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disorder.pdb
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disorder.pdb
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HEADER LIPID BINDING PROTEIN 11-OCT-04 1XQ8
TITLE HUMAN MICELLE-BOUND ALPHA-SYNUCLEIN
COMPND MOL_ID: 1;
COMPND 2 MOLECULE: ALPHA-SYNUCLEIN;
COMPND 3 CHAIN: A;
COMPND 4 SYNONYM: NON-A BETA COMPONENT OF AD AMYLOID, NON-A4
COMPND 5 COMPONENT OF AMYLOID, NACP;
COMPND 6 ENGINEERED: YES
SOURCE MOL_ID: 1;
SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
SOURCE 3 ORGANISM_COMMON: HUMAN;
SOURCE 4 ORGANISM_TAXID: 9606;
SOURCE 5 GENE: SNCA, NACP;
SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562;
SOURCE 8 EXPRESSION_SYSTEM_VECTOR: PET-41
KEYWDS MICELLE-BOUND HELIX, LIPID BINDING PROTEIN
EXPDTA SOLUTION NMR
MDLTYP MINIMIZED AVERAGE
AUTHOR T.S.ULMER,A.BAX,N.B.COLE,R.L.NUSSBAUM
REVDAT 6 24-FEB-09 1XQ8 1 VERSN
REVDAT 5 26-APR-05 1XQ8 1 HEADER
REVDAT 4 12-APR-05 1XQ8 1 JRNL
REVDAT 3 22-FEB-05 1XQ8 1 JRNL
REVDAT 2 08-FEB-05 1XQ8 1 JRNL
REVDAT 1 11-JAN-05 1XQ8 0
JRNL AUTH T.S.ULMER,A.BAX,N.B.COLE,R.L.NUSSBAUM
JRNL TITL STRUCTURE AND DYNAMICS OF MICELLE-BOUND HUMAN
JRNL TITL 2 ALPHA-SYNUCLEIN
JRNL REF J.BIOL.CHEM. V. 280 9595 2005
JRNL REFN ISSN 0021-9258
JRNL PMID 15615727
JRNL DOI 10.1074/JBC.M411805200
REMARK 1
REMARK 2
REMARK 2 RESOLUTION. NOT APPLICABLE.
REMARK 3
REMARK 3 REFINEMENT.
REMARK 3 PROGRAM : X-PLOR 2.9.5
REMARK 3 AUTHORS : BRUNGER
REMARK 3
REMARK 3 OTHER REFINEMENT REMARKS: PLEASE NOTE THAT LARGE AMPLITUDE
REMARK 3 DYNAMICS ARE PRESENT IN THIS SYSTEM, DESCRIBED IN THE PRIMARY
REMARK 3 CITATION, AND THE REPORTED STRUCTURE MERELY REPRESENTS THE
REMARK 3 EFFECTIVE AVERAGE CONFORMATION OF THE MOLECULE.
REMARK 4
REMARK 4 1XQ8 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
REMARK 100
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 09-NOV-04.
REMARK 100 THE RCSB ID CODE IS RCSB030638.
REMARK 210
REMARK 210 EXPERIMENTAL DETAILS
REMARK 210 EXPERIMENT TYPE : NMR
REMARK 210 TEMPERATURE (KELVIN) : 298.2
REMARK 210 PH : 7.4
REMARK 210 IONIC STRENGTH : 115
REMARK 210 PRESSURE : 1 ATM
REMARK 210 SAMPLE CONTENTS : 0.5 MM ALPHA-SYNUCLEIN 2H,
REMARK 210 13C, 15N
REMARK 210
REMARK 210 NMR EXPERIMENTS CONDUCTED : HNCO-QJ, HN(CO)CA-QJ, HNCO-JNH
REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ, 800 MHZ
REMARK 210 SPECTROMETER MODEL : DRX
REMARK 210 SPECTROMETER MANUFACTURER : BRUKER
REMARK 210
REMARK 210 STRUCTURE DETERMINATION.
REMARK 210 SOFTWARE USED : X-PLOR 2.9.5
REMARK 210 METHOD USED : MOLECULAR FRAGMENT
REMARK 210 REPLACEMENT, SIMULATED
REMARK 210 ANNEALING
REMARK 210
REMARK 210 CONFORMERS, NUMBER CALCULATED : 20
REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1
REMARK 210 CONFORMERS, SELECTION CRITERIA : AVERAGE STRUCTURE
REMARK 210
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL
REMARK 210
REMARK 210 REMARK: NULL
REMARK 215
REMARK 215 NMR STUDY
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION
REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON
REMARK 215 THESE RECORDS ARE MEANINGLESS.
REMARK 500
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
REMARK 500 SUBTOPIC: TORSION ANGLES
REMARK 500
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
REMARK 500
REMARK 500 STANDARD TABLE:
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)
REMARK 500
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400
REMARK 500
REMARK 500 M RES CSSEQI PSI PHI
REMARK 500 VAL A 95 101.52 -52.18
REMARK 500 LYS A 96 163.31 -46.73
REMARK 500 GLN A 99 -30.10 -175.72
REMARK 500 LYS A 102 90.03 48.10
REMARK 500 GLU A 105 120.48 168.47
REMARK 500 GLN A 109 -109.53 -57.01
REMARK 500 GLU A 110 -17.46 -171.13
REMARK 500 GLU A 114 -3.87 -54.43
REMARK 500 ASN A 122 30.68 -170.31
REMARK 500 GLU A 123 -52.52 66.99
REMARK 500 ALA A 124 -139.70 -156.57
REMARK 500 TYR A 125 -72.31 -53.41
REMARK 500 GLU A 126 88.83 -151.08
REMARK 500 MET A 127 -171.21 52.67
REMARK 500 GLU A 130 -149.52 35.41
REMARK 500 TYR A 133 -77.99 56.83
REMARK 500 ASP A 135 -17.92 -163.33
REMARK 500
REMARK 500 REMARK: NULL
REMARK 650
REMARK 650 HELIX
REMARK 650 THE SECONDARY STRUCTURE OF THIS PROTEIN WAS
REMARK 650 AUTHOR DETERMINED
DBREF 1XQ8 A 1 140 UNP P37840 SYUA_HUMAN 1 140
SEQRES 1 A 140 MET ASP VAL PHE MET LYS GLY LEU SER LYS ALA LYS GLU
SEQRES 2 A 140 GLY VAL VAL ALA ALA ALA GLU LYS THR LYS GLN GLY VAL
SEQRES 3 A 140 ALA GLU ALA ALA GLY LYS THR LYS GLU GLY VAL LEU TYR
SEQRES 4 A 140 VAL GLY SER LYS THR LYS GLU GLY VAL VAL HIS GLY VAL
SEQRES 5 A 140 ALA THR VAL ALA GLU LYS THR LYS GLU GLN VAL THR ASN
SEQRES 6 A 140 VAL GLY GLY ALA VAL VAL THR GLY VAL THR ALA VAL ALA
SEQRES 7 A 140 GLN LYS THR VAL GLU GLY ALA GLY SER ILE ALA ALA ALA
SEQRES 8 A 140 THR GLY PHE VAL LYS LYS ASP GLN LEU GLY LYS ASN GLU
SEQRES 9 A 140 GLU GLY ALA PRO GLN GLU GLY ILE LEU GLU ASP MET PRO
SEQRES 10 A 140 VAL ASP PRO ASP ASN GLU ALA TYR GLU MET PRO SER GLU
SEQRES 11 A 140 GLU GLY TYR GLN ASP TYR GLU PRO GLU ALA
HELIX 1 1 VAL A 3 VAL A 37 1 35
HELIX 2 2 LYS A 45 THR A 92 1 48
CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1
ORIGX1 1.000000 0.000000 0.000000 0.00000
ORIGX2 0.000000 1.000000 0.000000 0.00000
ORIGX3 0.000000 0.000000 1.000000 0.00000
SCALE1 1.000000 0.000000 0.000000 0.00000
SCALE2 0.000000 1.000000 0.000000 0.00000
SCALE3 0.000000 0.000000 1.000000 0.00000
ATOM 1 N MET A 1 250.965 35.980 1.756 1.00 3.51 N
ATOM 2 CA MET A 1 250.631 34.877 0.809 1.00 2.95 C
ATOM 3 C MET A 1 249.137 34.933 0.477 1.00 1.98 C
ATOM 4 O MET A 1 248.722 34.621 -0.622 1.00 2.25 O
ATOM 5 CB MET A 1 250.966 33.522 1.452 1.00 3.46 C
ATOM 6 CG MET A 1 252.471 33.254 1.353 1.00 4.04 C
ATOM 7 SD MET A 1 253.361 34.426 2.407 1.00 4.85 S
ATOM 8 CE MET A 1 254.923 34.409 1.490 1.00 5.59 C
ATOM 9 H1 MET A 1 251.445 35.587 2.589 1.00 3.73 H
ATOM 10 H2 MET A 1 250.089 36.458 2.050 1.00 3.86 H
ATOM 11 H3 MET A 1 251.593 36.664 1.288 1.00 3.91 H
ATOM 12 HA MET A 1 251.201 35.001 -0.100 1.00 3.41 H
ATOM 13 HB2 MET A 1 250.671 33.533 2.488 1.00 3.61 H
ATOM 14 HB3 MET A 1 250.432 32.738 0.937 1.00 3.81 H
ATOM 15 HG2 MET A 1 252.679 32.245 1.681 1.00 4.25 H
ATOM 16 HG3 MET A 1 252.793 33.372 0.327 1.00 4.29 H
ATOM 17 HE1 MET A 1 255.062 33.437 1.041 1.00 5.95 H
ATOM 18 HE2 MET A 1 255.741 34.609 2.164 1.00 5.89 H
ATOM 19 HE3 MET A 1 254.898 35.169 0.719 1.00 5.77 H
ATOM 20 N ASP A 2 248.321 35.325 1.418 1.00 1.45 N
ATOM 21 CA ASP A 2 246.860 35.394 1.143 1.00 0.95 C
ATOM 22 C ASP A 2 246.615 36.397 0.013 1.00 0.90 C
ATOM 23 O ASP A 2 246.715 37.594 0.194 1.00 0.86 O
ATOM 24 CB ASP A 2 246.122 35.851 2.403 1.00 1.58 C
