181: CG H181: CD1 H181: CD2 H182: N H182: CA H182: C H182: O H182: CB H182: OG H183: N H183: CA H183: C H183: O H183: CB H183: CG H183: CD H183: CE H183: NZ H184: N H184: CA H184: C H184: O H184: CB H185: N H185: CA H185: C H185: O H185: CB H185: CG H185: OD1 H185: OD2 H186: N H186: CA H186: C H186: O H186: CB H186: CG H186: CD1 H186: CD2 H186: CE1 H186: CE2 H186: CZ H186: OH H187: N H187: CA H187: C H187: O H187: CB H187: CG H187: CD H187: OE1 H187: OE2 H188: N H188: CA H188: C H188: O H188: CB H188: CG H188: CD H188: CE H188: NZ H189: N H189: CA H189: C H189: O H189: CB H189: CG H189: ND1 H189: CD2 H189: CE1 H189: NE2 H190: N H190: CA H190: C H190: O H190: CB H190: CG H190: CD H190: CE H190: NZ H191: N H191: CA H191: C H191: O H191: CB H191: CG1 H191: CG2 H192: N H192: CA H192: C H192: O H192: CB H192: CG H192: CD1 H192: CD2 H192: CE1 H192: CE2 H192: CZ H192: OH H193: N H193: CA H193: C H193: O H193: CB H194: N H194: CA H194: C H194: O H194: CB H194: SG H195: N H195: CA H195: C H195: O H195: CB H195: CG H195: CD H195: OE1 H195: OE2 H196: N H196: CA H196: C H196: O H196: CB H196: CG1 H196: CG2 H197: N H197: CA H197: C H197: O H197: CB H197: OG1 H197: CG2 H198: N H198: CA H198: C H198: O H198: CB H198: CG H198: ND1 H198: CD2 H198: CE1 H198: NE2 H199: N H199: CA H199: C H199: O H199: CB H199: CG H199: CD H199: OE1 H199: NE2 H200: N H200: CA H200: C H200: O H201: N H201: CA H201: C H201: O H201: CB H201: CG H201: CD1 H201: CD2 H202: N H202: CA H202: C H202: O H202: CB H202: OG H203: N H203: CA H203: C H203: O H203: CB H203: OG H204: N H204: CA H204: C H204: O H204: CB H204: CG H204: CD H205: N H205: CA H205: C H205: O H205: CB H205: CG1 H205: CG2 H206: N H206: CA H206: C H206: O H206: CB H206: OG1 H206: CG2 H207: N H207: CA H207: C H207: O H207: CB H207: CG H207: CD H207: CE H207: NZ H208: N H208: CA H208: C H208: O H208: CB H208: OG H209: N H209: CA H209: C H209: O H209: CB H209: CG H209: CD1 H209: CD2 H209: CE1 H209: CE2 H209: CZ H210: N H210: CA H210: C H210: O H210: CB H210: CG H210: OD1 H210: ND2 H211: N H211: CA H211: C H211: O H211: CB H211: CG H211: CD H211: NE H211: CZ H211: NH1 H211: NH2 H212: N H212: CA H212: C H212: O H213: N H213: CA H213: C H213: O H213: CB H213: CG H213: CD H213: OE1 H213: OE2 H214: N H214: CA H214: C H214: O H214: CB H214: SG K1: N K1: CA K1: C K1: O K1: CB K1: CG K1: CD K1: OE1 K1: NE2 K2: N K2: CA K2: C K2: O K2: CB K2: CG1 K2: CG2 K3: N K3: CA K3: C K3: O K3: CB K3: CG K3: CD K3: OE1 K3: NE2 K4: N K4: CA K4: C K4: O K4: CB K4: CG K4: CD1 K4: CD2 K5: N K5: CA K5: C K5: O K5: CB K5: CG1 K5: CG2 K5: CD1 K6: N K6: CA K6: C K6: O K6: CB K6: CG K6: CD K6: OE1 K6: NE2 K7: N K7: CA K7: C K7: O K7: CB K7: OG K8: N K8: CA K8: C K8: O K9: N K9: CA K9: C K9: O K9: CB K9: CG K9: CD K10: N K10: CA K10: C K10: O K10: CB K10: CG K10: CD K10: OE1 K10: NE2 K11: N K11: CA K11: C K11: O K11: CB K11: CG K11: CD1 K11: CD2 K11: CE1 K11: CE2 K11: CZ K12: N K12: CA K12: C K12: O K12: CB K12: CG K12: CD K12: CE K12: NZ K13: N K13: CA K13: C K13: O K13: CB K13: OG1 K13: CG2 K14: N K14: CA K14: C K14: O K14: CB K14: CG K14: CD K15: N K15: CA K15: C K15: O K16: N K16: CA K16: C K16: O K16: CB K17: N K17: CA K17: C K17: O K17: CB K17: OG K18: N K18: CA K18: C K18: O K18: CB K18: CG1 K18: CG2 K19: N K19: CA K19: C K19: O K19: CB K19: OG1 K19: CG2 K20: N K20: CA K20: C K20: O K20: CB K20: CG1 K20: CG2 K21: N K21: CA K21: C K21: O K21: CB K21: OG K22: N K22: CA K22: C K22: O K22: CB K22: SG K23: N K23: CA K23: C K23: O K23: CB K23: CG K23: CD K23: CE K23: NZ K24: N K24: CA K24: C K24: O K24: CB K25: N K25: CA K25: C K25: O K25: CB K25: OG K26: N K26: CA K26: C K26: O K27: N K27: CA K27: C K27: O K27: CB K27: CG K27: CD1 K27: CD2 K27: CE1 K27: CE2 K27: CZ K27: OH K28: N K28: CA K28: C K28: O K28: CB K28: CG1 K28: CG2 K28: CD1 K29: N K29: CA K29: C K29: O K29: CB K29: CG K29: CD1 K29: CD2 K29: CE1 K29: CE2 K29: CZ K30: N K30: CA K30: C K30: O K30: CB K30: OG1 K30: CG2 K31: N K31: CA K31: C K31: O K31: CB K31: CG K31: OD1 K31: OD2 K32: N K32: CA K32: C K32: O K32: CB K32: CG K32: CD1 K32: CD2 K32: CE1 K32: CE2 K32: CZ K32: OH K33: N K33: CA K33: C K33: O K33: CB K33: CG K33: CD1 K33: CD2 K34: N K34: CA K34: C K34: O K34: CB K34: CG1 K34: CG2 K34: CD1 K35: N K35: CA K35: C K35: O K35: CB K35: CG K35: ND1 K35: CD2 K35: CE1 K35: NE2 K36: N K36: CA K36: C K36: O K36: CB K36: CG K36: CD1 K36: CD2 K36: NE1 K36: CE2 K36: CE3 K36: CZ2 K36: CZ3 K36: CH2 K37: N K37: CA K37: C K37: O K37: CB K37: CG1 K37: CG2 K38: N K38: CA K38: C K38: O K38: CB K38: CG K38: CD K38: NE K38: CZ K38: NH1 K38: NH2 K39: N K39: CA K39: C K39: O K39: CB K39: CG K39: CD1 K39: CD2 K40: N K40: CA K40: C K40: O K40: CB K40: CG1 K40: CG2 K41: N K41: CA K41: C K41: O K41: CB K41: CG K41: CD K42: N K42: CA K42: C K42: O K43: N K43: CA K43: C K43: O K43: CB K43: CG K43: CD K43: CE K43: NZ K44: N K44: CA K44: C K44: O K45: N K45: CA K45: C K45: O K45: CB K45: CG K45: CD1 K45: CD2 K46: N K46: CA K46: C K46: O K46: CB K46: CG K46: CD K46: OE1 K46: OE2 K47: