1307 lines
98 KiB
Plaintext
1307 lines
98 KiB
Plaintext
HEADER ---- XX-XXX-XX xxxx
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COMPND ---
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REMARK 3
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REMARK 3 REFINEMENT.
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REMARK 3 PROGRAM : REFMAC
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REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON
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REMARK 3
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REMARK 3 Maximum likelihood refinement was used
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REMARK 3
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REMARK 3 DATA USED IN REFINEMENT.
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REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.1
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REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) :10.00
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REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.0
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REMARK 3 COMPLETENESS FOR RANGE (%) : 98.9
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REMARK 3 NUMBER OF REFLECTIONS : 10194
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REMARK 3
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REMARK 3 FIT TO DATA USED IN REFINEMENT.
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REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT
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REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM
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REMARK 3 R VALUE (WORKING + TEST SET) : 0.24527
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REMARK 3 R VALUE (WORKING SET) : 0.24238
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REMARK 3 FREE R VALUE : 0.30068
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REMARK 3 FREE R VALUE TEST SET SIZE (%) :5.0
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REMARK 3 FREE R VALUE TEST SET COUNT : 535
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REMARK 3
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REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.
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REMARK 3 All atoms : 1194
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REMARK 3
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REMARK 3 B VALUES.
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REMARK 3 FROM WILSON PLOT (A**2) : NULL
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REMARK 3 MEAN B VALUE (OVERALL, A**2) : 36.883
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REMARK 3 OVERALL ANISOTROPIC B VALUE.
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REMARK 3 B11 (A**2) : 0.11
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REMARK 3 B22 (A**2) : 0.11
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REMARK 3 B33 (A**2) : -0.22
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REMARK 3 B12 (A**2) : 0.00
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REMARK 3 B13 (A**2) : 0.00
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REMARK 3 B23 (A**2) : 0.00
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REMARK 3
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REMARK 3 ESTIMATED OVERALL COORDINATE ERROR.
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REMARK 3 ESU BASED ON R VALUE (A):
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REMARK 3 0.24976
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REMARK 3 ESU BASED ON FREE R VALUE (A):
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REMARK 3 0.22588
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REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A):
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REMARK 3 0.12698
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REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2):
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REMARK 3 5.28769
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REMARK 3
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REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES.
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REMARK 3 DISTANCE RESTRAINTS. RMS SIGMA
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REMARK 3 BOND LENGTH (A) : 0.012 ; 0.021
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REMARK 3 BOND ANGLE (DEGREES) : 1.770 ; 1.998
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REMARK 3 Torsion angles, period 1 (DEGREES) : 3.905 ; 3.000
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REMARK 3 Torsion angles, period 3 (DEGREES) :15.661 ;15.000