ATOM 25 CG ASP A 2 246.270 34.789 3.492 1.00 2.20 C
ATOM 26 OD1 ASP A 2 247.395 34.465 3.827 1.00 2.76 O
ATOM 27 OD2 ASP A 2 245.256 34.323 3.978 1.00 2.76 O
ATOM 28 H ASP A 2 248.670 35.570 2.300 1.00 1.98 H
ATOM 29 HA ASP A 2 246.503 34.419 0.846 1.00 1.27 H
ATOM 30 HB2 ASP A 2 246.543 36.782 2.749 1.00 2.05 H
ATOM 31 HB3 ASP A 2 245.078 35.990 2.177 1.00 2.06 H
ATOM 32 N VAL A 3 246.315 35.909 -1.159 1.00 0.95 N
ATOM 33 CA VAL A 3 246.085 36.822 -2.313 1.00 0.96 C
ATOM 34 C VAL A 3 245.072 37.899 -1.920 1.00 0.91 C
ATOM 35 O VAL A 3 244.919 38.896 -2.594 1.00 0.91 O
ATOM 36 CB VAL A 3 245.544 36.021 -3.498 1.00 1.07 C
ATOM 37 CG1 VAL A 3 245.317 36.957 -4.685 1.00 1.14 C
ATOM 38 CG2 VAL A 3 246.556 34.939 -3.886 1.00 1.36 C
ATOM 39 H VAL A 3 246.266 34.938 -1.285 1.00 1.01 H
ATOM 40 HA VAL A 3 247.018 37.291 -2.592 1.00 0.95 H
ATOM 41 HB VAL A 3 244.609 35.558 -3.222 1.00 1.33 H
ATOM 42 HG11 VAL A 3 246.184 37.586 -4.819 1.00 1.52 H
ATOM 43 HG12 VAL A 3 244.451 37.573 -4.497 1.00 1.71 H
ATOM 44 HG13 VAL A 3 245.156 36.373 -5.578 1.00 1.47 H
ATOM 45 HG21 VAL A 3 246.306 34.545 -4.859 1.00 1.90 H
ATOM 46 HG22 VAL A 3 246.525 34.143 -3.158 1.00 1.65 H
ATOM 47 HG23 VAL A 3 247.546 35.365 -3.912 1.00 1.70 H
ATOM 48 N PHE A 4 244.376 37.704 -0.834 1.00 0.91 N
ATOM 49 CA PHE A 4 243.374 38.718 -0.399 1.00 0.91 C
ATOM 50 C PHE A 4 244.096 39.896 0.259 1.00 0.84 C
ATOM 51 O PHE A 4 243.835 41.043 -0.045 1.00 0.85 O
ATOM 52 CB PHE A 4 242.409 38.085 0.605 1.00 0.95 C
ATOM 53 CG PHE A 4 241.536 37.072 -0.102 1.00 1.29 C
ATOM 54 CD1 PHE A 4 240.340 37.483 -0.703 1.00 2.00 C
ATOM 55 CD2 PHE A 4 241.923 35.727 -0.159 1.00 2.02 C
ATOM 56 CE1 PHE A 4 239.528 36.550 -1.361 1.00 2.63 C
ATOM 57 CE2 PHE A 4 241.114 34.796 -0.817 1.00 2.68 C
ATOM 58 CZ PHE A 4 239.915 35.205 -1.418 1.00 2.77 C
ATOM 59 H PHE A 4 244.511 36.891 -0.304 1.00 0.92 H
ATOM 60 HA PHE A 4 242.822 39.069 -1.258 1.00 0.95 H
ATOM 61 HB2 PHE A 4 242.971 37.593 1.383 1.00 1.20 H
ATOM 62 HB3 PHE A 4 241.787 38.852 1.038 1.00 1.22 H
ATOM 63 HD1 PHE A 4 240.043 38.520 -0.658 1.00 2.52 H
ATOM 64 HD2 PHE A 4 242.845 35.408 0.302 1.00 2.53 H
ATOM 65 HE1 PHE A 4 238.605 36.869 -1.827 1.00 3.38 H
ATOM 66 HE2 PHE A 4 241.412 33.762 -0.860 1.00 3.46 H
ATOM 67 HZ PHE A 4 239.291 34.483 -1.924 1.00 3.41 H
ATOM 68 N MET A 5 245.006 39.623 1.154 1.00 0.81 N
ATOM 69 CA MET A 5 245.745 40.728 1.827 1.00 0.78 C
ATOM 70 C MET A 5 246.319 41.670 0.766 1.00 0.75 C
ATOM 71 O MET A 5 246.161 42.874 0.839 1.00 0.74 O
ATOM 72 CB MET A 5 246.887 40.143 2.665 1.00 0.79 C
ATOM 73 CG MET A 5 246.334 39.584 3.979 1.00 0.86 C
ATOM 74 SD MET A 5 245.789 40.953 5.032 1.00 1.56 S
ATOM 75 CE MET A 5 244.855 39.976 6.239 1.00 1.89 C
ATOM 76 H MET A 5 245.204 38.690 1.382 1.00 0.82 H
ATOM 77 HA MET A 5 245.069 41.276 2.467 1.00 0.80 H
ATOM 78 HB2 MET A 5 247.373 39.347 2.110 1.00 0.82 H
ATOM 79 HB3 MET A 5 247.609 40.912 2.884 1.00 0.77 H
ATOM 80 HG2 MET A 5 245.498 38.933 3.774 1.00 1.20 H
ATOM 81 HG3 MET A 5 247.106 39.027 4.484 1.00 1.32 H
ATOM 82 HE1 MET A 5 243.807 39.991 5.976 1.00 2.18 H
ATOM 83 HE2 MET A 5 244.981 40.399 7.223 1.00 2.49 H
ATOM 84 HE3 MET A 5 245.216 38.956 6.238 1.00 2.24 H
ATOM 85 N LYS A 6 246.987 41.132 -0.217 1.00 0.76 N
ATOM 86 CA LYS A 6 247.572 41.993 -1.282 1.00 0.77 C
ATOM 87 C LYS A 6 246.484 42.898 -1.862 1.00 0.78 C
ATOM 88 O LYS A 6 246.600 44.108 -1.859 1.00 0.78 O
ATOM 89 CB LYS A 6 248.148 41.110 -2.391 1.00 0.82 C
ATOM 90 CG LYS A 6 249.479 40.506 -1.936 1.00 1.38 C
ATOM 91 CD LYS A 6 250.038 39.620 -3.052 1.00 1.77 C
ATOM 92 CE LYS A 6 251.429 39.117 -2.662 1.00 2.48 C
ATOM 93 NZ LYS A 6 252.413 40.228 -2.808 1.00 2.74 N
ATOM 94 H LYS A 6 247.104 40.159 -0.254 1.00 0.78 H
ATOM 95 HA LYS A 6 248.359 42.602 -0.861 1.00 0.76 H
ATOM 96 HB2 LYS A 6 247.452 40.315 -2.614 1.00 1.09 H
ATOM 97 HB3 LYS A 6 248.314 41.706 -3.278 1.00 1.21 H
ATOM 98 HG2 LYS A 6 250.182 41.300 -1.718 1.00 1.93 H
ATOM 99 HG3 LYS A 6 249.322 39.909 -1.052 1.00 1.95 H
ATOM 100 HD2 LYS A 6 249.379 38.779 -3.205 1.00 2.14 H
ATOM 101 HD3 LYS A 6 250.107 40.192 -3.965 1.00 2.15 H
ATOM 102 HE2 LYS A 6 251.416 38.780 -1.637 1.00 3.06 H
ATOM 103 HE3 LYS A 6 251.711 38.298 -3.305 1.00 2.98 H
ATOM 104 HZ1 LYS A 6 251.912 41.104 -3.056 1.00 2.91 H
ATOM 105 HZ2 LYS A 6 253.093 39.991 -3.560 1.00 3.19 H
ATOM 106 HZ3 LYS A 6 252.919 40.363 -1.911 1.00 3.05 H
ATOM 107 N GLY A 7 245.425 42.323 -2.363 1.00 0.81 N
ATOM 108 CA GLY A 7 244.331 43.152 -2.944 1.00 0.85 C
ATOM 109 C GLY A 7 243.885 44.199 -1.922 1.00 0.83 C
ATOM 110 O GLY A 7 243.463 45.283 -2.274 1.00 0.86 O
ATOM 111 H GLY A 7 245.350 41.345 -2.358 1.00 0.82 H
ATOM 112 HA2 GLY A 7 244.690 43.645 -3.835 1.00 0.87 H
ATOM 113 HA3 GLY A 7 243.491 42.516 -3.193 1.00 0.89 H
ATOM 114 N LEU A 8 243.972 43.885 -0.659 1.00 0.81 N
ATOM 115 CA LEU A 8 243.551 44.864 0.384 1.00 0.81 C
ATOM 116 C LEU A 8 244.608 45.965 0.507 1.00 0.77 C
ATOM 117 O LEU A 8 244.303 47.140 0.455 1.00 0.77 O
ATOM 118 CB LEU A 8 243.400 44.140 1.731 1.00 0.81 C
ATOM 119 CG LEU A 8 242.543 44.985 2.700 1.00 1.35 C
ATOM 120 CD1 LEU A 8 241.053 44.699 2.476 1.00 2.04 C
ATOM 121 CD2 LEU A 8 242.900 44.634 4.149 1.00 1.96 C
ATOM 122 H LEU A 8 244.314 43.005 -0.395 1.00 0.79 H
ATOM 123 HA LEU A 8 242.609 45.304 0.101 1.00 0.85 H
ATOM 124 HB2 LEU A 8 242.927 43.185 1.569 1.00 1.15 H
ATOM 125 HB3 LEU A 8 244.383 43.986 2.160 1.00 1.07 H
ATOM 126 HG LEU A 8 242.731 46.035 2.528 1.00 2.07 H
ATOM 127 HD11 LEU A 8 240.843 43.666 2.723 1.00 2.45 H
ATOM 128 HD12 LEU A 8 240.795 44.879 1.444 1.00 2.57 H
ATOM 129 HD13 LEU A 8 240.465 45.346 3.109 1.00 2.49 H
ATOM 130 HD21 LEU A 8 242.752 43.578 4.310 1.00 2.49 H
ATOM 131 HD22 LEU A 8 242.266 45.194 4.822 1.00 2.29 H
ATOM 132 HD23 LEU A 8 243.934 44.885 4.335 1.00 2.47 H
ATOM 133 N SER A 9 245.849 45.594 0.671 1.00 0.74 N
ATOM 134 CA SER A 9 246.922 46.620 0.797 1.00 0.71 C
ATOM 135 C SER A 9 247.017 47.422 -0.502 1.00 0.73 C
ATOM 136 O SER A 9 247.512 48.529 -0.524 1.00 0.71 O
ATOM 137 CB SER A 9 248.259 45.928 1.067 1.00 0.71 C
ATOM 138 OG SER A 9 249.322 46.817 0.737 1.00 1.48 O
ATOM 139 H SER A 9 246.074 44.641 0.711 1.00 0.74 H
ATOM 140 HA SER A 9 246.689 47.286 1.615 1.00 0.70 H
ATOM 141 HB2 SER A 9 248.328 45.669 2.111 1.00 1.32 H
ATOM 142 HB3 SER A 9 248.325 45.026 0.468 1.00 1.17 H
ATOM 143 HG SER A 9 249.194 47.626 1.231 1.00 1.90 H
ATOM 144 N LYS A 10 246.549 46.869 -1.587 1.00 0.77 N
ATOM 145 CA LYS A 10 246.614 47.601 -2.883 1.00 0.80 C
ATOM 146 C LYS A 10 245.547 48.697 -2.903 1.00 0.80 C
ATOM 147 O LYS A 10 245.779 49.794 -3.372 1.00 0.80 O