N K47: CA K47: C K47: O K47: CB K47: CG K47: CD1 K47: CD2 K47: NE1 K47: CE2 K47: CE3 K47: CZ2 K47: CZ3 K47: CH2 K48: N K48: CA K48: C K48: O K48: CB K48: CG K48: CD1 K48: CD2 K49: N K49: CA K49: C K49: O K50: N K50: CA K50: C K50: O K50: CB K50: CG K50: CD K50: NE K50: CZ K50: NH1 K50: NH2 K51: N K51: CA K51: C K51: O K51: CB K51: CG1 K51: CG2 K51: CD1 K52: N K52: CA K52: C K52: O K52: CB K52: CG K52: OD1 K52: ND2 K53: N K53: CA K53: C K53: O K53: CB K53: OG1 K53: CG2 K54: N K54: CA K54: C K54: O K54: CB K54: CG K54: OD1 K54: ND2 K55: N K55: CA K55: C K55: O K55: CB K56: N K56: CA K56: C K56: O K57: N K57: CA K57: C K57: O K57: CB K57: CG K57: CD1 K57: CD2 K58: N K58: CA K58: C K58: O K58: CB K58: CG K58: SD K58: CE K59: N K59: CA K59: C K59: O K59: CB K59: CG K59: CD1 K59: CD2 K59: CE1 K59: CE2 K59: CZ K59: OH K60: N K60: CA K60: C K60: O K60: CB K60: CG K60: CD1 K60: CD2 K61: N K61: CA K61: C K61: O K61: CB K61: OG K62: N K62: CA K62: C K62: O K62: CB K62: CG K62: ND1 K62: CD2 K62: CE1 K62: NE2 K63: N K63: CA K63: C K63: O K63: CB K63: CG K63: CD K63: CE K63: NZ K64: N K64: CA K64: C K64: O K64: CB K64: CG K64: CD1 K64: CD2 K64: CE1 K64: CE2 K64: CZ K65: N K65: CA K65: C K65: O K65: CB K65: CG K65: CD K65: OE1 K65: OE2 K66: N K66: CA K66: C K66: O K67: N K67: CA K67: C K67: O K67: CB K67: CG K67: CD K67: NE K67: CZ K67: NH1 K67: NH2 K68: N K68: CA K68: C K68: O K68: CB K68: CG K68: CD1 K68: CD2 K69: N K69: CA K69: C K69: O K69: CB K69: CG1 K69: CG2 K69: CD1 K70: N K70: CA K70: C K70: O K70: CB K70: CG K70: CD1 K70: CD2 K71: N K71: CA K71: C K71: O K71: CB K71: CG K71: CD K71: NE K71: CZ K71: NH1 K71: NH2 K72: N K72: CA K72: C K72: O K72: CB K72: CG K72: CD K72: NE K72: CZ K72: NH1 K72: NH2 K73: N K73: CA K73: C K73: O K73: CB K73: CG1 K73: CG2 K74: N K74: CA K74: C K74: O K74: CB K74: CG1 K74: CG2 K75: N K75: CA K75: C K75: O K75: CB K75: CG K75: OD1 K75: OD2 K76: N K76: CA K76: C K76: O K76: CB K76: CG K76: CD1 K76: CD2 K76: NE1 K76: CE2 K76: CE3 K76: CZ2 K76: CZ3 K76: CH2 K77: N K77: CA K77: C K77: O K77: CB K77: CG K77: CD K77: NE K77: CZ K77: NH1 K77: NH2 K78: N K78: CA K78: C K78: O K78: CB K78: OG1 K78: CG2 K79: N K79: CA K79: C K79: O K79: CB K79: CG K79: CD K80: N K80: CA K80: C K80: O K80: CB K80: OG K81: N K81: CA K81: C K81: O K81: CB K81: CG K81: CD1 K81: CD2 K82: N K82: CA K82: C K82: O K83: N K83: CA K83: C K83: O K83: CB K83: OG1 K83: CG2 K84: N K84: CA K84: C K84: O K84: CB K84: CG1 K84: CG2 K85: N K85: CA K85: C K85: O K85: CB K85: CG K85: OD1 K85: ND2 K86: N K86: CA K86: C K86: O K86: CB K86: CG K86: SD K86: CE K87: N K87: CA K87: C K87: O K87: CB K87: CG K87: CD K87: OE1 K87: OE2 K88: N K88: CA K88: C K88: O K88: CB K88: CG K88: CD1 K88: CD2 K89: N K89: CA K89: C K89: O K89: CB K89: CG K89: CD K89: NE K89: CZ K89: NH1 K89: NH2 K90: N K90: CA K90: C K90: O K90: CB K90: CG K90: OD1 K90: ND2 K91: N K91: CA K91: C K91: O K91: CB K91: CG1 K91: CG2 K92: N K92: CA K92: C K92: O K92: CB K92: CG K92: CD K92: NE K92: CZ K92: NH1 K92: NH2 K93: N K93: CA K93: C K93: O K93: CB K93: OG K94: N K94: CA K94: C K94: O K94: CB K94: CG K94: OD1 K94: OD2 K95: N K95: CA K95: C K95: O K95: CB K95: CG K95: OD1 K95: OD2 K96: N K96: CA K96: C K96: O K96: CB K96: OG K97: N K97: CA K97: C K97: O K97: CB K98: N K98: CA K98: C K98: O K98: CB K98: CG1 K98: CG2 K98: CD1 K99: N K99: CA K99: C K99: O K99: CB K99: CG K99: CD1 K99: CD2 K99: CE1 K99: CE2 K99: CZ K99: OH K100: N K100: CA K100: C K100: O K100: CB K100: CG K100: CD1 K100: CD2 K100: CE1 K100: CE2 K100: CZ K101: N K101: CA K101: C K101: O K101: CB K101: SG K102: N K102: CA K102: C K102: O K103: N K103: CA K103: C K103: O K103: CB K103: CG K103: CD K103: NE K103: CZ K103: NH1 K103: NH2 K104: N K104: CA K104: C K104: O K104: CB K104: CG1 K104: CG2 K105: N K105: CA K105: C K105: O K105: CB K105: CG1 K105: CG2 K106: N K106: CA K106: C K106: O K106: CB K106: CG K106: OD1 K106: OD2 K107: N K107: CA K107: C K107: O K108: N K108: CA K108: C K108: O K108: CB K108: CG K108: CD1 K108: CD2 K108: CE1 K108: CE2 K108: CZ K109: N K109: CA K109: C K109: O K109: CB K109: CG K109: OD1 K109: ND2 K110: N K110: CA K110: C K110: O K110: CB K111: N K111: CA K111: C K111: O K111: CB K112: N K112: CA K112: C K112: O K113: N K113: CA K113: C K113: O K113: CB K113: CG K113: CD K114: N K114: CA K114: C K114: O K114: CB K114: CG K114: CD1 K114: CD2 K115: N K115: CA K115: C K115: O K115: CB K115: CG K115: CD K115: OE1 K115: OE2 K116: N K116: CA K116: C K116: O K116: CB K116: CG K116: CD1 K116: CD2 K116: CE1 K116: CE2 K116: CZ K117: N K117: CA K117: C K117: O K117: CB K117: CG K117: CD1 K117: CD2 K117: NE1 K117: CE2 K117: CE3 K117: CZ2 K117: CZ3 K117: CH2 K118: N K118: CA K118: C K118: O K119: N K119: CA K119: C K119: O K119: CB K119: CG K119: CD K119: OE1 K119: NE2 K120: N K120: CA K120: C K120: O K121: N K121: CA K121: C K121: O K121: CB K121: OG K122: N K122: CA K122: C K122: O K122: CB K122: CG K122: CD K123: N K123: CA K123: C K123: O K123: CB K123: CG1 K123: CG2 K124: N K124: CA K124: C K124: O K124: CB K124: CG1 K124: CG2 K124: CD1 K125: N K125: CA K125: C K125: O K125: CB K125: CG1 K125: CG2 K126: N K126: CA K126: C K126: O K126: CB K126: OG K127: N K127: CA K127: C K127: O K127: CB K127: OG K129: N K129: CA K129: C K129: O K129: CB K130: N K130: CA K130: C K130: O K130: CB K130: OG K131: N K131: CA K131: C K131: O K131: CB K131: OG1 K131: CG2 K132: N K132: CA K132: C K132: O K132: CB K132: CG K132: CD K132: CE K132: NZ K133: N K133: CA K133: C K133: O K134: N K134: CA K134: C K134: O K134: CB K134: CG K134: CD K135: N K135: CA K135: C K135: O K135: CB K135: OG K136: N K136: CA K136: C K136: O K136: CB K136: CG1 K136: CG2 K137: N K137: CA K137: C K137: O K137: CB K137: CG K137: CD1 K137: CD2 K137: CE1 K137: CE2 K137: CZ K138: N K138: CA K138: C K138: O K138: CB K138: CG K138: CD K139: N K139: CA K139: C K139: O K139: CB K139: CG K139: CD1 K139: CD2 K140: N K140: CA K140: C K140: O K140: CB K141: N K141: CA K141: C K141: O K141: CB K141: CG K141: CD K142: N K142: CA K142: C K142: O K142: CB K142: OG K143: N K143: CA K143: C K143: O K143: CB K143: OG K144: N K144: CA K144: C K144: O K144: CB K144: CG K144: CD K144: CE K144: NZ K145: N K145: CA K145: C K145: O K145: CB K145: OG K146: N K146: CA K146: C K146: O K146: CB K146: OG1 K146: CG2 K147: N K147: CA K147: C K147: O K147: CB K147: OG K148: N K148: CA K148: C K148: O K149: N K149: CA K149: C K149: O K150: N K150: CA K150: C K150: O K150: CB K150: OG1 K150: CG2 K151: N K151: CA K151: C K151: O K151: CB K152: N K152: CA K152: C K152: O K152: CB K153: N K153: CA K153: C K153: O K153: CB K153: CG K153: CD1 K153: CD2 K154: N K154: CA K154: C K154: O K155: N K155: CA K155: C K155: O K155: CB K155: SG K156: N K156: CA K156: C K156: O K156: CB K156: CG K156: CD1 K156: CD2 K157: N K157: CA K157: C K157: O K157: CB K157: CG1 K157: CG2 K158: N K158: CA K158: C K158: O K158: CB K158: CG K158: CD K158: CE K158: NZ K159: N K159: CA K159: C K159: O K159: CB K159: CG K159: OD1 K159: OD2 K160: N K160: CA K160: C K160: O K160: CB K160: CG K160: CD1 K160: CD2 K160: CE1 K160: CE2 K160: CZ K160: OH K161: N K161: CA K161: C K161: O K161: CB K161: CG K161: CD1 K161: CD2 K161: CE1 K161: CE2 K161: CZ K162: N K162: CA K162: C K162: O K162: CB K162: CG K162: CD K163: N K163: CA K163: C K163: O K163: CB K163: CG K163: CD K163: OE1 K163: OE2 K164: N K164: CA K164: C K164: O K164: CB K164: CG K164: CD K165: N K165: CA K165: C K165: O K165: CB K165: CG1 K165: CG2 K166: N K166: CA K166: C K166: O K166: CB K166: OG1 K166: CG2 K167: N K167: CA K167: C K167: O K167: CB K167: CG1 K167: CG2 K168: N K168: CA K168: C K168: O K168: CB K168: OG K169: N K169: CA K169: C K169: O K169: CB K169: CG K169: CD1 K169: CD2 K169: NE1 K169: CE2 K169: CE3 K169: CZ2 K169: CZ3 K169: CH2 K170: N K170: CA K170: C K170: O K170: CB K170: CG K170: OD1 K170: ND2 K171: N K171: CA K171: C K171: O K171: CB K171: OG K172: N K172: CA K172: C K172: O K173: N K173: CA K173: C K173: O K173: CB K174: N K174: CA K174: C K174: O K174: CB K174: CG K174: CD1 K174: CD2 K175: N K175: CA K175: C K175: O K175: CB K175: OG1 K175: CG2 K176: N K176: CA K176: C K176: O K176: CB K176: OG K177: N K177: CA K177: C K177: O K178: N K178: CA K178: C K178: O K178: CB K178: CG1 K178: CG2 K179: N K179: CA K179: C K179: O K179: CB K179: CG K179: ND1 K179: CD2 K179: CE1 K179: NE2 K180: N K180: CA K180: C K180: O K180: CB K180: OG1 K180: CG2 K181: N K181: CA K181: C K181: O K181: CB K181: CG K181: CD1 K181: CD2 K181: CE1 K181: CE2 K181: CZ K182: N K182: CA K182: C K182: O K182: CB K182: CG K182: CD K183: N K183: CA K183: C K183: O K183: CB K184: N K184: CA K184: C K184: O K184: CB K184: CG1 K184: CG2 K185: N K185: CA K185: C K185: O K185: CB K185: CG K185: CD1 K185: CD2 K186: N K186: CA K186: C K186: O K186: CB K186: CG K186: CD K186: OE1 K186: NE2 K187: N K187: CA K187: C K187: O K187: CB K187: OG K188: N K188: CA K188: C K188: O K188: CB K188: OG K189: N K189: CA K189: C K189: O K190: N K190: CA K190: C K190: O K190: CB K190: CG K190: CD1 K190: CD2 K191: N K191: CA K191: C K191: O K191: CB K191: CG K191: CD1 K191: CD2 K191: CE1 K191: CE2 K191: CZ K191: OH K192: N K192: CA K192: C K192: O K192: CB K192: OG K193: N K193: CA K193: C K193: O K193: CB K193: CG K193: CD1 K193: CD2 K194: N K194: CA K194: C K194: O K194: CB K194: OG K195: N K195: CA K195: C K195: O K195: CB K195: OG K196: N K196: CA K196: C K196: O K196: CB K196: CG1 K196: CG2 K197: N K197: CA K197: C K197: O K197: CB K197: CG1 K197: CG2 K198: N K198: CA K198: C K198: O K198: CB K198: OG1 K198: CG2 K199: N K199: CA K199: C K199: O K199: CB K199: CG1 K199: CG2 K200: N K200: CA K200: C K200: O K200: CB K200: CG K200: CD K201: N K201: CA K201: C K201: O K201: CB K201: OG K202: N K202: CA K202: C K202: O K202: CB K202: OG K203: N K203: CA K203: C K203: O K203: CB K203: OG K204: N K204: CA K204: C K204: O K204: CB K204: CG K204: CD1 K204: CD2 K205: N K205: CA K205: C K205: O K206: N K206: CA K206: C K206: O K206: CB K206: OG1 K206: CG2 K207: N K207: CA K207: C K207: O K207: CB K207: CG K207: CD K207: OE1 K207: NE2 K208: N K208: CA K208: C K208: O K208: CB K208: OG1 K208: CG2 K209: N K209: CA K209: C K209: O K209: CB K209: CG K209: CD1 K209: CD2 K209: CE1 K209: CE2 K209: CZ K209: OH K210: N K210: CA K210: C K210: O K210: CB K210: CG1 K210: CG2 K210: CD1 K211: N K211: CA K211: C K211: O K211: CB K211: SG K212: N K212: CA K212: C K212: O K212: CB K212: CG K212: OD1 K212: ND2 K213: N K213: CA K213: C K213: O K213: CB K213: CG1 K213: CG2 K214: N K214: CA K214: C K214: O K214: CB K214: CG K214: OD1 K214: ND2 K215: N K215: CA K215: C K215: O K215: CB K215: CG K215: ND1 K215: CD2 K215: CE1 K215: NE2 K216: N K216: CA K216: C K216: O K216: CB K216: CG K216: CD K216: CE K216: NZ K217: N K217: CA K217: C K217: O K217: CB K217: CG K217: CD K218: N K218: CA K218: C K218: O K218: CB K218: OG K219: N K219: CA K219: C K219: O K219: CB K219: CG K219: OD1 K219: ND2 K220: N K220: CA K220: C K220: O K220: CB K220: OG1 K220: CG2 K221: N K221: CA K221: C K221: O K221: CB K221: CG K221: CD K221: CE K221: NZ K222: N K222: CA K222: C K222: O K222: CB K222: CG1 K222: CG2 K223: N K223: CA K223: C K223: O K223: CB K223: CG K223: OD1 K223: OD2 K224: N K224: CA K224: C K224: O K224: CB K224: CG K224: CD K224: CE K224: NZ K225: N K225: CA K225: C K225: O K225: CB K225: CG K225: CD K225: CE K225: NZ K226: N K226: CA K226: C K226: O K226: CB K226: CG1 K226: CG2 K227: N K227: CA K227: C K227: O K227: CB K227: CG K227: CD K227: OE1 K227: OE2 K228: N K228: CA K228: C K228: O K228: CB K228: CG K228: CD K229: N K229: CA K229: C K229: O K229: CB K229: CG K229: CD K229: CE K229: NZ K230: N K230: CA K230: C K230: O K230: CB K230: OG L1: N L1: CA L1: C L1: O L1: CB L1: CG L1: CD L1: OE1 L1: NE2 L2: N L2: CA L2: C L2: O L2: CB L2: CG1 L2: CG2 L3: N L3: CA L3: C L3: O L3: CB L3: CG1 L3: CG2 L4: N L4: CA L4: C L4: O L4: CB L4: CG L4: SD L4: CE L5: N L5: CA L5: C L5: O L5: CB L5: OG1 L5: CG2 L6: N L6: CA L6: C L6: O L6: CB L6: CG L6: CD L6: OE1 L6: NE2 L7: N L7: CA L7: C L7: O L7: CB L7: OG L8: N L8: CA L8: C L8: O L8: CB L8: CG L8: CD L9: N L9: CA L9: C L9: O L9: CB L10: N L10: CA L10: C L10: O L10: CB L10: OG1 L10: CG2 L11: N L11: CA L11: C L11: O L11: CB L11: CG L11: CD1 L11: CD2 L12: N L12: CA L12: C L12: O L12: CB L12: OG L13: N L13: CA L13: C L13: O L13: CB L13: CG L13: CD1 L13: CD2 L14: N L14: CA L14: C L14: O L14: CB L14: OG L15: N L15: CA L15: C L15: O L15: CB L15: CG L15: CD L16: N L16: CA L16: C L16: O L17: N L17: CA L17: C L17: O L17: CB L17: CG L17: CD L17: OE1 L17: OE2 L18: N L18: CA L18: C L18: O L18: CB L18: OG1 L18: CG2 L19: N L19: CA L19: C L19: O L19: CB L20: N L20: CA L20: C L20: O L20: CB L21: N L21: CA L21: C L21: O L21: CB L21: CG1 L21: CG2 L22: N L22: CA L22: C L22: O L22: CB L22: OG L23: N L23: CA L23: C L23: O L23: CB L23: SG L24: N L24: CA L24: C L24: O L24: CB L24: CG L24: CD L24: NE L24: CZ L24: NH1 L24: NH2 L25: N L25: CA L25: C L25: O L25: CB L26: N L26: CA L26: C L26: O L26: CB L26: OG L27: N L27: CA L27: C L27: O L27: CB L27: CG L27: CD L27: OE1 L27: NE2 L28: N L28: CA L28: C L28: O L28: CB L28: CG L28: CD1 L28: CD2 L28: CE1 L28: CE2 L28: CZ L28: OH L29: N L29: CA L29: C L29: O L29: CB L29: CG1 L29: CG2 L30: N L30: CA L30: C L30: O L30: CB L30: CG L30: OD1 L30: OD2 L31: N L31: CA L31: C L31: O L31: CB L31: CG L31: CD L31: NE L31: CZ L31: NH1 L31: NH2 L32: N L32: CA L32: C L32: O L32: CB L32: OG L33: N L33: CA L33: C L33: O L33: CB L33: CG1 L33: CG2 L33: CD1 L34: N L34: CA L34: C L34: O L34: CB L34: OG L35: N L35: CA L35: C L35: O L35: CB L35: CG L35: CD1 L35: CD2 L35: NE1 L35: CE2 L35: CE3 L35: CZ2 L35: CZ3 L35: CH2 L36: N L36: CA L36: C L36: O L36: CB L36: CG L36: CD1 L36: CD2 L36: CE1 L36: CE2 L36: CZ L36: OH L37: N L37: CA L37: C L37: O L37: CB L37: CG L37: CD L37: OE1 L37: NE2 L38: N L38: CA L38: C L38: O L38: CB L38: CG L38: CD1 L38: CD2 L39: N L39: CA L39: C L39: O L39: CB L39: CG L39: CD L39: CE L39: NZ L40: N L40: CA L40: C L40: O L40: CB L40: OG1 L40: CG2 L41: N L41: CA L41: C L41: O L42: N L42: CA L42: C L42: O L42: CB L42: CG L42: CD L42: NE L42: CZ L42: NH1 L42: NH2 L43: N L43: CA L43: C L43: O L43: CB L44: N L44: CA L44: C L44: O L44: CB L44: CG L44: CD L45: N L45: CA L45: C L45: O L45: CB L45: CG L45: CD L45: NE L45: CZ L45: NH1 L45: NH2 L46: N L46: CA L46: C L46: O L46: CB L46: CG L46: CD1 L46: CD2 L47: N L47: CA L47: C L47: O L47: CB L47: CG L47: CD1 L47: CD2 L48: N L48: CA L48: C L48: O L48: CB L48: CG1 L48: CG2 L49: N L49: CA L49: C L49: O L49: CB L49: CG L49: CD1 L49: CD2 L49: CE1 L49: CE2 L49: CZ L49: OH L50: N L50: CA L50: C L50: O L50: CB L51: N L51: CA L51: C L51: O L51: CB L52: N L52: CA L52: C L52: O L52: CB L52: OG L53: N L53: CA L53: C L53: O L53: CB L53: OG L54: N L54: CA L54: C L54: O L54: CB L54: CG L54: CD L54: NE L54: CZ L54: NH1 L54: NH2 L55: N L55: CA L55: C L55: O L55: CB L55: OG L56: N L56: CA L56: C L56: O L56: CB L56: CG1 L56: CG2 L56: CD1 L57: N L57: CA L57: C L57: O L58: N L58: CA L58: C L58: O L58: CB L58: CG1 L58: CG2 L59: N L59: CA L59: C L59: O L59: CB L59: CG L59: CD L60: N L60: CA L60: C L60: O L60: CB L60: CG L60: OD1 L60: OD2 L61: N L61: CA L61: C L61: O L61: CB L61: CG L61: CD L61: NE L61: CZ L61: NH1 L61: NH2 L62: N L62: CA L62: C L62: O L62: CB L62: CG L62: CD1 L62: CD2 L62: CE1 L62: CE2 L62: CZ L63: N L63: CA L63: C L63: O L63: CB L63: OG L64: N L64: CA L64: C L64: O L65: N L65: CA L65: C L65: O L65: CB L65: OG L66: N L66: CA L66: C L66: O L67: N L67: CA L67: C L67: O L67: CB L67: OG L68: N L68: CA L68: C L68: O L69: N L69: CA L69: C L69: O L69: CB L69: CG L69: CD L69: NE L69: CZ L69: NH1 L69: NH2 L70: N L70: CA L70: C L70: O L70: CB L70: CG L70: OD1 L70: OD2 L71: N L71: CA L71: C L71: O L71: CB L71: CG L71: CD1 L71: CD2 L71: CE1 L71: CE2 L71: CZ L72: N L72: CA L72: C L72: O L72: CB L72: OG1 L72: CG2 L73: N L73: CA L73: C L73: O L73: CB L73: CG L73: CD1 L73: CD2 L74: N L74: CA L74: C L74: O L74: CB L74: OG1 L74: CG2 L75: N L75: CA L75: C L75: O L75: CB L75: CG1 L75: CG2 L75: CD1 L76: N L76: CA L76: C L76: O L76: CB L76: CG L76: CD L76: NE L76: CZ L76: NH1 L76: NH2 L77: N L77: CA L77: C L77: O L78: N L78: CA L78: C L78: O L78: CB L78: CG1 L78: CG2 L79: N L79: CA L79: C L79: O L79: CB L79: CG L79: CD L79: OE1 L79: NE2 L80: N L80: CA L80: C L80: O L80: CB L80: OG L81: N L81: CA L81: C L81: O L81: CB L81: CG L81: OD1 L81: OD2 L82: N L82: CA L82: C L82: O L82: CB L82: CG L82: OD1 L82: OD2 L83: N L83: CA L83: C L83: O L83: CB L83: CG L83: CD1 L83: CD2 L83: CE1 L83: CE2 L83: CZ L84: N L84: CA L84: C L84: O L84: CB L85: N L85: CA L85: C L85: O L85: CB L85: CG L85: CD1 L85: CD2 L86: N L86: CA L86: C L86: O L86: CB L86: CG L86: CD1 L86: CD2 L86: CE1 L86: CE2 L86: CZ L86: OH L87: N L87: CA L87: C L87: O L87: CB L87: CG L87: CD1 L87: CD2 L87: CE1 L87: CE2 L87: CZ L87: OH L88: N L88: CA L88: C L88: O L88: CB L88: SG L89: N L89: CA L89: C L89: O L89: CB L89: CG L89: CD L89: OE1 L89: NE2 L90: N L90: CA L90: C L90: O L90: CB L90: CG L90: CD L90: OE1 L90: NE2 L91: N L91: CA L91: C L91: O L91: CB L91: CG L91: OD1 L91: OD2 L92: N L92: CA L92: C L92: O L92: CB L92: CG L92: CD1 L92: CD2 L92: CE1 L92: CE2 L92: CZ L92: OH L93: N L93: CA L93: C L93: O L93: CB L93: CG L93: CD1 L93: CD2 L93: CE1 L93: CE2 L93: CZ L93: OH L94: N L94: CA L94: C L94: O L94: CB L94: CG L94: CD1 L94: CD2 L94: NE1 L94: CE2 L94: CE3 L94: CZ2 L94: CZ3 L94: CH2 L95: N L95: CA L95: C L95: O L95: CB L95: CG L95: CD L96: N L96: CA L96: C L96: O L96: CB L96: CG1 L96: CG2 L97: N L97: CA L97: C L97: O L97: CB L97: OG1 L97: CG2 L98: N L98: CA L98: C L98: O L98: CB L98: CG L98: CD1 L98: CD2 L98: CE1 L98: CE2 L98: CZ L99: N L99: CA L99: C L99: O L100: N L100: CA L100: C L100: O L100: CB L100: CG L100: CD L100: OE1 L100: NE2 L101: N L101: CA L101: C L101: O L102: N L102: CA L102: C L102: O L102: CB L102: OG1 L102: CG2 L103: N L103: CA L103: C L103: O L103: CB L103: CG L103: CD L103: NE L103: CZ L103: NH1 L103: NH2 L104: N L104: CA L104: C L104: O L104: CB L104: CG L104: CD1 L104: CD2 L105: N L105: CA L105: C L105: O L105: CB L105: CG L105: OD1 L105: OD2 L106: N L106: CA L106: C L106: O L106: CB L106: CG L106: SD L106: CE L107: N L107: CA L107: C L107: O L107: CB L107: CG L107: CD L107: CE L107: NZ L108: N L108: CA L108: C L108: O L108: CB L108: CG L108: CD L108: NE L108: CZ L108: NH1 L108: NH2 L109: N L109: CA L109: C L109: O L109: CB L109: OG1 L109: CG2 L110: N L110: CA L110: C L110: O L110: CB L110: CG1 L110: CG2 L111: N L111: CA L111: C L111: O L111: CB L112: N L112: CA L112: C L112: O L112: CB L113: N L113: CA L113: C L113: O L113: CB L113: CG L113: CD L114: N L114: CA L114: C L114: O L114: CB L114: OG L115: N L115: CA L115: C L115: O L115: CB L115: CG1 L115: CG2 L116: N L116: CA L116: C L116: O L116: CB L116: CG L116: CD1 L116: CD2 L116: CE1 L116: CE2 L116: CZ L117: N L117: CA L117: C L117: O L117: CB L117: CG1 L117: CG2 L117: CD1 L118: N L118: CA L118: C L118: O L118: CB L118: CG L118: CD1 L118: CD2 L118: CE1 L118: CE2 L118: CZ L119: N L119: CA L119: C L119: O L119: CB L119: CG L119: CD L120: N L120: CA L120: C L120: O L120: CB L120: CG L120: CD L121: N L121: CA L121: C L121: O L121: CB L121: OG L122: N L122: CA L122: C L122: O L122: CB L122: CG L122: OD1 L122: OD2 L123: N L123: CA L123: C L123: O L123: CB L123: CG L123: CD L123: OE1 L123: OE2 L124: N L124: CA L124: C L124: O L124: CB L124: CG L124: CD L124: OE1 L124: NE2 L125: N L125: CA L125: C L125: O L125: CB L125: CG L125: CD1 L125: CD2 L126: N L126: CA L126: C L126: O L126: CB L126: CG L126: CD L126: CE L126: NZ L127: N L127: CA L127: C L127: O L127: CB L127: OG L128: N L128: CA L128: C L128: O L129: N L129: CA L129: C L129: O L129: CB L129: OG1 L129: CG2 L130: N L130: CA L130: C L130: O L130: CB L131: N L131: CA L131: C L131: O L131: CB L131: OG L132: N L132: CA L132: C L132: O L132: CB L132: CG1 L132: CG2 L133: N L133: CA L133: C L133: O L133: CB L133: CG1 L133: CG2 L134: N L134: CA L134: C L134: O L134: CB L134: SG L135: N L135: CA L135: C L135: O L135: CB L135: CG L135: CD1 L135: CD2 L136: N L136: CA L136: C L136: O L136: CB L136: CG L136: CD1 L136: CD2 L137: N L137: CA L137: C L137: O L137: CB L137: CG L137: OD1 L137: ND2 L138: N L138: CA L138: C L138: O L138: CB L138: CG L138: OD1 L138: ND2 L139: N L139: CA L139: C L139: O L139: CB L139: CG L139: CD1 L139: CD2 L139: CE1 L139: CE2 L139: CZ L140: N L140: CA L140: C L140: O L140: CB L140: CG L140: CD1 L140: CD2 L140: CE1 L140: CE2 L140: CZ L140: OH L141: N L141: CA L141: C L141: O L141: CB L141: CG L141: CD L142: N L142: CA L142: C L142: O L142: CB L142: CG L142: CD L142: NE L142: CZ L142: NH1 L142: NH2 L143: N L143: CA L143: C L143: O L143: CB L143: CG L143: CD L143: OE1 L143: OE2 L144: N L144: CA L144: C L144: O L144: CB L145: N L145: CA L145: C L145: O L145: CB L145: CG L145: CD L145: CE L145: NZ L146: N L146: CA L146: C L146: O L146: CB L146: CG1 L146: CG2 L147: N L147: CA L147: C L147: O L147: CB L147: CG L147: CD L147: OE1 L147: NE2 L148: N L148: CA L148: C L148: O L148: CB L148: CG L148: CD1 L148: CD2 L148: NE1 L148: CE2 L148: CE3 L148: CZ2 L148: CZ3 L148: CH2 L149: N L149: CA L149: C L149: O L149: CB L149: CG L149: CD L149: CE L149: NZ L150: N L150: CA L150: C L150: O L150: CB L150: CG1 L150: CG2 L151: N L151: CA L151: C L151: O L151: CB L151: CG L151: OD1 L151: OD2 L152: N L152: CA L152: C L152: O L152: CB L152: CG L152: OD1 L152: ND2 L153: N L153: CA L153: C L153: O L153: CB L154: N L154: CA L154: C L154: O L154: CB L154: CG L154: CD1 L154: CD2 L155: N L155: CA L155: C L155: O L155: CB L155: CG L155: CD L155: OE1 L155: NE2 L156: N L156: CA L156: C L156: O L156: CB L156: OG L157: N L157: CA L157: C L157: O L158: N L158: CA L158: C L158: O L158: CB L158: CG L158: OD1 L158: ND2 L159: N L159: CA L159: C L159: O L159: CB L159: OG L160: N L160: CA L160: C L160: O L160: CB L160: CG L160: CD L160: OE1 L160: NE2 L161: N L161: CA L161: C L161: O L161: CB L161: CG L161: CD L161: OE1 L161: OE2 L162: N L162: CA L162: C L162: O L162: CB L162: OG L163: N L163: CA L163: C L163: O L163: CB L163: CG1 L163: CG2 L164: N L164: CA L164: C L164: O L164: CB L164: OG1 L164: CG2 L165: N L165: CA L165: C L165: O L165: CB L165: CG L165: CD L165: OE1 L165: OE2 L166: N L166: CA L166: C L166: O L166: CB L166: CG L166: CD L166: OE1 L166: NE2 L167: N L167: CA L167: C L167: O L167: CB L167: CG L167: OD1 L167: OD2 L168: N L168: CA L168: C L168: O L168: CB L168: OG L169: N L169: CA L169: C L169: O L169: CB L169: CG L169: CD L169: CE L169: NZ L170: N L170: CA L170: C L170: O L170: CB L170: CG L170: OD1 L170: OD2 L171: N L171: CA L171: C L171: O L171: CB L171: OG L172: N L172: CA L172: C L172: O L172: CB L172: OG1 L172: CG2 L173: N L173: CA L173: C L173: O L173: CB L173: CG L173: CD1 L173: CD2 L173: CE1 L173: CE2 L173: CZ L173: OH L174: N L174: CA L174: C L174: O L174: CB L174: OG L175: N L175: CA L175: C L175: O L175: CB L175: CG L175: CD1 L175: CD2 L176: N L176: CA L176: C L176: O L176: CB L176: OG L177: N L177: CA L177: C L177: O L177: CB L177: OG L178: N L178: CA L178: C L178: O L178: CB L178: OG1 L178: CG2 L179: N L179: CA L179: C L179: O L179: CB L179: CG L179: CD1 L179: CD2 L180: N L180: CA L180: C L180: O L180: CB L180: OG1 L180: CG2 L181: N L181: CA L181: C L181: O L181: CB L181: CG L181: CD1 L181: CD2 L182: N L182: CA L182: C L182: O L182: CB L182: OG L183: N L183: CA L183: C L183: O L183: CB L183: CG L183: CD L183: CE L183: NZ L184: N L184: CA L184: C L184: O L184: CB L185: N L185: CA L185: C L185: O L185: CB L185: CG L185: OD1 L185: OD2 L186: N L186: CA L186: C L186: O L186: CB L186: CG L186: CD1 L186: CD2 L186: CE1 L186: CE2 L186: CZ L186: OH L187: N L187: CA L187: C L187: O L187: CB L187: CG L187: CD L187: OE1 L187: OE2 L188: N L188: CA L188: C L188: O L188: CB L188: CG L188: CD L188: CE L188: NZ L189: N L189: CA L189: C L189: O L189: CB L189: CG L189: ND1 L189: CD2 L189: CE1 L189: NE2 L190: N L190: CA L190: C L190: O L190: CB L190: CG L190: CD L190: CE L190: NZ L191: N L191: CA L191: C L191: O L191: CB L191: CG1 L191: CG2 L192: N L192: CA L192: C L192: O L192: CB L192: CG L192: CD1 L192: CD2 L192: CE1 L192: CE2 L192: CZ L192: OH L193: N L193: CA L193: C L193: O L193: CB L194: N L194: CA L194: C L194: O L194: CB L194: SG L195: N L195: CA L195: C L195: O L195: CB L195: CG L195: CD L195: OE1 L195: OE2 L196: N L196: CA L196: C L196: O L196: CB L196: CG1 L196: CG2 L197: N L197: CA L197: C L197: O L197: CB L197: OG1 L197: CG2 L198: N L198: CA L198: C L198: O L198: CB L198: CG L198: ND1 L198: CD2 L198: CE1 L198: NE2 L199: N L199: CA L199: C L199: O L199: CB L199: CG L199: CD L199: OE1 L199: NE2 L200: N L200: CA L200: C L200: O L201: N L201: CA L201: C L201: O L201: CB L201: CG L201: CD1 L201: CD2 L202: N L202: CA L202: C L202: O L202: CB L202: OG L203: N L203: CA L203: C L203: O L203: CB L203: OG L204: N L204: CA L204: C L204: O L204: CB L204: CG L204: CD L205: N L205: CA L205: C L205: O L205: CB L205: CG1 L205: CG2 L206: N L206: CA L206: C L206: O L206: CB L206: OG1 L206: CG2 L207: N L207: CA L207: C L207: O L207: CB L207: CG L207: CD L207: CE L207: NZ L208: N L208: CA L208: C L208: O L208: CB L208: OG L209: N L209: CA L209: C