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REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3) : 0.136 ; 0.200
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REMARK 3 PLANE RESTRAINT (A) : 0.005 ; 0.020
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REMARK 3 VDW repulsions (A) : 0.274 ; 0.300
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REMARK 3 Potential hbonds (A) : 0.233 ; 0.500
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REMARK 3
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REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA
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REMARK 3 MAIN-CHAIN BOND (A**2) : 4.928 ; 2.500
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REMARK 3 MAIN-CHAIN ANGLE (A**2) : 7.821 ; 5.000
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REMARK 3 SIDE-CHAIN BOND (A**2) : 5.409 ; 2.500
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REMARK 3 SIDE-CHAIN ANGLE (A**2) : 7.923 ; 5.000
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REMARK 3
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REMARK 3 OTHER REFINEMENT REMARKS: NULL
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REMARK 3
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REMARK 3
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REMARK 3 Scaling details
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REMARK 3 Bulk solvent correction based on constant value has been used
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REMARK 3 Parameters for mask calculation
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REMARK 3 VDW prob radii = 1.40
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REMARK 3 ION prob radii = 0.80
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REMARK 3 Shrinkage radii = 0.80
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REMARK 3
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SSBOND 1 CYS A 3 CYS A 127
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SSBOND 2 CYS A 24 CYS A 65
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SSBOND 3 CYS A 46 CYS A 99
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MODRES SUL X 1 SO4 RENAME
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MODRES SUL X 2 SO4 RENAME
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MODRES SUL X 3 SO4 RENAME
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MODRES SUL X 4 SO4 RENAME
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MODRES SUL X 5 SO4 RENAME
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CRYST1 91.144 91.144 45.856 90.00 90.00 90.00 P 41 21 2
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SCALE1 0.010972 0.000000 0.000000 0.00000
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SCALE2 0.000000 0.010972 0.000000 0.00000
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SCALE3 0.000000 0.000000 0.021808 0.00000
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ATOM 1 N MET A 0 29.369 38.811 18.829 1.00 69.49 N
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ATOM 2 CA MET A 0 29.501 37.614 19.716 1.00 69.96 C
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ATOM 3 CB MET A 0 28.148 36.925 19.854 1.00 70.29 C
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ATOM 4 CG MET A 0 27.369 36.878 18.548 1.00 67.70 C
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ATOM 5 SD MET A 0 25.797 36.054 18.746 1.00 63.18 S
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ATOM 6 CE MET A 0 26.344 34.621 19.644 1.00 55.84 C
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ATOM 7 C MET A 0 30.562 36.613 19.229 1.00 65.06 C
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ATOM 8 O MET A 0 31.129 36.757 18.143 1.00 62.65 O
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ATOM 9 N HIS A 1 30.815 35.593 20.040 1.00 58.35 N
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ATOM 10 CA HIS A 1 31.827 34.607 19.712 1.00 53.25 C
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ATOM 11 CB HIS A 1 32.477 34.063 20.985 1.00 59.42 C
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ATOM 12 CG HIS A 1 33.147 35.112 21.825 1.00 64.67 C
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ATOM 13 ND1 HIS A 1 34.328 35.721 21.460 1.00 68.59 N
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ATOM 14 CE1 HIS A 1 34.680 36.593 22.389 1.00 69.66 C
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ATOM 15 NE2 HIS A 1 33.770 36.571 23.347 1.00 66.70 N
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ATOM 16 CD2 HIS A 1 32.801 35.655 23.019 1.00 65.89 C
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ATOM 17 C HIS A 1 31.276 33.484 18.832 1.00 46.00 C
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ATOM 18 O HIS A 1 30.118 33.125 18.921 1.00 34.54 O
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ATOM 19 N LYS A 2 32.145 32.931 17.999 1.00 46.99 N