ATOM 148 CB LYS A 10 246.366 46.624 -4.034 1.00 0.86 C
ATOM 149 CG LYS A 10 246.575 47.342 -5.366 1.00 1.36 C
ATOM 150 CD LYS A 10 246.404 46.350 -6.517 1.00 1.79 C
ATOM 151 CE LYS A 10 246.628 47.068 -7.851 1.00 2.29 C
ATOM 152 NZ LYS A 10 248.089 47.270 -8.068 1.00 3.12 N
ATOM 153 H LYS A 10 246.155 45.972 -1.550 1.00 0.78 H
ATOM 154 HA LYS A 10 247.591 48.048 -2.994 1.00 0.79 H
ATOM 155 HB2 LYS A 10 247.054 45.794 -3.959 1.00 1.03 H
ATOM 156 HB3 LYS A 10 245.355 46.256 -3.981 1.00 1.31 H
ATOM 157 HG2 LYS A 10 245.850 48.139 -5.465 1.00 1.86 H
ATOM 158 HG3 LYS A 10 247.569 47.756 -5.397 1.00 1.91 H
ATOM 159 HD2 LYS A 10 247.122 45.554 -6.413 1.00 2.25 H
ATOM 160 HD3 LYS A 10 245.408 45.938 -6.495 1.00 2.07 H
ATOM 161 HE2 LYS A 10 246.225 46.465 -8.654 1.00 2.53 H
ATOM 162 HE3 LYS A 10 246.129 48.028 -7.837 1.00 2.57 H
ATOM 163 HZ1 LYS A 10 248.577 47.304 -7.148 1.00 3.39 H
ATOM 164 HZ2 LYS A 10 248.242 48.168 -8.576 1.00 3.59 H
ATOM 165 HZ3 LYS A 10 248.467 46.480 -8.632 1.00 3.54 H
ATOM 166 N ALA A 11 244.380 48.413 -2.394 1.00 0.82 N
ATOM 167 CA ALA A 11 243.302 49.441 -2.385 1.00 0.84 C
ATOM 168 C ALA A 11 243.698 50.587 -1.451 1.00 0.79 C
ATOM 169 O ALA A 11 243.573 51.746 -1.786 1.00 0.80 O
ATOM 170 CB ALA A 11 241.997 48.810 -1.893 1.00 0.87 C
ATOM 171 H ALA A 11 244.213 47.524 -2.017 1.00 0.82 H
ATOM 172 HA ALA A 11 243.162 49.824 -3.385 1.00 0.87 H
ATOM 173 HB1 ALA A 11 242.095 48.550 -0.851 1.00 1.31 H
ATOM 174 HB2 ALA A 11 241.790 47.917 -2.468 1.00 1.35 H
ATOM 175 HB3 ALA A 11 241.187 49.513 -2.014 1.00 1.33 H
ATOM 176 N LYS A 12 244.174 50.270 -0.277 1.00 0.74 N
ATOM 177 CA LYS A 12 244.578 51.340 0.678 1.00 0.70 C
ATOM 178 C LYS A 12 245.586 52.274 0.002 1.00 0.69 C
ATOM 179 O LYS A 12 245.625 53.461 0.273 1.00 0.68 O
ATOM 180 CB LYS A 12 245.218 50.703 1.914 1.00 0.67 C
ATOM 181 CG LYS A 12 245.457 51.782 2.979 1.00 1.28 C
ATOM 182 CD LYS A 12 246.043 51.153 4.252 1.00 1.86 C
ATOM 183 CE LYS A 12 244.946 50.436 5.054 1.00 2.50 C
ATOM 184 NZ LYS A 12 245.469 50.110 6.408 1.00 3.02 N
ATOM 185 H LYS A 12 244.266 49.328 -0.024 1.00 0.74 H
ATOM 186 HA LYS A 12 243.707 51.906 0.974 1.00 0.72 H
ATOM 187 HB2 LYS A 12 244.557 49.945 2.302 1.00 1.07 H
ATOM 188 HB3 LYS A 12 246.159 50.255 1.642 1.00 1.07 H
ATOM 189 HG2 LYS A 12 246.152 52.514 2.591 1.00 1.99 H
ATOM 190 HG3 LYS A 12 244.525 52.269 3.212 1.00 1.72 H
ATOM 191 HD2 LYS A 12 246.808 50.442 3.981 1.00 2.25 H
ATOM 192 HD3 LYS A 12 246.479 51.927 4.864 1.00 2.36 H
ATOM 193 HE2 LYS A 12 244.083 51.077 5.147 1.00 2.81 H
ATOM 194 HE3 LYS A 12 244.664 49.523 4.554 1.00 2.96 H
ATOM 195 HZ1 LYS A 12 246.382 50.585 6.550 1.00 3.28 H
ATOM 196 HZ2 LYS A 12 245.598 49.079 6.492 1.00 3.55 H
ATOM 197 HZ3 LYS A 12 244.794 50.437 7.129 1.00 3.19 H
ATOM 198 N GLU A 13 246.397 51.753 -0.878 1.00 0.69 N
ATOM 199 CA GLU A 13 247.398 52.614 -1.570 1.00 0.70 C
ATOM 200 C GLU A 13 246.672 53.631 -2.452 1.00 0.73 C
ATOM 201 O GLU A 13 247.123 54.740 -2.638 1.00 0.72 O
ATOM 202 CB GLU A 13 248.308 51.743 -2.439 1.00 0.72 C
ATOM 203 CG GLU A 13 249.388 52.614 -3.081 1.00 1.32 C
ATOM 204 CD GLU A 13 250.336 51.735 -3.896 1.00 1.84 C
ATOM 205 OE1 GLU A 13 250.293 50.531 -3.717 1.00 2.34 O
ATOM 206 OE2 GLU A 13 251.086 52.280 -4.688 1.00 2.49 O
ATOM 207 H GLU A 13 246.347 50.796 -1.084 1.00 0.71 H
ATOM 208 HA GLU A 13 247.994 53.135 -0.835 1.00 0.67 H
ATOM 209 HB2 GLU A 13 248.772 50.983 -1.826 1.00 1.06 H
ATOM 210 HB3 GLU A 13 247.720 51.270 -3.212 1.00 1.11 H
ATOM 211 HG2 GLU A 13 248.924 53.343 -3.730 1.00 1.90 H
ATOM 212 HG3 GLU A 13 249.945 53.123 -2.312 1.00 1.89 H
ATOM 213 N GLY A 14 245.547 53.258 -3.000 1.00 0.77 N
ATOM 214 CA GLY A 14 244.792 54.203 -3.870 1.00 0.81 C
ATOM 215 C GLY A 14 244.016 55.192 -2.998 1.00 0.80 C
ATOM 216 O GLY A 14 243.986 56.374 -3.264 1.00 0.80 O
ATOM 217 H GLY A 14 245.200 52.356 -2.839 1.00 0.77 H
ATOM 218 HA2 GLY A 14 245.485 54.744 -4.502 1.00 0.82 H
ATOM 219 HA3 GLY A 14 244.099 53.654 -4.484 1.00 0.85 H
ATOM 220 N VAL A 15 243.389 54.714 -1.958 1.00 0.78 N
ATOM 221 CA VAL A 15 242.617 55.628 -1.069 1.00 0.79 C
ATOM 222 C VAL A 15 243.547 56.715 -0.526 1.00 0.74 C
ATOM 223 O VAL A 15 243.170 57.863 -0.404 1.00 0.74 O
ATOM 224 CB VAL A 15 242.030 54.830 0.096 1.00 0.81 C
ATOM 225 CG1 VAL A 15 241.289 55.779 1.044 1.00 1.48 C
ATOM 226 CG2 VAL A 15 241.054 53.784 -0.446 1.00 1.40 C
ATOM 227 H VAL A 15 243.427 53.755 -1.761 1.00 0.78 H
ATOM 228 HA VAL A 15 241.817 56.086 -1.632 1.00 0.82 H
ATOM 229 HB VAL A 15 242.829 54.338 0.631 1.00 1.39 H
ATOM 230 HG11 VAL A 15 242.006 56.382 1.581 1.00 2.09 H
ATOM 231 HG12 VAL A 15 240.707 55.203 1.748 1.00 1.99 H
ATOM 232 HG13 VAL A 15 240.634 56.419 0.474 1.00 1.94 H
ATOM 233 HG21 VAL A 15 240.186 54.281 -0.854 1.00 1.93 H
ATOM 234 HG22 VAL A 15 240.751 53.127 0.355 1.00 1.90 H
ATOM 235 HG23 VAL A 15 241.537 53.208 -1.221 1.00 1.97 H
ATOM 236 N VAL A 16 244.761 56.363 -0.203 1.00 0.70 N
ATOM 237 CA VAL A 16 245.714 57.376 0.331 1.00 0.66 C
ATOM 238 C VAL A 16 246.142 58.314 -0.799 1.00 0.66 C
ATOM 239 O VAL A 16 246.127 59.522 -0.656 1.00 0.66 O
ATOM 240 CB VAL A 16 246.944 56.669 0.900 1.00 0.63 C
ATOM 241 CG1 VAL A 16 248.003 57.701 1.291 1.00 1.09 C
ATOM 242 CG2 VAL A 16 246.543 55.869 2.138 1.00 1.12 C
ATOM 243 H VAL A 16 245.046 55.431 -0.311 1.00 0.70 H
ATOM 244 HA VAL A 16 245.233 57.947 1.111 1.00 0.66 H
ATOM 245 HB VAL A 16 247.351 56.000 0.154 1.00 0.96 H
ATOM 246 HG11 VAL A 16 247.538 58.499 1.850 1.00 1.47 H
ATOM 247 HG12 VAL A 16 248.459 58.105 0.398 1.00 1.60 H
ATOM 248 HG13 VAL A 16 248.760 57.229 1.901 1.00 1.66 H
ATOM 249 HG21 VAL A 16 247.395 55.315 2.503 1.00 1.68 H
ATOM 250 HG22 VAL A 16 245.753 55.178 1.883 1.00 1.54 H
ATOM 251 HG23 VAL A 16 246.198 56.544 2.910 1.00 1.67 H
ATOM 252 N ALA A 17 246.516 57.770 -1.924 1.00 0.69 N
ATOM 253 CA ALA A 17 246.942 58.632 -3.062 1.00 0.71 C
ATOM 254 C ALA A 17 245.806 59.588 -3.428 1.00 0.74 C
ATOM 255 O ALA A 17 246.026 60.742 -3.730 1.00 0.74 O
ATOM 256 CB ALA A 17 247.279 57.753 -4.269 1.00 0.75 C
ATOM 257 H ALA A 17 246.515 56.795 -2.021 1.00 0.70 H
ATOM 258 HA ALA A 17 247.814 59.201 -2.776 1.00 0.69 H
ATOM 259 HB1 ALA A 17 248.206 57.226 -4.086 1.00 1.31 H
ATOM 260 HB2 ALA A 17 247.383 58.374 -5.148 1.00 1.22 H
ATOM 261 HB3 ALA A 17 246.484 57.039 -4.427 1.00 1.26 H
ATOM 262 N ALA A 18 244.590 59.115 -3.404 1.00 0.77 N
ATOM 263 CA ALA A 18 243.440 59.997 -3.748 1.00 0.81 C
ATOM 264 C ALA A 18 243.275 61.062 -2.662 1.00 0.79 C
ATOM 265 O ALA A 18 242.883 62.181 -2.931 1.00 0.81 O
ATOM 266 CB ALA A 18 242.163 59.160 -3.839 1.00 0.86 C
ATOM 267 H ALA A 18 244.433 58.179 -3.157 1.00 0.78 H