L209: O L209: CB L209: CG L209: CD1 L209: CD2 L209: CE1 L209: CE2 L209: CZ L210: N L210: CA L210: C L210: O L210: CB L210: CG L210: OD1 L210: ND2 L211: N L211: CA L211: C L211: O L211: CB L211: CG L211: CD L211: NE L211: CZ L211: NH1 L211: NH2 L212: N L212: CA L212: C L212: O L213: N L213: CA L213: C L213: O L213: CB L213: CG L213: CD L213: OE1 L213: OE2 L214: N L214: CA L214: C L214: O L214: CB L214: SG Chain information for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb --- Chain | Description 1.1/A 1.1/E 1.1/I | No description available 1.1/B 1.1/F 1.1/J | No description available 1.1/C 1.1/G 1.1/K | No description available 1.1/D 1.1/H 1.1/L | No description available > isolde start > set selectionWidth 4 Done loading forcefield > set bgColor white > addh Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 10 messages similar to the above omitted 2010 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 5956 hydrogens added > hide HC > show HC > hide HC > isolde restrain ligands #1 > hide #1.1.5 models > show #1.1.5 models > addh hbond true Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added > show HC > hide HC > volume #1.2.1.1 level 1.102 QWidget::repaint: Recursive repaint detected > select #1 51607 atoms, 52256 bonds, 14 models selected > isolde sim start sel No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Doing nothing No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Adding hydrogens Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1974 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added No template found for residue A3932 (NAG) Excluding residue > clipper associate #2 toModel #1 > clipper associate #2 toModel #1 > show #!1.1 target m > show #!1.1 target m > hide #!1.1 target m > show #!1.1 target m > select #1 51607 atoms, 52256 bonds, 18 models selected > toolshed show ISOLDE > set selectionWidth 4 Done loading forcefield > clipper associate #2 toModel #1 > clipper associate #2 toModel #1 > hide #!1.2 models > close #1.2 > open "/Users/km503/Documents/VRC40/higher > resolution/cryosparc_P4_J12_008_volume_map_sharp_local-zflip.mrc" Opened cryosparc_P4_J12_008_volume_map_sharp_local-zflip.mrc, grid size 320,320,320, pixel 1.08, shown at level 0.667, step 2, values float32 > clipper associate #2 toModel #1 > addh Summary of feedback from adding hydrogens to VRC40-trimer- rsr40_real_space_refined-coot-0.pdb #1.1 --- warning | Skipped 15 atom(s) with bad connectivities; see log for details notes | No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined- coot-0.pdb (#1.1) chain A; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain B; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain C; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain D; guessing termini instead No usable SEQRES records for VRC40-trimer-rsr40_real_space_refined-coot-0.pdb (#1.1) chain E; guessing termini instead 7 messages similar to the above omitted Chain-initial residues that are actual N termini: /C GLN 1, /D GLN 1, /G GLN 1, /H GLN 1, /K GLN 1, /L GLN 1 Chain-initial residues that are not actual N termini: /A ALA 32, /B ALA 512, /E ALA 32, /F ALA 512, /I ALA 32, /J ALA 512 Chain-final residues that are actual C termini: Chain-final residues that are not actual C termini: /A VAL 505, /B ASP 664, /C SER 230, /D CYS 214, /E VAL 505, /F ASP 664, /G SER 230, /H CYS 214, /I VAL 505, /J ASP 664, /K SER 230, /L CYS 214 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /A NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /A NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /E NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /E NAG 3932 O7 Skipping possible acceptor with bad geometry: /I NAG 3932 O7 Wrong number of grandchild atoms for phi/psi acceptor /I NAG 3932 O7 10 messages similar to the above omitted 1977 hydrogen bonds /A VAL 505 is not terminus, removing H atom from 'C' /B ASP 664 is not terminus, removing H atom from 'C' /C SER 230 is not terminus, removing H atom from 'C' /D CYS 214 is not terminus, removing H atom from 'C' /E VAL 505 is not terminus, removing H atom from 'C' 7 messages similar to the above omitted 0 hydrogens added > hide HC > isolde restrain ligands #1 QWidget::repaint: Recursive repaint detected > select #1 51607 atoms, 52256 bonds, 18 models selected > isolde sim start sel No template found for residue A3943 (NAG) Excluding residue No template found for residue A3944 (NAG) Excluding residue No template found for residue A3961 (NAG) Excluding residue No template found for residue A3964 (NAG) Excluding residue No template found for residue A3969 (MAN) Excluding residue No template found for residue E3932 (NAG) Excluding residue No template found for residue E3943 (NAG) Excluding residue No template found for residue E3944 (NAG) Excluding residue No template found for residue E3961 (NAG) Excluding residue No template found for residue E3964 (NAG) Excluding residue No template found for residue E3969 (MAN) Excluding residue No template found