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ATOM 20 CA LYS A 2 31.802 31.934 16.992 1.00 50.66 C
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ATOM 21 CB LYS A 2 33.081 31.544 16.229 1.00 57.70 C
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ATOM 22 CG LYS A 2 33.794 32.724 15.584 1.00 68.52 C
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ATOM 23 CD LYS A 2 34.996 32.282 14.768 1.00 77.70 C
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ATOM 24 CE LYS A 2 35.687 33.480 14.129 1.00 82.14 C
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ATOM 25 NZ LYS A 2 36.844 33.068 13.284 1.00 83.70 N
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ATOM 26 C LYS A 2 31.091 30.673 17.484 1.00 44.79 C
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ATOM 27 O LYS A 2 30.202 30.143 16.803 1.00 41.43 O
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ATOM 28 N CYS A 3 31.479 30.198 18.663 1.00 35.87 N
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ATOM 29 CA CYS A 3 30.971 28.928 19.176 1.00 28.80 C
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ATOM 30 CB CYS A 3 32.173 28.061 19.574 1.00 22.00 C
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ATOM 31 SG CYS A 3 33.033 27.521 18.108 1.00 25.19 S
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ATOM 32 C CYS A 3 29.970 29.045 20.334 1.00 21.37 C
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ATOM 33 O CYS A 3 29.862 28.154 21.172 1.00 24.44 O
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ATOM 34 N ASP A 4 29.238 30.149 20.343 1.00 12.97 N
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ATOM 35 CA ASP A 4 28.255 30.508 21.366 1.00 18.56 C
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ATOM 36 CB ASP A 4 27.760 31.914 21.045 1.00 26.42 C
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ATOM 37 CG ASP A 4 26.688 32.390 21.979 1.00 30.02 C
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ATOM 38 OD1 ASP A 4 27.037 32.996 22.995 1.00 27.90 O
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ATOM 39 OD2 ASP A 4 25.466 32.219 21.778 1.00 38.60 O
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ATOM 40 C ASP A 4 27.082 29.544 21.316 1.00 21.46 C
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ATOM 41 O ASP A 4 26.825 28.966 20.276 1.00 18.95 O
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ATOM 42 N ILE A 5 26.354 29.391 22.417 1.00 15.24 N
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ATOM 43 CA ILE A 5 25.237 28.480 22.431 1.00 18.45 C
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ATOM 44 CB ILE A 5 24.778 28.086 23.846 1.00 23.02 C
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ATOM 45 CG1 ILE A 5 24.486 29.303 24.707 1.00 26.03 C
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ATOM 46 CD1 ILE A 5 23.561 28.979 25.800 1.00 33.04 C
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ATOM 47 CG2 ILE A 5 25.711 27.039 24.488 1.00 26.55 C
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ATOM 48 C ILE A 5 24.041 28.963 21.631 1.00 17.96 C
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ATOM 49 O ILE A 5 23.061 28.240 21.503 1.00 17.58 O
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ATOM 50 N THR A 6 24.107 30.180 21.119 1.00 14.21 N
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ATOM 51 CA THR A 6 23.082 30.622 20.192 1.00 20.96 C
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ATOM 52 CB THR A 6 23.468 31.933 19.519 1.00 18.68 C
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ATOM 53 OG1 THR A 6 23.461 32.976 20.486 1.00 24.97 O
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ATOM 54 CG2 THR A 6 22.365 32.362 18.502 1.00 11.64 C
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ATOM 55 C THR A 6 22.979 29.547 19.130 1.00 22.10 C
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ATOM 56 O THR A 6 21.891 29.334 18.555 1.00 20.41 O
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ATOM 57 N LEU A 7 24.112 28.871 18.875 1.00 17.89 N
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ATOM 58 CA LEU A 7 24.147 27.755 17.929 1.00 16.15 C
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ATOM 59 CB LEU A 7 25.584 27.213 17.724 1.00 19.76 C
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ATOM 60 CG LEU A 7 26.767 28.055 17.159 1.00 20.55 C
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ATOM 61 CD1 LEU A 7 28.057 27.252 16.857 1.00 21.07 C
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ATOM 62 CD2 LEU A 7 26.334 28.835 15.925 1.00 25.08 C
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ATOM 63 C LEU A 7 23.199 26.620 18.348 1.00 18.32 C
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ATOM 64 O LEU A 7 22.527 26.007 17.525 1.00 9.05 O
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ATOM 65 N GLN A 8 23.136 26.318 19.636 1.00 19.77 N