ATOM 268 HA ALA A 18 243.626 60.477 -4.698 1.00 0.84 H
ATOM 269 HB1 ALA A 18 241.918 58.771 -2.862 1.00 1.35 H
ATOM 270 HB2 ALA A 18 242.317 58.339 -4.524 1.00 1.22 H
ATOM 271 HB3 ALA A 18 241.353 59.778 -4.195 1.00 1.39 H
ATOM 272 N ALA A 19 243.568 60.723 -1.436 1.00 0.75 N
ATOM 273 CA ALA A 19 243.428 61.716 -0.334 1.00 0.73 C
ATOM 274 C ALA A 19 244.385 62.885 -0.576 1.00 0.71 C
ATOM 275 O ALA A 19 243.985 64.031 -0.608 1.00 0.72 O
ATOM 276 CB ALA A 19 243.765 61.048 1.000 1.00 0.70 C
ATOM 277 H ALA A 19 243.880 59.815 -1.241 1.00 0.74 H
ATOM 278 HA ALA A 19 242.412 62.083 -0.307 1.00 0.76 H
ATOM 279 HB1 ALA A 19 243.779 61.792 1.782 1.00 1.14 H
ATOM 280 HB2 ALA A 19 244.734 60.579 0.931 1.00 1.24 H
ATOM 281 HB3 ALA A 19 243.020 60.300 1.227 1.00 1.30 H
ATOM 282 N GLU A 20 245.648 62.604 -0.748 1.00 0.69 N
ATOM 283 CA GLU A 20 246.629 63.699 -0.987 1.00 0.68 C
ATOM 284 C GLU A 20 246.130 64.590 -2.126 1.00 0.71 C
ATOM 285 O GLU A 20 246.217 65.799 -2.067 1.00 0.69 O
ATOM 286 CB GLU A 20 247.984 63.097 -1.368 1.00 0.70 C
ATOM 287 CG GLU A 20 248.569 62.357 -0.163 1.00 0.69 C
ATOM 288 CD GLU A 20 249.879 61.680 -0.571 1.00 1.40 C
ATOM 289 OE1 GLU A 20 250.268 61.834 -1.720 1.00 2.07 O
ATOM 290 OE2 GLU A 20 250.469 61.017 0.269 1.00 2.14 O
ATOM 291 H GLU A 20 245.951 61.672 -0.720 1.00 0.69 H
ATOM 292 HA GLU A 20 246.737 64.289 -0.089 1.00 0.66 H
ATOM 293 HB2 GLU A 20 247.853 62.405 -2.187 1.00 0.73 H
ATOM 294 HB3 GLU A 20 248.659 63.886 -1.666 1.00 0.71 H
ATOM 295 HG2 GLU A 20 248.759 63.060 0.635 1.00 1.13 H
ATOM 296 HG3 GLU A 20 247.868 61.609 0.175 1.00 1.12 H
ATOM 297 N LYS A 21 245.605 64.000 -3.165 1.00 0.78 N
ATOM 298 CA LYS A 21 245.101 64.811 -4.308 1.00 0.82 C
ATOM 299 C LYS A 21 243.825 65.546 -3.890 1.00 0.82 C
ATOM 300 O LYS A 21 243.731 66.754 -3.986 1.00 0.83 O
ATOM 301 CB LYS A 21 244.794 63.890 -5.490 1.00 0.90 C
ATOM 302 CG LYS A 21 244.708 64.710 -6.782 1.00 1.54 C
ATOM 303 CD LYS A 21 244.539 63.764 -7.970 1.00 1.81 C
ATOM 304 CE LYS A 21 244.476 64.575 -9.265 1.00 2.16 C
ATOM 305 NZ LYS A 21 244.345 63.646 -10.425 1.00 2.60 N
ATOM 306 H LYS A 21 245.544 63.022 -3.194 1.00 0.80 H
ATOM 307 HA LYS A 21 245.852 65.530 -4.598 1.00 0.81 H
ATOM 308 HB2 LYS A 21 245.582 63.157 -5.584 1.00 1.10 H
ATOM 309 HB3 LYS A 21 243.853 63.386 -5.324 1.00 1.41 H
ATOM 310 HG2 LYS A 21 243.861 65.377 -6.730 1.00 2.25 H
ATOM 311 HG3 LYS A 21 245.614 65.285 -6.907 1.00 1.91 H
ATOM 312 HD2 LYS A 21 245.377 63.084 -8.011 1.00 2.10 H
ATOM 313 HD3 LYS A 21 243.626 63.201 -7.856 1.00 2.39 H
ATOM 314 HE2 LYS A 21 243.624 65.236 -9.234 1.00 2.62 H
ATOM 315 HE3 LYS A 21 245.380 65.158 -9.368 1.00 2.60 H
ATOM 316 HZ1 LYS A 21 243.347 63.378 -10.543 1.00 3.06 H
ATOM 317 HZ2 LYS A 21 244.918 62.795 -10.252 1.00 2.89 H
ATOM 318 HZ3 LYS A 21 244.680 64.116 -11.287 1.00 2.93 H
ATOM 319 N THR A 22 242.837 64.828 -3.432 1.00 0.83 N
ATOM 320 CA THR A 22 241.570 65.488 -3.011 1.00 0.86 C
ATOM 321 C THR A 22 241.875 66.541 -1.943 1.00 0.82 C
ATOM 322 O THR A 22 241.228 67.564 -1.863 1.00 0.85 O
ATOM 323 CB THR A 22 240.614 64.439 -2.437 1.00 0.88 C
ATOM 324 OG1 THR A 22 240.545 63.332 -3.321 1.00 1.55 O
ATOM 325 CG2 THR A 22 239.221 65.053 -2.265 1.00 1.10 C
ATOM 326 H THR A 22 242.928 63.854 -3.366 1.00 0.83 H
ATOM 327 HA THR A 22 241.111 65.964 -3.865 1.00 0.90 H
ATOM 328 HB THR A 22 240.976 64.113 -1.477 1.00 1.36 H
ATOM 329 HG1 THR A 22 239.647 63.270 -3.654 1.00 1.97 H
ATOM 330 HG21 THR A 22 239.254 65.799 -1.485 1.00 1.64 H
ATOM 331 HG22 THR A 22 238.519 64.277 -1.994 1.00 1.70 H
ATOM 332 HG23 THR A 22 238.913 65.509 -3.195 1.00 1.59 H
ATOM 333 N LYS A 23 242.859 66.298 -1.121 1.00 0.77 N
ATOM 334 CA LYS A 23 243.207 67.286 -0.061 1.00 0.76 C
ATOM 335 C LYS A 23 243.887 68.498 -0.700 1.00 0.75 C
ATOM 336 O LYS A 23 243.809 69.603 -0.198 1.00 0.76 O
ATOM 337 CB LYS A 23 244.159 66.638 0.946 1.00 0.75 C
ATOM 338 CG LYS A 23 244.407 67.612 2.099 1.00 1.25 C
ATOM 339 CD LYS A 23 245.316 66.958 3.140 1.00 1.63 C
ATOM 340 CE LYS A 23 245.546 67.933 4.298 1.00 2.38 C
ATOM 341 NZ LYS A 23 246.414 67.292 5.324 1.00 2.87 N
ATOM 342 H LYS A 23 243.370 65.466 -1.202 1.00 0.75 H
ATOM 343 HA LYS A 23 242.307 67.603 0.446 1.00 0.78 H
ATOM 344 HB2 LYS A 23 243.717 65.730 1.327 1.00 1.15 H
ATOM 345 HB3 LYS A 23 245.098 66.410 0.461 1.00 1.16 H
ATOM 346 HG2 LYS A 23 244.882 68.505 1.717 1.00 1.93 H
ATOM 347 HG3 LYS A 23 243.465 67.872 2.561 1.00 1.83 H
ATOM 348 HD2 LYS A 23 244.847 66.058 3.513 1.00 2.05 H
ATOM 349 HD3 LYS A 23 246.263 66.711 2.687 1.00 2.06 H
ATOM 350 HE2 LYS A 23 246.027 68.827 3.928 1.00 2.79 H
ATOM 351 HE3 LYS A 23 244.596 68.193 4.741 1.00 2.92 H
ATOM 352 HZ1 LYS A 23 247.411 67.515 5.125 1.00 3.02 H
ATOM 353 HZ2 LYS A 23 246.276 66.261 5.300 1.00 3.31 H
ATOM 354 HZ3 LYS A 23 246.163 67.655 6.264 1.00 3.27 H
ATOM 355 N GLN A 24 244.560 68.299 -1.801 1.00 0.75 N
ATOM 356 CA GLN A 24 245.247 69.438 -2.475 1.00 0.77 C
ATOM 357 C GLN A 24 244.241 70.199 -3.342 1.00 0.78 C
ATOM 358 O GLN A 24 244.418 71.364 -3.636 1.00 0.78 O
ATOM 359 CB GLN A 24 246.374 68.900 -3.359 1.00 0.81 C
ATOM 360 CG GLN A 24 247.169 70.069 -3.937 1.00 1.22 C
ATOM 361 CD GLN A 24 248.358 69.537 -4.735 1.00 1.62 C
ATOM 362 OE1 GLN A 24 248.727 68.385 -4.605 1.00 1.90 O
ATOM 363 NE2 GLN A 24 248.986 70.338 -5.554 1.00 2.51 N
ATOM 364 H GLN A 24 244.613 67.400 -2.186 1.00 0.76 H
ATOM 365 HA GLN A 24 245.659 70.104 -1.731 1.00 0.76 H
ATOM 366 HB2 GLN A 24 247.029 68.276 -2.767 1.00 1.23 H
ATOM 367 HB3 GLN A 24 245.954 68.320 -4.165 1.00 1.44 H
ATOM 368 HG2 GLN A 24 246.534 70.653 -4.585 1.00 1.91 H
ATOM 369 HG3 GLN A 24 247.531 70.687 -3.134 1.00 1.81 H
ATOM 370 HE21 GLN A 24 248.693 71.268 -5.648 1.00 2.95 H
ATOM 371 HE22 GLN A 24 249.748 70.009 -6.075 1.00 3.00 H
ATOM 372 N GLY A 25 243.188 69.548 -3.755 1.00 0.81 N
ATOM 373 CA GLY A 25 242.173 70.234 -4.603 1.00 0.85 C
ATOM 374 C GLY A 25 241.392 71.239 -3.754 1.00 0.85 C
ATOM 375 O GLY A 25 241.241 72.391 -4.118 1.00 0.87 O
ATOM 376 H GLY A 25 243.066 68.608 -3.509 1.00 0.82 H
ATOM 377 HA2 GLY A 25 242.667 70.754 -5.408 1.00 0.87 H
ATOM 378 HA3 GLY A 25 241.488 69.504 -5.008 1.00 0.89 H
ATOM 379 N VAL A 26 240.898 70.816 -2.623 1.00 0.83 N
ATOM 380 CA VAL A 26 240.129 71.749 -1.752 1.00 0.85 C
ATOM 381 C VAL A 26 241.026 72.919 -1.343 1.00 0.81 C
ATOM 382 O VAL A 26 240.572 74.034 -1.178 1.00 0.83 O
ATOM 383 CB VAL A 26 239.659 71.005 -0.500 1.00 0.87 C
ATOM 384 CG1 VAL A 26 238.609 69.962 -0.892 1.00 0.92 C
ATOM 385 CG2 VAL A 26 240.849 70.303 0.152 1.00 0.82 C
ATOM 386 H VAL A 26 241.033 69.886 -2.346 1.00 0.82 H