for residue I3932 (NAG) Excluding residue No template found for residue I3943 (NAG) Excluding residue No template found for residue I3944 (NAG) Excluding residue No template found for residue I3961 (NAG) Excluding residue No template found for residue I3964 (NAG) Excluding residue No template found for residue I3969 (MAN) Excluding residue > select #1 51607 atoms, 52256 bonds, 18 models selected > isolde sim start sel Simulation already running! > select clear No rotamer preview selected! Ignoring command. No rotamer preview selected! Ignoring command. Traceback (most recent call last): File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/core/triggerset.py", line 130, in invoke return self._func(self._name, data) File "/Users/km503/Library/Application Support/ChimeraX/0.91/site- packages/chimerax/isolde/openmm/openmm_interface.py", line 1686, in _push_coords_to_sim self.thread_handler.coords = self._pending_coords File "/Users/km503/Library/Application Support/ChimeraX/0.91/site- packages/chimerax/isolde/openmm/openmm_interface.py", line 309, in coords f(self._c_pointer, n, pointer(coords)) File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/atomic/molc.py", line 320, in pointer cty = numpy_type_to_ctype[a.dtype.type] AttributeError: 'NoneType' object has no attribute 'dtype' Error processing trigger "coord update": AttributeError: 'NoneType' object has no attribute 'dtype' File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/atomic/molc.py", line 320, in pointer cty = numpy_type_to_ctype[a.dtype.type] See log for complete Python traceback. Traceback (most recent call last): File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/core/triggerset.py", line 130, in invoke return self._func(self._name, data) File "/Users/km503/Library/Application Support/ChimeraX/0.91/site- packages/chimerax/isolde/openmm/openmm_interface.py", line 1686, in _push_coords_to_sim self.thread_handler.coords = self._pending_coords File "/Users/km503/Library/Application Support/ChimeraX/0.91/site- packages/chimerax/isolde/openmm/openmm_interface.py", line 309, in coords f(self._c_pointer, n, pointer(coords)) File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/atomic/molc.py", line 320, in pointer cty = numpy_type_to_ctype[a.dtype.type] AttributeError: 'NoneType' object has no attribute 'dtype' Error processing trigger "coord update": AttributeError: 'NoneType' object has no attribute 'dtype' File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/atomic/molc.py", line 320, in pointer cty = numpy_type_to_ctype[a.dtype.type] See log for complete Python traceback. Traceback (most recent call last): File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/core/triggerset.py", line 130, in invoke return self._func(self._name, data) File "/Users/km503/Library/Application Support/ChimeraX/0.91/site- packages/chimerax/isolde/openmm/openmm_interface.py", line 1686, in _push_coords_to_sim self.thread_handler.coords = self._pending_coords File "/Users/km503/Library/Application Support/ChimeraX/0.91/site- packages/chimerax/isolde/openmm/openmm_interface.py", line 309, in coords f(self._c_pointer, n, pointer(coords)) File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/atomic/molc.py", line 320, in pointer cty = numpy_type_to_ctype[a.dtype.type] AttributeError: 'NoneType' object has no attribute 'dtype' Error processing trigger "coord update": AttributeError: 'NoneType' object has no attribute 'dtype' File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/atomic/molc.py", line 320, in pointer cty = numpy_type_to_ctype[a.dtype.type] See log for complete Python traceback. Traceback (most recent call last): File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/core/triggerset.py", line 130, in invoke return self._func(self._name, data) File "/Users/km503/Library/Application Support/ChimeraX/0.91/site- packages/chimerax/isolde/openmm/openmm_interface.py", line 1686, in _push_coords_to_sim self.thread_handler.coords = self._pending_coords File "/Users/km503/Library/Application Support/ChimeraX/0.91/site- packages/chimerax/isolde/openmm/openmm_interface.py", line 309, in coords f(self._c_pointer, n, pointer(coords)) File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/atomic/molc.py", line 320, in pointer cty = numpy_type_to_ctype[a.dtype.type] AttributeError: 'NoneType' object has no attribute 'dtype' Error processing trigger "coord update": AttributeError: 'NoneType' object has no attribute 'dtype' File "/private/var/folders/xv/05d2bhc950b8q5xxkg5j9c25qc0nm9/T/AppTranslocation/7849F4B9-F847-4719-B2BB-F74924045DFA/d/ChimeraX-0.91.app/Contents/Library/Frameworks/Python.framework/Versions/3.7/lib/python3.7/site- packages/chimerax/atomic/molc.py", line 320, in pointer cty = numpy_type_to_ctype[a.dtype.type] See log for complete Python traceback. OpenGL version: 4.1 ATI-3.5.5 OpenGL renderer: AMD Radeon Pro 5500M OpenGL Engine OpenGL vendor: ATI Technologies Inc.
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