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ATOM 66 CA GLN A 8 22.231 25.261 20.068 1.00 14.43 C
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ATOM 67 CB GLN A 8 22.605 24.740 21.461 1.00 9.79 C
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ATOM 68 CG GLN A 8 21.622 23.814 22.156 1.00 10.45 C
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ATOM 69 CD GLN A 8 21.292 22.556 21.404 1.00 15.35 C
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ATOM 70 OE1 GLN A 8 20.258 21.944 21.655 1.00 19.23 O
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ATOM 71 NE2 GLN A 8 22.163 22.148 20.493 1.00 14.29 N
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ATOM 72 C GLN A 8 20.804 25.758 19.990 1.00 16.32 C
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ATOM 73 O GLN A 8 19.908 24.990 19.619 1.00 12.71 O
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ATOM 74 N GLU A 9 20.593 27.042 20.294 1.00 17.23 N
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ATOM 75 CA GLU A 9 19.228 27.590 20.221 1.00 16.47 C
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ATOM 76 CB GLU A 9 19.165 29.051 20.649 1.00 18.12 C
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ATOM 77 CG GLU A 9 19.193 29.234 22.154 1.00 25.64 C
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ATOM 78 CD GLU A 9 18.039 28.545 22.858 1.00 23.41 C
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ATOM 79 OE1 GLU A 9 16.919 29.068 22.770 1.00 29.08 O
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ATOM 80 OE2 GLU A 9 18.250 27.512 23.529 1.00 26.48 O
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ATOM 81 C GLU A 9 18.681 27.438 18.816 1.00 15.55 C
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ATOM 82 O GLU A 9 17.552 26.963 18.623 1.00 17.37 O
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ATOM 83 N ILE A 10 19.508 27.810 17.843 1.00 15.26 N
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ATOM 84 CA ILE A 10 19.170 27.701 16.424 1.00 15.90 C
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ATOM 85 CB ILE A 10 20.293 28.308 15.544 1.00 19.99 C
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ATOM 86 CG1 ILE A 10 20.253 29.838 15.646 1.00 22.69 C
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ATOM 87 CD1 ILE A 10 21.394 30.567 14.980 1.00 15.29 C
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ATOM 88 CG2 ILE A 10 20.143 27.832 14.094 1.00 13.99 C
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ATOM 89 C ILE A 10 18.884 26.259 16.003 1.00 9.42 C
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ATOM 90 O ILE A 10 17.892 25.976 15.313 1.00 15.76 O
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ATOM 91 N ILE A 11 19.742 25.345 16.438 1.00 19.82 N
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ATOM 92 CA ILE A 11 19.572 23.945 16.086 1.00 22.72 C
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ATOM 93 CB ILE A 11 20.797 23.154 16.471 1.00 22.48 C
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ATOM 94 CG1 ILE A 11 21.841 23.408 15.422 1.00 21.47 C
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ATOM 95 CD1 ILE A 11 23.153 22.901 15.834 1.00 16.01 C
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ATOM 96 CG2 ILE A 11 20.504 21.669 16.483 1.00 22.18 C
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ATOM 97 C ILE A 11 18.305 23.338 16.697 1.00 16.64 C
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ATOM 98 O ILE A 11 17.611 22.566 16.051 1.00 15.10 O
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ATOM 99 N LYS A 12 18.069 23.666 17.959 1.00 23.55 N
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ATOM 100 CA LYS A 12 16.909 23.171 18.680 1.00 26.18 C
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ATOM 101 CB LYS A 12 17.018 23.615 20.141 1.00 23.73 C
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ATOM 102 CG LYS A 12 15.758 23.454 20.930 1.00 32.53 C
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ATOM 103 CD LYS A 12 15.988 23.787 22.397 1.00 39.18 C
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ATOM 104 CE LYS A 12 14.672 23.901 23.158 1.00 46.90 C
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ATOM 105 NZ LYS A 12 14.782 24.912 24.249 1.00 52.74 N
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ATOM 106 C LYS A 12 15.610 23.683 18.012 1.00 18.94 C
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ATOM 107 O LYS A 12 14.628 22.940 17.798 1.00 17.81 O
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ATOM 108 N THR A 13 15.629 24.959 17.672 1.00 12.86 N
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ATOM 109 CA THR A 13 14.489 25.587 16.993 1.00 21.31 C
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ATOM 110 CB THR A 13 14.703 27.134 16.935 1.00 22.40 C