ATOM 387 HA VAL A 26 239.272 72.123 -2.292 1.00 0.89 H
ATOM 388 HB VAL A 26 239.226 71.709 0.196 1.00 0.89 H
ATOM 389 HG11 VAL A 26 237.804 70.446 -1.424 1.00 1.45 H
ATOM 390 HG12 VAL A 26 238.221 69.492 -0.003 1.00 1.35 H
ATOM 391 HG13 VAL A 26 239.061 69.215 -1.527 1.00 1.24 H
ATOM 392 HG21 VAL A 26 241.289 69.610 -0.549 1.00 1.39 H
ATOM 393 HG22 VAL A 26 240.512 69.762 1.026 1.00 1.24 H
ATOM 394 HG23 VAL A 26 241.586 71.035 0.446 1.00 1.22 H
ATOM 395 N ALA A 27 242.297 72.673 -1.178 1.00 0.77 N
ATOM 396 CA ALA A 27 243.222 73.771 -0.780 1.00 0.76 C
ATOM 397 C ALA A 27 243.146 74.901 -1.808 1.00 0.76 C
ATOM 398 O ALA A 27 242.914 76.043 -1.470 1.00 0.76 O
ATOM 399 CB ALA A 27 244.653 73.233 -0.719 1.00 0.75 C
ATOM 400 H ALA A 27 242.642 71.767 -1.315 1.00 0.77 H
ATOM 401 HA ALA A 27 242.938 74.148 0.192 1.00 0.77 H
ATOM 402 HB1 ALA A 27 244.843 72.620 -1.585 1.00 1.10 H
ATOM 403 HB2 ALA A 27 244.777 72.644 0.176 1.00 1.10 H
ATOM 404 HB3 ALA A 27 245.350 74.057 -0.703 1.00 1.26 H
ATOM 405 N GLU A 28 243.341 74.590 -3.061 1.00 0.78 N
ATOM 406 CA GLU A 28 243.279 75.647 -4.109 1.00 0.80 C
ATOM 407 C GLU A 28 241.845 76.168 -4.223 1.00 0.82 C
ATOM 408 O GLU A 28 241.615 77.344 -4.436 1.00 0.83 O
ATOM 409 CB GLU A 28 243.717 75.060 -5.452 1.00 0.86 C
ATOM 410 CG GLU A 28 245.205 74.707 -5.400 1.00 0.96 C
ATOM 411 CD GLU A 28 245.618 74.036 -6.709 1.00 1.48 C
ATOM 412 OE1 GLU A 28 244.769 73.906 -7.577 1.00 2.12 O
ATOM 413 OE2 GLU A 28 246.772 73.666 -6.823 1.00 2.23 O
ATOM 414 H GLU A 28 243.528 73.662 -3.312 1.00 0.79 H
ATOM 415 HA GLU A 28 243.937 76.460 -3.840 1.00 0.79 H
ATOM 416 HB2 GLU A 28 243.144 74.168 -5.659 1.00 0.87 H
ATOM 417 HB3 GLU A 28 243.550 75.787 -6.232 1.00 0.87 H
ATOM 418 HG2 GLU A 28 245.781 75.609 -5.260 1.00 1.37 H
ATOM 419 HG3 GLU A 28 245.384 74.034 -4.578 1.00 1.57 H
ATOM 420 N ALA A 29 240.877 75.304 -4.085 1.00 0.84 N
ATOM 421 CA ALA A 29 239.459 75.752 -4.185 1.00 0.90 C
ATOM 422 C ALA A 29 239.180 76.805 -3.112 1.00 0.89 C
ATOM 423 O ALA A 29 238.546 77.810 -3.364 1.00 0.92 O
ATOM 424 CB ALA A 29 238.530 74.554 -3.978 1.00 0.96 C
ATOM 425 H ALA A 29 241.082 74.361 -3.914 1.00 0.84 H
ATOM 426 HA ALA A 29 239.284 76.178 -5.162 1.00 0.92 H
ATOM 427 HB1 ALA A 29 238.883 73.720 -4.566 1.00 1.34 H
ATOM 428 HB2 ALA A 29 237.530 74.815 -4.290 1.00 1.56 H
ATOM 429 HB3 ALA A 29 238.522 74.281 -2.934 1.00 1.28 H
ATOM 430 N ALA A 30 239.649 76.584 -1.915 1.00 0.88 N
ATOM 431 CA ALA A 30 239.411 77.574 -0.827 1.00 0.92 C
ATOM 432 C ALA A 30 239.882 78.956 -1.284 1.00 0.91 C
ATOM 433 O ALA A 30 239.115 79.898 -1.334 1.00 0.95 O
ATOM 434 CB ALA A 30 240.192 77.157 0.422 1.00 0.95 C
ATOM 435 H ALA A 30 240.159 75.768 -1.731 1.00 0.87 H
ATOM 436 HA ALA A 30 238.356 77.610 -0.597 1.00 0.96 H
ATOM 437 HB1 ALA A 30 241.230 77.007 0.162 1.00 1.41 H
ATOM 438 HB2 ALA A 30 239.780 76.240 0.812 1.00 1.36 H
ATOM 439 HB3 ALA A 30 240.116 77.933 1.172 1.00 1.41 H
ATOM 440 N GLY A 31 241.138 79.086 -1.612 1.00 0.88 N
ATOM 441 CA GLY A 31 241.659 80.407 -2.064 1.00 0.91 C
ATOM 442 C GLY A 31 240.901 80.860 -3.313 1.00 0.90 C
ATOM 443 O GLY A 31 240.775 82.037 -3.580 1.00 0.94 O
ATOM 444 H GLY A 31 241.740 78.314 -1.559 1.00 0.86 H
ATOM 445 HA2 GLY A 31 241.523 81.135 -1.276 1.00 0.94 H
ATOM 446 HA3 GLY A 31 242.707 80.320 -2.297 1.00 0.94 H
ATOM 447 N LYS A 32 240.398 79.935 -4.084 1.00 0.89 N
ATOM 448 CA LYS A 32 239.650 80.320 -5.314 1.00 0.92 C
ATOM 449 C LYS A 32 238.311 80.947 -4.916 1.00 0.94 C
ATOM 450 O LYS A 32 237.913 81.970 -5.437 1.00 0.96 O
ATOM 451 CB LYS A 32 239.409 79.073 -6.178 1.00 0.95 C
ATOM 452 CG LYS A 32 239.072 79.498 -7.611 1.00 1.41 C
ATOM 453 CD LYS A 32 238.972 78.259 -8.502 1.00 1.79 C
ATOM 454 CE LYS A 32 238.767 78.690 -9.957 1.00 2.48 C
ATOM 455 NZ LYS A 32 237.481 79.433 -10.082 1.00 3.13 N
ATOM 456 H LYS A 32 240.512 78.989 -3.855 1.00 0.89 H
ATOM 457 HA LYS A 32 240.231 81.040 -5.872 1.00 0.95 H
ATOM 458 HB2 LYS A 32 240.298 78.461 -6.185 1.00 1.18 H
ATOM 459 HB3 LYS A 32 238.589 78.505 -5.772 1.00 1.37 H
ATOM 460 HG2 LYS A 32 238.129 80.025 -7.616 1.00 2.02 H
ATOM 461 HG3 LYS A 32 239.849 80.144 -7.987 1.00 1.87 H
ATOM 462 HD2 LYS A 32 239.885 77.685 -8.422 1.00 2.12 H
ATOM 463 HD3 LYS A 32 238.134 77.654 -8.185 1.00 2.22 H
ATOM 464 HE2 LYS A 32 239.583 79.327 -10.262 1.00 2.80 H
ATOM 465 HE3 LYS A 32 238.739 77.814 -10.589 1.00 2.97 H
ATOM 466 HZ1 LYS A 32 237.549 80.117 -10.863 1.00 3.60 H
ATOM 467 HZ2 LYS A 32 237.281 79.936 -9.194 1.00 3.55 H
ATOM 468 HZ3 LYS A 32 236.713 78.761 -10.282 1.00 3.28 H
ATOM 469 N THR A 33 237.616 80.345 -3.989 1.00 0.97 N
ATOM 470 CA THR A 33 236.308 80.910 -3.552 1.00 1.03 C
ATOM 471 C THR A 33 236.547 82.264 -2.882 1.00 1.03 C
ATOM 472 O THR A 33 235.669 83.102 -2.819 1.00 1.07 O
ATOM 473 CB THR A 33 235.647 79.957 -2.554 1.00 1.12 C
ATOM 474 OG1 THR A 33 235.622 78.649 -3.099 1.00 1.47 O
ATOM 475 CG2 THR A 33 234.218 80.421 -2.270 1.00 1.69 C
ATOM 476 H THR A 33 237.957 79.524 -3.577 1.00 0.97 H
ATOM 477 HA THR A 33 235.665 81.039 -4.410 1.00 1.05 H
ATOM 478 HB THR A 33 236.207 79.952 -1.635 1.00 1.32 H
ATOM 479 HG1 THR A 33 236.519 78.413 -3.351 1.00 1.90 H
ATOM 480 HG21 THR A 33 233.701 79.665 -1.699 1.00 2.17 H
ATOM 481 HG22 THR A 33 233.699 80.586 -3.203 1.00 2.02 H
ATOM 482 HG23 THR A 33 234.244 81.343 -1.705 1.00 2.18 H
ATOM 483 N LYS A 34 237.733 82.480 -2.382 1.00 1.04 N
ATOM 484 CA LYS A 34 238.042 83.775 -1.713 1.00 1.11 C
ATOM 485 C LYS A 34 237.940 84.913 -2.734 1.00 1.08 C
ATOM 486 O LYS A 34 237.502 86.001 -2.427 1.00 1.11 O
ATOM 487 CB LYS A 34 239.464 83.717 -1.143 1.00 1.19 C
ATOM 488 CG LYS A 34 239.651 84.817 -0.095 1.00 1.78 C
ATOM 489 CD LYS A 34 241.034 84.681 0.544 1.00 2.13 C
ATOM 490 CE LYS A 34 241.239 85.799 1.570 1.00 2.87 C
ATOM 491 NZ LYS A 34 240.283 85.617 2.702 1.00 3.37 N
ATOM 492 H LYS A 34 238.423 81.788 -2.446 1.00 1.02 H
ATOM 493 HA LYS A 34 237.337 83.944 -0.912 1.00 1.17 H
ATOM 494 HB2 LYS A 34 239.625 82.751 -0.682 1.00 1.54 H
ATOM 495 HB3 LYS A 34 240.179 83.857 -1.940 1.00 1.52 H
ATOM 496 HG2 LYS A 34 239.565 85.783 -0.568 1.00 2.32 H
ATOM 497 HG3 LYS A 34 238.897 84.721 0.667 1.00 2.30 H
ATOM 498 HD2 LYS A 34 241.112 83.721 1.033 1.00 2.52 H
ATOM 499 HD3 LYS A 34 241.793 84.756 -0.224 1.00 2.28 H
ATOM 500 HE2 LYS A 34 242.252 85.762 1.944 1.00 3.18 H
ATOM 501 HE3 LYS A 34 241.062 86.754 1.100 1.00 3.40 H
ATOM 502 HZ1 LYS A 34 240.213 86.505 3.241 1.00 3.79 H
ATOM 503 HZ2 LYS A 34 240.625 84.858 3.325 1.00 3.60 H
ATOM 504 HZ3 LYS A 34 239.347 85.364 2.328 1.00 3.65 H
ATOM 505 N GLU A 35 238.353 84.668 -3.948 1.00 1.06 N
ATOM 506 CA GLU A 35 238.286 85.729 -4.991 1.00 1.12 C