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ATOM 111 OG1 THR A 13 14.811 27.679 18.269 1.00 22.34 O
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ATOM 112 CG2 THR A 13 13.492 27.833 16.350 1.00 27.49 C
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ATOM 113 C THR A 13 14.286 24.977 15.585 1.00 22.92 C
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ATOM 114 O THR A 13 13.144 24.670 15.159 1.00 11.93 O
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ATOM 115 N LEU A 14 15.391 24.766 14.873 1.00 21.41 N
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ATOM 116 CA LEU A 14 15.319 24.197 13.534 1.00 19.50 C
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ATOM 117 CB LEU A 14 16.665 24.272 12.809 1.00 19.56 C
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ATOM 118 CG LEU A 14 17.017 25.526 11.995 1.00 16.47 C
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ATOM 119 CD1 LEU A 14 18.510 25.312 11.662 1.00 11.55 C
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ATOM 120 CD2 LEU A 14 16.202 25.642 10.725 1.00 17.60 C
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ATOM 121 C LEU A 14 14.837 22.756 13.642 1.00 21.69 C
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ATOM 122 O LEU A 14 14.104 22.270 12.780 1.00 16.86 O
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ATOM 123 N ASN A 15 15.267 22.067 14.695 1.00 25.55 N
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ATOM 124 CA ASN A 15 14.793 20.709 14.921 1.00 24.44 C
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ATOM 125 CB ASN A 15 15.424 20.086 16.155 1.00 24.07 C
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ATOM 126 CG ASN A 15 16.716 19.358 15.850 1.00 27.41 C
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ATOM 127 OD1 ASN A 15 16.939 18.854 14.746 1.00 27.78 O
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ATOM 128 ND2 ASN A 15 17.582 19.299 16.840 1.00 24.78 N
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ATOM 129 C ASN A 15 13.296 20.728 15.107 1.00 29.32 C
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ATOM 130 O ASN A 15 12.638 19.808 14.688 1.00 24.47 O
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ATOM 131 N CYS A 16 12.761 21.759 15.753 1.00 34.38 N
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ATOM 132 CA CYS A 16 11.335 21.846 15.907 1.00 36.70 C
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ATOM 133 CB CYS A 16 10.909 22.983 16.828 1.00 47.40 C
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ATOM 134 SG CYS A 16 10.993 22.580 18.577 1.00 59.77 S
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ATOM 135 C CYS A 16 10.701 22.078 14.568 1.00 35.59 C
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ATOM 136 O CYS A 16 9.746 21.404 14.229 1.00 36.59 O
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ATOM 137 N LEU A 17 11.208 23.045 13.812 1.00 34.61 N
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ATOM 138 CA LEU A 17 10.580 23.351 12.531 1.00 30.20 C
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ATOM 139 CB LEU A 17 11.236 24.568 11.858 1.00 27.55 C
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ATOM 140 CG LEU A 17 11.335 25.844 12.691 1.00 25.59 C
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ATOM 141 CD1 LEU A 17 12.579 26.641 12.335 1.00 27.28 C
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ATOM 142 CD2 LEU A 17 10.099 26.655 12.475 1.00 31.40 C
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ATOM 143 C LEU A 17 10.501 22.131 11.591 1.00 29.47 C
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ATOM 144 O LEU A 17 9.438 21.809 11.075 1.00 34.94 O
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ATOM 145 N THR A 18 11.598 21.441 11.364 1.00 32.18 N
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ATOM 146 CA THR A 18 11.531 20.293 10.456 1.00 36.06 C
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ATOM 147 CB THR A 18 12.915 19.792 10.084 1.00 27.44 C
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ATOM 148 OG1 THR A 18 13.602 19.385 11.265 1.00 28.61 O
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ATOM 149 CG2 THR A 18 13.756 20.899 9.531 1.00 32.58 C
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ATOM 150 C THR A 18 10.717 19.090 10.943 1.00 40.00 C
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ATOM 151 O THR A 18 10.347 18.251 10.137 1.00 41.06 O
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ATOM 152 N GLU A 19 10.481 18.967 12.245 1.00 46.06 N
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ATOM 153 CA GLU A 19 9.707 17.834 12.755 1.00 60.15 C
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ATOM 154 CB GLU A 19 10.013 17.574 14.221 1.00 71.06 C
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ATOM 155 CG GLU A 19 11.471 17.279 14.513 1.00 83.40 C
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ATOM 156 CD GLU A 19 11.759 17.270 15.999 1.00 89.79 C