ATOM 507 C GLU A 35 236.867 85.798 -5.562 1.00 1.07 C
ATOM 508 O GLU A 35 236.469 86.792 -6.142 1.00 1.09 O
ATOM 509 CB GLU A 35 239.272 85.397 -6.114 1.00 1.21 C
ATOM 510 CG GLU A 35 239.250 86.501 -7.176 1.00 1.69 C
ATOM 511 CD GLU A 35 240.279 86.182 -8.264 1.00 2.36 C
ATOM 512 OE1 GLU A 35 239.986 85.351 -9.107 1.00 2.87 O
ATOM 513 OE2 GLU A 35 241.344 86.776 -8.235 1.00 3.03 O
ATOM 514 H GLU A 35 238.710 83.783 -4.173 1.00 1.05 H
ATOM 515 HA GLU A 35 238.545 86.682 -4.554 1.00 1.20 H
ATOM 516 HB2 GLU A 35 240.267 85.311 -5.703 1.00 1.59 H
ATOM 517 HB3 GLU A 35 238.990 84.457 -6.569 1.00 1.43 H
ATOM 518 HG2 GLU A 35 238.269 86.563 -7.620 1.00 2.24 H
ATOM 519 HG3 GLU A 35 239.498 87.445 -6.718 1.00 2.06 H
ATOM 520 N GLY A 36 236.103 84.753 -5.406 1.00 1.07 N
ATOM 521 CA GLY A 36 234.713 84.760 -5.944 1.00 1.13 C
ATOM 522 C GLY A 36 233.936 85.937 -5.351 1.00 1.13 C
ATOM 523 O GLY A 36 233.416 86.769 -6.062 1.00 1.19 O
ATOM 524 H GLY A 36 236.443 83.962 -4.938 1.00 1.09 H
ATOM 525 HA2 GLY A 36 234.747 84.855 -7.019 1.00 1.18 H
ATOM 526 HA3 GLY A 36 234.220 83.837 -5.677 1.00 1.19 H
ATOM 527 N VAL A 37 233.850 86.010 -4.051 1.00 1.15 N
ATOM 528 CA VAL A 37 233.103 87.132 -3.415 1.00 1.25 C
ATOM 529 C VAL A 37 233.694 88.467 -3.873 1.00 1.15 C
ATOM 530 O VAL A 37 233.004 89.460 -3.972 1.00 1.22 O
ATOM 531 CB VAL A 37 233.215 87.020 -1.894 1.00 1.42 C
ATOM 532 CG1 VAL A 37 232.559 85.719 -1.430 1.00 2.05 C
ATOM 533 CG2 VAL A 37 234.691 87.019 -1.488 1.00 1.72 C
ATOM 534 H VAL A 37 234.276 85.326 -3.493 1.00 1.15 H
ATOM 535 HA VAL A 37 232.064 87.081 -3.703 1.00 1.35 H
ATOM 536 HB VAL A 37 232.712 87.861 -1.434 1.00 1.89 H
ATOM 537 HG11 VAL A 37 232.431 85.744 -0.359 1.00 2.45 H
ATOM 538 HG12 VAL A 37 233.189 84.882 -1.697 1.00 2.35 H
ATOM 539 HG13 VAL A 37 231.596 85.613 -1.906 1.00 2.66 H
ATOM 540 HG21 VAL A 37 235.144 87.956 -1.770 1.00 2.26 H
ATOM 541 HG22 VAL A 37 235.201 86.210 -1.988 1.00 2.23 H
ATOM 542 HG23 VAL A 37 234.769 86.890 -0.420 1.00 1.96 H
ATOM 543 N LEU A 38 234.969 88.499 -4.154 1.00 1.05 N
ATOM 544 CA LEU A 38 235.608 89.771 -4.604 1.00 1.02 C
ATOM 545 C LEU A 38 235.442 89.915 -6.121 1.00 0.91 C
ATOM 546 O LEU A 38 235.911 89.095 -6.885 1.00 0.86 O
ATOM 547 CB LEU A 38 237.103 89.742 -4.250 1.00 1.08 C
ATOM 548 CG LEU A 38 237.738 91.126 -4.490 1.00 1.63 C
ATOM 549 CD1 LEU A 38 237.469 92.056 -3.294 1.00 2.30 C
ATOM 550 CD2 LEU A 38 239.253 90.971 -4.669 1.00 2.37 C
ATOM 551 H LEU A 38 235.509 87.686 -4.068 1.00 1.05 H
ATOM 552 HA LEU A 38 235.136 90.608 -4.112 1.00 1.09 H
ATOM 553 HB2 LEU A 38 237.220 89.459 -3.211 1.00 1.39 H
ATOM 554 HB3 LEU A 38 237.597 89.009 -4.872 1.00 1.33 H
ATOM 555 HG LEU A 38 237.316 91.565 -5.381 1.00 2.16 H
ATOM 556 HD11 LEU A 38 236.427 92.326 -3.263 1.00 2.81 H
ATOM 557 HD12 LEU A 38 238.066 92.950 -3.399 1.00 2.71 H
ATOM 558 HD13 LEU A 38 237.740 91.555 -2.372 1.00 2.69 H
ATOM 559 HD21 LEU A 38 239.637 90.309 -3.909 1.00 2.81 H
ATOM 560 HD22 LEU A 38 239.729 91.936 -4.581 1.00 2.74 H
ATOM 561 HD23 LEU A 38 239.456 90.555 -5.646 1.00 2.90 H
ATOM 562 N TYR A 39 234.787 90.954 -6.563 1.00 0.93 N
ATOM 563 CA TYR A 39 234.600 91.145 -8.029 1.00 0.89 C
ATOM 564 C TYR A 39 235.964 91.427 -8.673 1.00 0.86 C
ATOM 565 O TYR A 39 236.909 91.807 -8.012 1.00 0.99 O
ATOM 566 CB TYR A 39 233.639 92.333 -8.274 1.00 1.01 C
ATOM 567 CG TYR A 39 232.210 91.865 -8.113 1.00 1.47 C
ATOM 568 CD1 TYR A 39 231.607 91.855 -6.851 1.00 2.17 C
ATOM 569 CD2 TYR A 39 231.491 91.438 -9.235 1.00 2.41 C
ATOM 570 CE1 TYR A 39 230.284 91.417 -6.713 1.00 3.18 C
ATOM 571 CE2 TYR A 39 230.170 91.000 -9.096 1.00 3.42 C
ATOM 572 CZ TYR A 39 229.565 90.988 -7.836 1.00 3.67 C
ATOM 573 OH TYR A 39 228.262 90.553 -7.700 1.00 4.83 O
ATOM 574 H TYR A 39 234.422 91.609 -5.932 1.00 1.02 H
ATOM 575 HA TYR A 39 234.190 90.241 -8.457 1.00 0.90 H
ATOM 576 HB2 TYR A 39 233.843 93.115 -7.556 1.00 1.49 H
ATOM 577 HB3 TYR A 39 233.782 92.714 -9.276 1.00 1.54 H
ATOM 578 HD1 TYR A 39 232.157 92.187 -5.985 1.00 2.47 H
ATOM 579 HD2 TYR A 39 231.956 91.447 -10.209 1.00 2.76 H
ATOM 580 HE1 TYR A 39 229.819 91.408 -5.741 1.00 3.91 H
ATOM 581 HE2 TYR A 39 229.616 90.671 -9.962 1.00 4.29 H
ATOM 582 HH TYR A 39 227.925 90.352 -8.575 1.00 5.05 H
ATOM 583 N VAL A 40 236.065 91.244 -9.964 1.00 0.81 N
ATOM 584 CA VAL A 40 237.357 91.500 -10.667 1.00 0.89 C
ATOM 585 C VAL A 40 237.062 92.042 -12.068 1.00 0.81 C
ATOM 586 O VAL A 40 236.938 91.297 -13.021 1.00 0.77 O
ATOM 587 CB VAL A 40 238.148 90.194 -10.779 1.00 1.03 C
ATOM 588 CG1 VAL A 40 239.598 90.498 -11.162 1.00 1.54 C
ATOM 589 CG2 VAL A 40 238.120 89.465 -9.435 1.00 1.92 C
ATOM 590 H VAL A 40 235.285 90.940 -10.474 1.00 0.80 H
ATOM 591 HA VAL A 40 237.937 92.229 -10.116 1.00 1.02 H
ATOM 592 HB VAL A 40 237.701 89.569 -11.537 1.00 1.26 H
ATOM 593 HG11 VAL A 40 239.613 91.235 -11.951 1.00 2.17 H
ATOM 594 HG12 VAL A 40 240.076 89.590 -11.505 1.00 1.98 H
ATOM 595 HG13 VAL A 40 240.126 90.877 -10.302 1.00 1.96 H
ATOM 596 HG21 VAL A 40 238.777 88.610 -9.476 1.00 2.46 H
ATOM 597 HG22 VAL A 40 237.112 89.136 -9.226 1.00 2.31 H
ATOM 598 HG23 VAL A 40 238.448 90.135 -8.654 1.00 2.42 H
ATOM 599 N GLY A 41 236.944 93.336 -12.198 1.00 0.84 N
ATOM 600 CA GLY A 41 236.650 93.934 -13.533 1.00 0.81 C
ATOM 601 C GLY A 41 237.594 93.354 -14.590 1.00 0.80 C
ATOM 602 O GLY A 41 237.417 93.567 -15.772 1.00 0.83 O
ATOM 603 H GLY A 41 237.043 93.916 -11.414 1.00 0.91 H
ATOM 604 HA2 GLY A 41 235.626 93.715 -13.805 1.00 0.77 H
ATOM 605 HA3 GLY A 41 236.788 95.003 -13.484 1.00 0.88 H
ATOM 606 N SER A 42 238.597 92.625 -14.180 1.00 0.79 N
ATOM 607 CA SER A 42 239.545 92.040 -15.171 1.00 0.81 C
ATOM 608 C SER A 42 238.938 90.770 -15.776 1.00 0.78 C
ATOM 609 O SER A 42 238.948 90.578 -16.973 1.00 0.81 O
ATOM 610 CB SER A 42 240.866 91.698 -14.476 1.00 0.87 C
ATOM 611 OG SER A 42 241.887 91.563 -15.455 1.00 1.67 O
ATOM 612 H SER A 42 238.727 92.465 -13.222 1.00 0.79 H
ATOM 613 HA SER A 42 239.730 92.757 -15.958 1.00 0.83 H
ATOM 614 HB2 SER A 42 241.132 92.486 -13.795 1.00 1.33 H
ATOM 615 HB3 SER A 42 240.757 90.769 -13.927 1.00 1.17 H
ATOM 616 HG SER A 42 241.969 92.403 -15.913 1.00 2.13 H
ATOM 617 N LYS A 43 238.407 89.901 -14.956 1.00 0.81 N
ATOM 618 CA LYS A 43 237.800 88.643 -15.487 1.00 0.83 C
ATOM 619 C LYS A 43 236.346 88.906 -15.889 1.00 0.70 C
ATOM 620 O LYS A 43 235.428 88.649 -15.135 1.00 0.85 O
ATOM 621 CB LYS A 43 237.839 87.559 -14.406 1.00 1.11 C
ATOM 622 CG LYS A 43 237.363 86.230 -15.008 1.00 1.69 C
ATOM 623 CD LYS A 43 237.489 85.099 -13.964 1.00 2.28 C
ATOM 624 CE LYS A 43 238.894 84.476 -13.994 1.00 2.80 C