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ATOM 157 OE1 GLU A 19 10.776 17.338 16.770 1.00 92.51 O
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ATOM 158 OE2 GLU A 19 12.951 17.200 16.390 1.00 92.22 O
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ATOM 159 C GLU A 19 8.230 18.112 12.617 1.00 66.11 C
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ATOM 160 O GLU A 19 7.384 17.234 12.787 1.00 61.07 O
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ATOM 161 N GLN A 20 7.919 19.366 12.337 1.00 80.56 N
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ATOM 162 CA GLN A 20 6.534 19.777 12.179 1.00 90.56 C
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ATOM 163 CB GLN A 20 6.076 20.679 13.326 1.00 97.35 C
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ATOM 164 CG GLN A 20 6.582 20.314 14.699 1.00104.73 C
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ATOM 165 CD GLN A 20 5.893 19.104 15.287 1.00109.84 C
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ATOM 166 OE1 GLN A 20 5.225 18.351 14.582 1.00112.37 O
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ATOM 167 NE2 GLN A 20 6.058 18.911 16.583 1.00112.03 N
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ATOM 168 C GLN A 20 6.355 20.532 10.886 1.00 92.79 C
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ATOM 169 O GLN A 20 6.754 21.689 10.757 1.00 96.86 O
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ATOM 170 N LYS A 21 5.750 19.872 9.919 1.00 90.98 N
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ATOM 171 CA LYS A 21 5.454 20.534 8.677 1.00 89.19 C
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ATOM 172 CB LYS A 21 5.767 19.597 7.517 1.00 95.25 C
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ATOM 173 CG LYS A 21 7.179 19.004 7.616 1.00101.05 C
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ATOM 174 CD LYS A 21 7.374 17.810 6.677 1.00106.25 C
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ATOM 175 CE LYS A 21 8.816 17.297 6.683 1.00107.98 C
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ATOM 176 NZ LYS A 21 9.038 16.192 5.700 1.00107.37 N
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ATOM 177 C LYS A 21 3.981 20.929 8.746 1.00 81.87 C
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ATOM 178 O LYS A 21 3.201 20.332 9.493 1.00 83.47 O
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ATOM 179 N THR A 22 3.606 21.972 8.024 1.00 70.04 N
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ATOM 180 CA THR A 22 2.220 22.410 8.019 1.00 58.56 C
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ATOM 181 CB THR A 22 2.024 23.687 8.880 1.00 53.64 C
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ATOM 182 OG1 THR A 22 2.785 24.774 8.337 1.00 43.51 O
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ATOM 183 CG2 THR A 22 2.595 23.507 10.289 1.00 49.70 C
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ATOM 184 C THR A 22 1.777 22.644 6.579 1.00 56.46 C
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ATOM 185 O THR A 22 2.426 22.178 5.648 1.00 50.63 O
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ATOM 186 N LEU A 23 0.673 23.367 6.403 1.00 60.02 N
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ATOM 187 CA LEU A 23 0.132 23.669 5.081 1.00 58.72 C
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ATOM 188 CB LEU A 23 -1.283 24.232 5.207 1.00 60.36 C
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ATOM 189 CG LEU A 23 -2.364 23.427 5.924 1.00 64.29 C
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ATOM 190 CD1 LEU A 23 -3.550 24.322 6.268 1.00 62.40 C
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ATOM 191 CD2 LEU A 23 -2.794 22.235 5.075 1.00 65.57 C
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ATOM 192 C LEU A 23 0.997 24.720 4.425 1.00 55.15 C
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ATOM 193 O LEU A 23 0.828 25.055 3.254 1.00 62.94 O
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ATOM 194 N CYS A 24 1.961 25.206 5.184 1.00 43.49 N
|
|
ATOM 195 CA CYS A 24 2.748 26.323 4.733 1.00 36.44 C
|
|
ATOM 196 CB CYS A 24 2.765 27.372 5.823 1.00 36.17 C
|
|
ATOM 197 SG CYS A 24 2.631 28.991 5.112 1.00 44.51 S
|
|
ATOM 198 C CYS A 24 4.173 26.031 4.322 1.00 28.64 C
|
|
ATOM 199 O CYS A 24 4.759 26.798 3.562 1.00 25.66 O
|
|
ATOM 200 N THR A 25 4.719 24.929 4.814 1.00 19.04 N
|
|
ATOM 201 CA THR A 25 6.123 24.613 4.603 1.00 24.43 C
|
|
ATOM 202 CB THR A 25 6.557 23.530 5.612 1.00 24.05 C
|
|
ATOM 203 OG1 THR A 25 5.693 22.385 5.513 1.00 22.10 O
|
|
ATOM 204 CG2 THR A 25 6.300 24.071 7.026 1.00 18.64 C
|
|
ATOM 205 C THR A 25 6.519 24.266 3.166 1.00 27.19 C
|
|
ATOM 206 O THR A 25 7.702 24.178 2.857 1.00 23.41 O
|
|
ATOM 207 N GLU A 26 5.538 24.113 2.281 1.00 29.97 N
|
|
ATOM 208 CA GLU A 26 5.810 23.787 0.880 1.00 29.11 C
|
|
ATOM 209 CB GLU A 26 4.727 22.914 0.264 1.00 37.80 C
|
|
ATOM 210 CG GLU A 26 4.696 21.469 0.749 1.00 50.41 C
|
|
ATOM 211 CD GLU A 26 5.944 20.680 0.382 1.00 53.97 C
|
|
ATOM 212 OE1 GLU A 26 6.164 20.409 -0.822 1.00 52.12 O
|
|
ATOM 213 OE2 GLU A 26 6.708 20.326 1.306 1.00 51.75 O
|
|
ATOM 214 C GLU A 26 5.906 25.054 0.085 1.00 31.09 C
|
|
ATOM 215 O GLU A 26 6.459 25.051 -0.996 1.00 36.51 O
|
|
ATOM 216 N LEU A 27 5.343 26.138 0.612 1.00 33.89 N
|
|
ATOM 217 CA LEU A 27 5.477 27.456 -0.012 1.00 29.73 C
|
|
ATOM 218 CB LEU A 27 4.733 28.506 0.799 1.00 28.86 C
|
|
ATOM 219 CG LEU A 27 3.251 28.119 0.896 1.00 31.22 C
|
|
ATOM 220 CD1 LEU A 27 2.454 29.248 1.517 1.00 26.32 C
|
|
ATOM 221 CD2 LEU A 27 2.731 27.790 -0.495 1.00 27.58 C
|
|
ATOM 222 C LEU A 27 6.956 27.757 -0.102 1.00 24.97 C
|
|
ATOM 223 O LEU A 27 7.737 27.206 0.672 1.00 25.98 O
|
|
ATOM 224 N THR A 28 7.360 28.616 -1.029 1.00 30.81 N
|
|
ATOM 225 CA THR A 28 8.785 28.737 -1.330 1.00 27.04 C
|
|
ATOM 226 CB THR A 28 8.962 28.756 -2.840 1.00 35.50 C
|
|
ATOM 227 OG1 THR A 28 8.453 29.982 -3.375 1.00 38.73 O
|
|
ATOM 228 CG2 THR A 28 8.052 27.742 -3.468 1.00 38.65 C
|
|
ATOM 229 C THR A 28 9.542 29.903 -0.736 1.00 28.84 C
|
|
ATOM 230 O THR A 28 8.948 30.886 -0.304 1.00 30.63 O
|
|
ATOM 231 N VAL A 29 10.867 29.774 -0.693 1.00 23.68 N
|
|
ATOM 232 CA VAL A 29 11.728 30.911 -0.355 1.00 20.65 C
|
|
ATOM 233 CB VAL A 29 12.294 30.855 1.079 1.00 24.17 C
|
|
ATOM 234 CG1 VAL A 29 11.202 30.956 2.127 1.00 29.31 C
|
|
ATOM 235 CG2 VAL A 29 13.184 29.641 1.278 1.00 11.34 C
|
|
ATOM 236 C VAL A 29 12.910 30.948 -1.314 1.00 19.29 C
|
|
ATOM 237 O VAL A 29 13.199 29.972 -1.995 1.00 20.92 O
|
|
ATOM 238 N THR A 30 13.625 32.057 -1.344 1.00 23.12 N
|
|
ATOM 239 CA THR A 30 14.803 32.151 -2.181 1.00 22.52 C
|
|
ATOM 240 CB THR A 30 15.275 33.572 -2.263 1.00 29.02 C
|
|
ATOM 241 OG1 THR A 30 14.350 34.331 -3.038 1.00 25.39 O
|
|
ATOM 242 CG2 THR A 30 16.578 33.638 -3.072 1.00 25.65 C
|
|
ATOM 243 C THR A 30 15.915 31.291 -1.618 1.00 23.73 C
|
|
ATOM 244 O THR A 30 16.317 31.454 -0.476 1.00 23.30 O
|
|
ATOM 245 N ASP A 31 16.422 30.389 -2.446 1.00 25.47 N
|
|
ATOM 246 CA ASP A 31 17.460 29.451 -2.036 1.00 23.58 C
|
|
ATOM 247 CB ASP A 31 17.485 28.291 -3.016 1.00 13.33 C
|
|
ATOM 248 CG ASP A 31 18.416 27.199 -2.594 1.00 20.76 C
|
|
ATOM 249 OD1 ASP A 31 18.884 27.234 -1.437 1.00 18.60 O
|
|
ATOM 250 OD2 ASP A 31 18.733 26.269 -3.352 1.00 19.28 O
|
|
ATOM 251 C ASP A 31 18.808 30.144 -2.022 1.00 22.62 C
|
|
ATOM 252 O ASP A 31 19.576 30.025 -2.948 1.00 22.48 O
|
|
ATOM 253 N ILE A 32 19.096 30.854 -0.952 1.00 25.86 N
|
|
ATOM 254 CA ILE A 32 20.329 31.602 -0.865 1.00 33.12 C
|
|
ATOM 255 CB ILE A 32 20.319 32.472 0.369 1.00 36.60 C
|
|
ATOM 256 CG1 ILE A 32 20.276 31.577 1.602 1.00 39.07 C
|
|
ATOM 257 CD1 ILE A 32 20.865 32.187 2.807 1.00 40.93 C
|
|
ATOM 258 CG2 ILE A 32 19.123 33.398 0.343 1.00 34.36 C
|
|
ATOM 259 C ILE A 32 21.518 30.675 -0.774 1.00 41.77 C
|
|
ATOM 260 O ILE A 32 22.660 31.108 -0.903 1.00 49.93 O
|
|
ATOM 261 N PHE A 33 21.275 29.401 -0.535 1.00 40.36 N
|
|
ATOM 262 CA PHE A 33 22.399 28.522 -0.468 1.00 44.50 C
|
|
ATOM 263 CB PHE A 33 22.037 27.243 0.262 1.00 47.47 C
|
|
ATOM 264 CG PHE A 33 21.577 27.487 1.667 1.00 47.77 C
|
|
ATOM 265 CD1 PHE A 33 22.385 28.143 2.571 1.00 47.86 C
|
|
ATOM 266 CE1 PHE A 33 21.957 28.387 3.863 1.00 51.26 C
|
|
ATOM 267 CZ PHE A 33 20.706 27.978 4.261 1.00 50.21 C
|
|
ATOM 268 CE2 PHE A 33 19.887 27.332 3.365 1.00 48.66 C
|
|
ATOM 269 CD2 PHE A 33 20.324 27.094 2.074 1.00 48.98 C
|
|
ATOM 270 C PHE A 33 22.874 28.302 -1.881 1.00 45.52 C
|
|
ATOM 271 O PHE A 33 24.068 28.409 -2.143 1.00 46.84 O
|
|
ATOM 272 N ALA A 34 21.928 28.080 -2.797 1.00 39.40 N
|
|
ATOM 273 CA ALA A 34 22.243 27.820 -4.200 1.00 29.14 C
|
|
ATOM 274 CB ALA A 34 21.019 27.859 -5.031 1.00 30.89 C
|
|
ATOM 275 C ALA A 34 23.348 28.660 -4.839 1.00 26.33 C
|
|
ATOM 276 O ALA A 34 23.744 28.417 -5.977 1.00 22.48 O
|
|
ATOM 277 N ALA A 35 23.866 29.645 -4.129 1.00 27.34 N
|
|
ATOM 278 CA ALA A 35 25.018 30.363 -4.653 1.00 39.14 C
|
|
ATOM 279 CB ALA A 35 25.413 31.465 -3.687 1.00 40.63 C
|
|
ATOM 280 C ALA A 35 26.234 29.432 -4.951 1.00 44.92 C
|
|
ATOM 281 O ALA A 35 26.257 28.247 -4.589 1.00 37.17 O
|
|
ATOM 282 N SER A 36 27.238 29.983 -5.628 1.00 54.72 N
|
|
ATOM 283 CA SER A 36 28.495 29.270 -5.899 1.00 58.61 C
|
|
ATOM 284 CB SER A 36 28.762 29.208 -7.402 1.00 60.45 C
|
|
ATOM 285 OG SER A 36 27.768 28.462 -8.074 1.00 63.65 O
|
|
ATOM 286 C SER A 36 29.687 29.950 -5.207 1.00 57.73 C
|
|
ATOM 287 O SER A 36 30.102 29.579 -4.108 1.00 54.06 O
|
|
ATOM 288 N LYS A 37 29.436 31.492 -5.050 0.00 66.69 N
|
|
ATOM 289 CA LYS A 37 30.420 32.498 -4.654 0.00 69.62 C
|
|
ATOM 290 CB LYS A 37 31.182 32.880 -5.929 0.00 70.32 C
|
|
ATOM 291 CG LYS A 37 32.314 33.879 -5.797 0.00 71.00 C
|
|