ATOM 625 NZ LYS A 43 239.864 85.398 -13.336 1.00 3.35 N
ATOM 626 H LYS A 43 238.407 90.074 -13.991 1.00 0.86 H
ATOM 627 HA LYS A 43 238.357 88.309 -16.350 1.00 0.84 H
ATOM 628 HB2 LYS A 43 238.850 87.452 -14.045 1.00 1.36 H
ATOM 629 HB3 LYS A 43 237.188 87.837 -13.589 1.00 1.61 H
ATOM 630 HG2 LYS A 43 236.329 86.330 -15.305 1.00 2.21 H
ATOM 631 HG3 LYS A 43 237.957 85.998 -15.877 1.00 2.03 H
ATOM 632 HD2 LYS A 43 237.296 85.492 -12.976 1.00 2.63 H
ATOM 633 HD3 LYS A 43 236.761 84.331 -14.184 1.00 2.73 H
ATOM 634 HE2 LYS A 43 238.879 83.537 -13.458 1.00 3.07 H
ATOM 635 HE3 LYS A 43 239.200 84.298 -15.014 1.00 3.26 H
ATOM 636 HZ1 LYS A 43 240.263 86.042 -14.047 1.00 3.64 H
ATOM 637 HZ2 LYS A 43 240.628 84.843 -12.900 1.00 3.68 H
ATOM 638 HZ3 LYS A 43 239.379 85.951 -12.604 1.00 3.72 H
ATOM 639 N THR A 44 236.130 89.413 -17.074 1.00 0.56 N
ATOM 640 CA THR A 44 234.736 89.693 -17.533 1.00 0.61 C
ATOM 641 C THR A 44 234.188 88.469 -18.272 1.00 0.60 C
ATOM 642 O THR A 44 234.923 87.571 -18.635 1.00 0.57 O
ATOM 643 CB THR A 44 234.747 90.897 -18.480 1.00 0.69 C
ATOM 644 OG1 THR A 44 235.267 92.027 -17.795 1.00 0.72 O
ATOM 645 CG2 THR A 44 233.323 91.199 -18.954 1.00 0.93 C
ATOM 646 H THR A 44 236.887 89.610 -17.666 1.00 0.57 H
ATOM 647 HA THR A 44 234.107 89.911 -16.681 1.00 0.73 H
ATOM 648 HB THR A 44 235.368 90.678 -19.335 1.00 0.69 H
ATOM 649 HG1 THR A 44 235.583 92.654 -18.451 1.00 0.75 H
ATOM 650 HG21 THR A 44 233.283 92.200 -19.356 1.00 1.40 H
ATOM 651 HG22 THR A 44 232.641 91.118 -18.120 1.00 1.34 H
ATOM 652 HG23 THR A 44 233.040 90.492 -19.719 1.00 1.41 H
ATOM 653 N LYS A 45 232.902 88.424 -18.492 1.00 0.66 N
ATOM 654 CA LYS A 45 232.309 87.258 -19.206 1.00 0.69 C
ATOM 655 C LYS A 45 233.092 86.996 -20.495 1.00 0.65 C
ATOM 656 O LYS A 45 233.601 85.913 -20.715 1.00 0.62 O
ATOM 657 CB LYS A 45 230.849 87.560 -19.552 1.00 0.81 C
ATOM 658 CG LYS A 45 230.102 87.962 -18.276 1.00 1.45 C
ATOM 659 CD LYS A 45 228.645 88.281 -18.612 1.00 1.58 C
ATOM 660 CE LYS A 45 227.956 88.860 -17.375 1.00 2.07 C
ATOM 661 NZ LYS A 45 228.080 87.902 -16.240 1.00 2.83 N
ATOM 662 H LYS A 45 232.327 89.156 -18.187 1.00 0.70 H
ATOM 663 HA LYS A 45 232.355 86.385 -18.572 1.00 0.69 H
ATOM 664 HB2 LYS A 45 230.807 88.370 -20.266 1.00 1.33 H
ATOM 665 HB3 LYS A 45 230.388 86.680 -19.974 1.00 1.27 H
ATOM 666 HG2 LYS A 45 230.138 87.148 -17.565 1.00 2.08 H
ATOM 667 HG3 LYS A 45 230.570 88.835 -17.846 1.00 2.11 H
ATOM 668 HD2 LYS A 45 228.609 88.999 -19.417 1.00 1.96 H
ATOM 669 HD3 LYS A 45 228.138 87.377 -18.913 1.00 2.02 H
ATOM 670 HE2 LYS A 45 228.422 89.799 -17.107 1.00 2.49 H
ATOM 671 HE3 LYS A 45 226.912 89.030 -17.591 1.00 2.41 H
ATOM 672 HZ1 LYS A 45 227.563 87.029 -16.461 1.00 3.24 H
ATOM 673 HZ2 LYS A 45 227.680 88.333 -15.380 1.00 3.13 H
ATOM 674 HZ3 LYS A 45 229.083 87.679 -16.081 1.00 3.29 H
ATOM 675 N GLU A 46 233.194 87.977 -21.348 1.00 0.67 N
ATOM 676 CA GLU A 46 233.942 87.783 -22.622 1.00 0.68 C
ATOM 677 C GLU A 46 235.317 87.181 -22.322 1.00 0.63 C
ATOM 678 O GLU A 46 235.844 86.404 -23.091 1.00 0.63 O
ATOM 679 CB GLU A 46 234.119 89.133 -23.321 1.00 0.75 C
ATOM 680 CG GLU A 46 234.800 88.927 -24.675 1.00 1.43 C
ATOM 681 CD GLU A 46 234.918 90.273 -25.394 1.00 1.87 C
ATOM 682 OE1 GLU A 46 234.706 91.286 -24.747 1.00 2.71 O
ATOM 683 OE2 GLU A 46 235.217 90.268 -26.578 1.00 2.06 O
ATOM 684 H GLU A 46 232.778 88.842 -21.152 1.00 0.71 H
ATOM 685 HA GLU A 46 233.389 87.115 -23.266 1.00 0.70 H
ATOM 686 HB2 GLU A 46 233.151 89.592 -23.470 1.00 1.16 H
ATOM 687 HB3 GLU A 46 234.733 89.776 -22.708 1.00 1.24 H
ATOM 688 HG2 GLU A 46 235.787 88.512 -24.522 1.00 2.03 H
ATOM 689 HG3 GLU A 46 234.215 88.249 -25.273 1.00 2.03 H
ATOM 690 N GLY A 47 235.899 87.532 -21.208 1.00 0.61 N
ATOM 691 CA GLY A 47 237.238 86.978 -20.862 1.00 0.61 C
ATOM 692 C GLY A 47 237.108 85.484 -20.561 1.00 0.58 C
ATOM 693 O GLY A 47 237.957 84.690 -20.924 1.00 0.59 O
ATOM 694 H GLY A 47 235.456 88.160 -20.600 1.00 0.62 H
ATOM 695 HA2 GLY A 47 237.913 87.124 -21.693 1.00 0.65 H
ATOM 696 HA3 GLY A 47 237.622 87.485 -19.989 1.00 0.64 H
ATOM 697 N VAL A 48 236.052 85.092 -19.904 1.00 0.58 N
ATOM 698 CA VAL A 48 235.867 83.650 -19.580 1.00 0.59 C
ATOM 699 C VAL A 48 235.676 82.859 -20.876 1.00 0.56 C
ATOM 700 O VAL A 48 236.275 81.821 -21.076 1.00 0.56 O
ATOM 701 CB VAL A 48 234.634 83.484 -18.690 1.00 0.68 C
ATOM 702 CG1 VAL A 48 234.320 81.995 -18.512 1.00 1.27 C
ATOM 703 CG2 VAL A 48 234.907 84.111 -17.321 1.00 1.24 C
ATOM 704 H VAL A 48 235.380 85.747 -19.622 1.00 0.60 H
ATOM 705 HA VAL A 48 236.739 83.284 -19.060 1.00 0.61 H
ATOM 706 HB VAL A 48 233.791 83.978 -19.151 1.00 1.18 H
ATOM 707 HG11 VAL A 48 235.231 81.457 -18.292 1.00 1.71 H
ATOM 708 HG12 VAL A 48 233.885 81.608 -19.421 1.00 1.91 H
ATOM 709 HG13 VAL A 48 233.622 81.867 -17.696 1.00 1.81 H
ATOM 710 HG21 VAL A 48 234.000 84.115 -16.735 1.00 1.84 H
ATOM 711 HG22 VAL A 48 235.253 85.127 -17.454 1.00 1.74 H
ATOM 712 HG23 VAL A 48 235.665 83.533 -16.808 1.00 1.77 H
ATOM 713 N VAL A 49 234.847 83.342 -21.760 1.00 0.58 N
ATOM 714 CA VAL A 49 234.620 82.618 -23.042 1.00 0.59 C
ATOM 715 C VAL A 49 235.959 82.411 -23.753 1.00 0.56 C
ATOM 716 O VAL A 49 236.209 81.376 -24.340 1.00 0.56 O
ATOM 717 CB VAL A 49 233.690 83.440 -23.936 1.00 0.65 C
ATOM 718 CG1 VAL A 49 233.581 82.784 -25.315 1.00 0.91 C
ATOM 719 CG2 VAL A 49 232.298 83.510 -23.297 1.00 0.84 C
ATOM 720 H VAL A 49 234.375 84.182 -21.581 1.00 0.60 H
ATOM 721 HA VAL A 49 234.169 81.658 -22.839 1.00 0.60 H
ATOM 722 HB VAL A 49 234.088 84.436 -24.043 1.00 0.86 H
ATOM 723 HG11 VAL A 49 232.760 83.227 -25.861 1.00 1.35 H
ATOM 724 HG12 VAL A 49 233.403 81.725 -25.195 1.00 1.45 H
ATOM 725 HG13 VAL A 49 234.501 82.937 -25.860 1.00 1.44 H
ATOM 726 HG21 VAL A 49 231.684 84.205 -23.848 1.00 1.44 H
ATOM 727 HG22 VAL A 49 232.387 83.843 -22.273 1.00 1.32 H
ATOM 728 HG23 VAL A 49 231.845 82.531 -23.321 1.00 1.37 H
ATOM 729 N HIS A 50 236.822 83.389 -23.709 1.00 0.56 N
ATOM 730 CA HIS A 50 238.143 83.250 -24.383 1.00 0.57 C
ATOM 731 C HIS A 50 238.999 82.237 -23.621 1.00 0.55 C
ATOM 732 O HIS A 50 239.860 81.588 -24.181 1.00 0.57 O
ATOM 733 CB HIS A 50 238.853 84.606 -24.401 1.00 0.60 C
ATOM 734 CG HIS A 50 240.184 84.467 -25.087 1.00 0.64 C
ATOM 735 ND1 HIS A 50 240.325 83.834 -26.314 1.00 1.33 N
ATOM 736 CD2 HIS A 50 241.440 84.882 -24.733 1.00 1.21 C
ATOM 737 CE1 HIS A 50 241.628 83.887 -26.653 1.00 1.11 C
ATOM 738 NE2 HIS A 50 242.349 84.516 -25.723 1.00 0.87 N
ATOM 739 H HIS A 50 236.600 84.217 -23.232 1.00 0.57 H
ATOM 740 HA HIS A 50 237.997 82.906 -25.396 1.00 0.60 H
ATOM 741 HB2 HIS A 50 238.244 85.323 -24.930 1.00 0.64 H
ATOM 742 HB3 HIS A 50 239.005 84.946 -23.387 1.00 0.59 H
ATOM 743 HD1 HIS A 50 239.606 83.419 -26.840 1.00 2.14 H
ATOM 744 HD2 HIS A 50 241.685 85.408 -23.822 1.00 2.14 H
ATOM 745 HE1 HIS A 50 242.039 83.467 -27.563 1.00 1.73 H
ATOM 746 HE2 HIS A 50 243.315 84.691 -25.736 1.00 1.21 H
ATOM 747 N GLY A 51 238.768 82.091 -22.345 1.00 0.53 N
ATOM 748 CA GLY A 51 239.568 81.118 -21.549 1.00 0.55 C
ATOM 749 C GLY A 51 239.228 79.694 -21.992 1.00 0.54 C
ATOM 750 O GLY A 51 240.076 78.960 -22.458 1.00 0.57 O
ATOM 751 H GLY A 51 238.067 82.620 -21.910 1.00 0.53 H
ATOM 752 HA2 GLY A 51 240.622 81.305 -21.708 1.00 0.57 H
ATOM 753 HA3 GLY A 51 239.339 81.231 -20.503 1.00 0.56 H
ATOM 754 N VAL A 52 237.992 79.301 -21.853 1.00 0.53 N
ATOM 755 CA VAL A 52 237.598 77.925 -22.267 1.00 0.55 C
ATOM 756 C VAL A 52 237.970 77.712 -23.736 1.00 0.56 C
ATOM 757 O VAL A 52 238.262 76.613 -24.158 1.00 0.58 O
ATOM 758 CB VAL A 52 236.088 77.753 -22.093 1.00 0.56 C
ATOM 759 CG1 VAL A 52 235.725 77.906 -20.615 1.00 0.58 C
ATOM 760 CG2 VAL A 52 235.354 78.819 -22.912 1.00 0.56 C
ATOM 761 H VAL A 52 237.323 79.910 -21.477 1.00 0.53 H
ATOM 762 HA VAL A 52 238.116 77.202 -21.655 1.00 0.56 H
ATOM 763 HB VAL A 52 235.796 76.772 -22.435 1.00 0.58 H
ATOM 764 HG11 VAL A 52 236.078 77.044 -20.066 1.00 1.24 H
ATOM 765 HG12 VAL A 52 234.650 77.983 -20.513 1.00 1.17 H
ATOM 766 HG13 VAL A 52 236.191 78.798 -20.222 1.00 1.02 H
ATOM 767 HG21 VAL A 52 235.708 79.799 -22.627 1.00 1.16 H
ATOM 768 HG22 VAL A 52 234.292 78.748 -22.725 1.00 1.16 H
ATOM 769 HG23 VAL A 52 235.546 78.658 -23.961 1.00 1.10 H
ATOM 770 N ALA A 53 237.959 78.756 -24.519 1.00 0.56 N
ATOM 771 CA ALA A 53 238.312 78.612 -25.959 1.00 0.60 C
ATOM 772 C ALA A 53 239.798 78.271 -26.088 1.00 0.62 C
ATOM 773 O ALA A 53 240.201 77.524 -26.957 1.00 0.65 O
ATOM 774 CB ALA A 53 238.027 79.927 -26.688 1.00 0.62 C
ATOM 775 H ALA A 53 237.718 79.636 -24.159 1.00 0.55 H
ATOM 776 HA ALA A 53 237.722 77.822 -26.398 1.00 0.62 H
ATOM 777 HB1 ALA A 53 238.768 80.662 -26.408 1.00 1.08 H
ATOM 778 HB2 ALA A 53 237.043 80.285 -26.419 1.00 1.10 H
ATOM 779 HB3 ALA A 53 238.069 79.764 -27.755 1.00 1.16 H
ATOM 780 N THR A 54 240.617 78.812 -25.227 1.00 0.61 N
ATOM 781 CA THR A 54 242.076 78.519 -25.300 1.00 0.65 C
ATOM 782 C THR A 54 242.342 77.115 -24.752 1.00 0.64 C
ATOM 783 O THR A 54 243.127 76.366 -25.293 1.00 0.66 O
ATOM 784 CB THR A 54 242.845 79.547 -24.467 1.00 0.67 C
ATOM 785 OG1 THR A 54 242.436 80.856 -24.836 1.00 1.12 O
ATOM 786 CG2 THR A 54 244.348 79.390 -24.714 1.00 1.19 C
ATOM 787 H THR A 54 240.272 79.412 -24.533 1.00 0.59 H
ATOM 788 HA THR A 54 242.403 78.572 -26.328 1.00 0.68 H
ATOM 789 HB THR A 54 242.641 79.388 -23.423 1.00 1.01 H
ATOM 790 HG1 THR A 54 242.375 81.382 -24.037 1.00 1.51 H
ATOM 791 HG21 THR A 54 244.579 79.707 -25.718 1.00 1.50 H
ATOM 792 HG22 THR A 54 244.628 78.356 -24.590 1.00 1.87 H
ATOM 793 HG23 THR A 54 244.894 80.000 -24.010 1.00 1.71 H
ATOM 794 N VAL A 55 241.692 76.754 -23.680 1.00 0.61 N
ATOM 795 CA VAL A 55 241.908 75.398 -23.098 1.00 0.61 C
ATOM 796 C VAL A 55 241.458 74.334 -24.101 1.00 0.59 C
ATOM 797 O VAL A 55 241.880 73.195 -24.045 1.00 0.59 O
ATOM 798 CB VAL A 55 241.095 75.261 -21.810 1.00 0.61 C
ATOM 799 CG1 VAL A 55 241.195 73.826 -21.285 1.00 0.63 C
ATOM 800 CG2 VAL A 55 241.644 76.227 -20.757 1.00 0.63 C
ATOM 801 H VAL A 55 241.062 77.373 -23.257 1.00 0.60 H
ATOM 802 HA VAL A 55 242.957 75.265 -22.877 1.00 0.63 H
ATOM 803 HB VAL A 55 240.056 75.497 -22.012 1.00 0.60 H
ATOM 804 HG11 VAL A 55 242.224 73.503 -21.325 1.00 1.10 H
ATOM 805 HG12 VAL A 55 240.593 73.176 -21.899 1.00 1.07 H
ATOM 806 HG13 VAL A 55 240.846 73.789 -20.266 1.00 1.22 H
ATOM 807 HG21 VAL A 55 242.697 76.035 -20.608 1.00 1.08 H
ATOM 808 HG22 VAL A 55 241.117 76.080 -19.826 1.00 1.26 H
ATOM 809 HG23 VAL A 55 241.508 77.242 -21.095 1.00 1.26 H
ATOM 810 N ALA A 56 240.600 74.692 -25.017 1.00 0.59 N
ATOM 811 CA ALA A 56 240.124 73.700 -26.021 1.00 0.59 C
ATOM 812 C ALA A 56 241.249 73.394 -27.010 1.00 0.59 C
ATOM 813 O ALA A 56 241.280 72.348 -27.629 1.00 0.60 O
ATOM 814 CB ALA A 56 238.923 74.274 -26.776 1.00 0.62 C
ATOM 815 H ALA A 56 240.270 75.615 -25.044 1.00 0.60 H
ATOM 816 HA ALA A 56 239.831 72.791 -25.517 1.00 0.59 H
ATOM 817 HB1 ALA A 56 238.228 74.704 -26.070 1.00 1.13 H
ATOM 818 HB2 ALA A 56 238.436 73.486 -27.327 1.00 1.14 H
ATOM 819 HB3 ALA A 56 239.260 75.037 -27.460 1.00 1.16 H
ATOM 820 N GLU A 57 242.177 74.299 -27.166 1.00 0.60 N
ATOM 821 CA GLU A 57 243.300 74.058 -28.116 1.00 0.63 C
ATOM 822 C GLU A 57 244.308 73.101 -27.478 1.00 0.63 C
ATOM 823 O GLU A 57 244.834 72.218 -28.123 1.00 0.65 O
ATOM 824 CB GLU A 57 243.988 75.386 -28.437 1.00 0.66 C
ATOM 825 CG GLU A 57 243.039 76.274 -29.243 1.00 1.29 C
ATOM 826 CD GLU A 57 243.701 77.629 -29.498 1.00 1.92 C
ATOM 827 OE1 GLU A 57 244.839 77.797 -29.086 1.00 2.44 O
ATOM 828 OE2 GLU A 57 243.061 78.474 -30.099 1.00 2.61 O
ATOM 829 H GLU A 57 242.135 75.136 -26.659 1.00 0.60 H
ATOM 830 HA GLU A 57 242.915 73.622 -29.026 1.00 0.65 H
ATOM 831 HB2 GLU A 57 244.252 75.885 -27.517 1.00 0.93 H
ATOM 832 HB3 GLU A 57 244.880 75.199 -29.018 1.00 1.18 H
ATOM 833 HG2 GLU A 57 242.815 75.799 -30.188 1.00 1.92 H
ATOM 834 HG3 GLU A 57 242.126 76.422 -28.689 1.00 1.87 H
ATOM 835 N LYS A 58 244.578 73.266 -26.212 1.00 0.62 N
ATOM 836 CA LYS A 58 245.550 72.364 -25.533 1.00 0.64 C
ATOM 837 C LYS A 58 244.936 70.969 -25.396 1.00 0.61 C
ATOM 838 O LYS A 58 245.603 69.966 -25.566 1.00 0.62 O
ATOM 839 CB LYS A 58 245.876 72.918 -24.144 1.00 0.68 C
ATOM 840 CG LYS A 58 246.660 74.223 -24.285 1.00 1.43 C
ATOM 841 CD LYS A 58 246.938 74.801 -22.896 1.00 1.92 C
ATOM 842 CE LYS A 58 247.728 76.101 -23.031 1.00 2.77 C
ATOM 843 NZ LYS A 58 247.970 76.679 -21.678 1.00 3.39 N
ATOM 844 H LYS A 58 244.140 73.983 -25.708 1.00 0.61 H
ATOM 845 HA LYS A 58 246.456 72.303 -26.119 1.00 0.68 H
ATOM 846 HB2 LYS A 58 244.957 73.104 -23.605 1.00 1.09 H
ATOM 847 HB3 LYS A 58 246.471 72.200 -23.602 1.00 1.14 H
ATOM 848 HG2 LYS A 58 247.596 74.026 -24.790 1.00 2.15 H
ATOM 849 HG3 LYS A 58 246.082 74.931 -24.860 1.00 1.92 H
ATOM 850 HD2 LYS A 58 245.999 74.998 -22.394 1.00 2.14 H
ATOM 851 HD3 LYS A 58 247.513 74.090 -22.321 1.00 2.40 H
ATOM 852 HE2 LYS A 58 248.675 75.900 -23.512 1.00 3.26 H
ATOM 853 HE3 LYS A 58 247.162 76.804 -23.625 1.00 3.05 H
ATOM 854 HZ1 LYS A 58 248.169 75.915 -21.003 1.00 3.55 H
ATOM 855 HZ2 LYS A 58 247.126 77.201 -21.371 1.00 3.83 H
ATOM 856 HZ3 LYS A 58 248.784 77.325 -21.717 1.00 3.79 H
ATOM 857 N THR A 59 243.669 70.897 -25.090 1.00 0.59 N