ATOM 292 CD LYS A 37 32.837 34.204 -7.191 0.00 71.01 C
|
|
ATOM 293 CE LYS A 37 34.322 34.527 -7.186 0.00 71.01 C
|
|
ATOM 294 NZ LYS A 37 34.835 34.715 -8.573 0.00 71.01 N
|
|
ATOM 295 C LYS A 37 29.885 33.784 -3.984 0.00 71.15 C
|
|
ATOM 296 O LYS A 37 29.738 34.816 -4.647 0.00 71.58 O
|
|
ATOM 297 N ASN A 38 29.599 33.729 -2.683 0.00 72.44 N
|
|
ATOM 298 CA ASN A 38 29.232 34.943 -1.925 0.00 73.19 C
|
|
ATOM 299 CB ASN A 38 28.024 35.708 -2.525 0.00 74.25 C
|
|
ATOM 300 CG ASN A 38 26.757 34.864 -2.619 0.00 74.93 C
|
|
ATOM 301 OD1 ASN A 38 26.487 34.012 -1.768 0.00 75.24 O
|
|
ATOM 302 ND2 ASN A 38 25.957 35.119 -3.654 0.00 75.45 N
|
|
ATOM 303 C ASN A 38 29.101 34.761 -0.408 0.00 72.48 C
|
|
ATOM 304 O ASN A 38 28.157 35.259 0.218 0.00 72.37 O
|
|
ATOM 305 N THR A 39 30.090 34.076 0.174 0.00 71.50 N
|
|
ATOM 306 CA THR A 39 30.086 33.765 1.601 0.00 69.93 C
|
|
ATOM 307 CB THR A 39 30.678 32.344 1.845 0.00 70.85 C
|
|
ATOM 308 OG1 THR A 39 31.906 32.196 1.111 0.00 71.20 O
|
|
ATOM 309 CG2 THR A 39 29.773 31.264 1.251 0.00 70.95 C
|
|
ATOM 310 C THR A 39 30.754 34.750 2.578 0.00 67.93 C
|
|
ATOM 311 O THR A 39 31.012 35.923 2.275 0.00 67.92 O
|
|
ATOM 312 N THR A 40 31.089 34.908 3.741 1.00 78.50 N
|
|
ATOM 313 CA THR A 40 31.353 34.954 5.174 1.00 79.32 C
|
|
ATOM 314 CB THR A 40 31.615 36.389 5.598 1.00 83.20 C
|
|
ATOM 315 OG1 THR A 40 32.754 36.871 4.880 1.00 87.79 O
|
|
ATOM 316 CG2 THR A 40 32.056 36.448 7.055 1.00 86.36 C
|
|
ATOM 317 C THR A 40 30.197 34.370 5.967 1.00 75.59 C
|
|
ATOM 318 O THR A 40 29.060 34.363 5.504 1.00 72.26 O
|
|
ATOM 319 N GLU A 41 30.496 33.858 7.155 1.00 74.49 N
|
|
ATOM 320 CA GLU A 41 29.465 33.301 8.013 1.00 75.28 C
|
|
ATOM 321 CB GLU A 41 30.055 32.850 9.348 1.00 80.16 C
|
|
ATOM 322 CG GLU A 41 30.650 31.457 9.359 1.00 84.91 C
|
|
ATOM 323 CD GLU A 41 30.761 30.907 10.765 1.00 89.11 C
|
|
ATOM 324 OE1 GLU A 41 30.577 31.696 11.719 1.00 90.53 O
|
|
ATOM 325 OE2 GLU A 41 31.022 29.693 10.917 1.00 91.94 O
|
|
ATOM 326 C GLU A 41 28.421 34.373 8.271 1.00 68.24 C
|
|
ATOM 327 O GLU A 41 27.219 34.136 8.160 1.00 62.89 O
|
|
ATOM 328 N LYS A 42 28.908 35.558 8.612 1.00 61.47 N
|
|
ATOM 329 CA LYS A 42 28.038 36.663 8.932 1.00 62.57 C
|
|
ATOM 330 CB LYS A 42 28.848 37.910 9.294 1.00 70.86 C
|
|
ATOM 331 CG LYS A 42 29.722 37.681 10.535 1.00 80.26 C
|
|
ATOM 332 CD LYS A 42 30.103 38.966 11.281 1.00 86.48 C
|
|
ATOM 333 CE LYS A 42 31.086 38.641 12.415 1.00 89.07 C
|
|
ATOM 334 NZ LYS A 42 31.653 39.843 13.086 1.00 90.24 N
|
|
ATOM 335 C LYS A 42 27.096 36.892 7.781 1.00 57.37 C
|
|
ATOM 336 O LYS A 42 25.887 36.902 7.965 1.00 53.65 O
|
|
ATOM 337 N GLU A 43 27.648 37.050 6.587 1.00 55.19 N
|
|
ATOM 338 CA GLU A 43 26.828 37.198 5.389 1.00 50.01 C
|
|
ATOM 339 CB GLU A 43 27.722 37.553 4.191 1.00 54.50 C
|
|
ATOM 340 CG GLU A 43 27.030 38.199 3.001 1.00 60.24 C
|
|
ATOM 341 CD GLU A 43 28.017 38.894 2.078 1.00 64.18 C
|
|
ATOM 342 OE1 GLU A 43 29.229 38.614 2.182 1.00 62.23 O
|
|
ATOM 343 OE2 GLU A 43 27.578 39.718 1.250 1.00 66.89 O
|
|
ATOM 344 C GLU A 43 25.998 35.899 5.168 1.00 44.20 C
|
|
ATOM 345 O GLU A 43 24.891 35.924 4.641 1.00 36.64 O
|
|
ATOM 346 N THR A 44 26.492 34.755 5.594 1.00 40.35 N
|
|
ATOM 347 CA THR A 44 25.629 33.608 5.440 1.00 40.68 C
|
|
ATOM 348 CB THR A 44 26.341 32.329 5.859 1.00 42.93 C
|
|
ATOM 349 OG1 THR A 44 27.191 31.888 4.792 1.00 43.45 O
|
|
ATOM 350 CG2 THR A 44 25.344 31.226 5.975 1.00 46.19 C
|
|
ATOM 351 C THR A 44 24.347 33.812 6.261 1.00 39.03 C
|
|
ATOM 352 O THR A 44 23.256 33.959 5.728 1.00 40.20 O
|
|
ATOM 353 N PHE A 45 24.504 33.836 7.567 1.00 32.01 N
|
|
ATOM 354 CA PHE A 45 23.388 33.965 8.465 1.00 32.86 C
|
|
ATOM 355 CB PHE A 45 23.932 34.003 9.871 1.00 37.47 C
|
|
ATOM 356 CG PHE A 45 24.758 32.811 10.195 1.00 43.30 C
|
|
ATOM 357 CD1 PHE A 45 24.444 31.591 9.636 1.00 44.43 C
|
|
ATOM 358 CE1 PHE A 45 25.180 30.492 9.919 1.00 45.79 C
|
|
ATOM 359 CZ PHE A 45 26.250 30.593 10.758 1.00 49.42 C
|
|
ATOM 360 CE2 PHE A 45 26.594 31.798 11.314 1.00 44.98 C
|
|
ATOM 361 CD2 PHE A 45 25.852 32.901 11.033 1.00 46.65 C
|
|
ATOM 362 C PHE A 45 22.471 35.146 8.166 1.00 29.29 C
|
|
ATOM 363 O PHE A 45 21.243 35.041 8.296 1.00 30.72 O
|
|
ATOM 364 N CYS A 46 23.047 36.245 7.721 1.00 16.03 N
|
|
ATOM 365 CA CYS A 46 22.264 37.419 7.374 1.00 24.52 C
|
|
ATOM 366 CB CYS A 46 23.168 38.546 6.923 1.00 24.97 C
|
|
ATOM 367 SG CYS A 46 22.258 40.025 6.430 1.00 33.11 S
|
|
ATOM 368 C CYS A 46 21.280 37.117 6.263 1.00 26.69 C
|
|
ATOM 369 O CYS A 46 20.129 37.552 6.306 1.00 14.36 O
|
|
ATOM 370 N ARG A 47 21.755 36.339 5.287 1.00 29.59 N
|
|
ATOM 371 CA ARG A 47 21.000 35.992 4.087 1.00 34.53 C
|
|
ATOM 372 CB ARG A 47 21.937 35.391 3.034 1.00 40.12 C
|
|
ATOM 373 CG ARG A 47 22.941 36.406 2.457 1.00 52.54 C
|
|
ATOM 374 CD ARG A 47 24.200 35.786 1.849 1.00 57.62 C
|
|
ATOM 375 NE ARG A 47 23.913 34.606 1.032 1.00 63.37 N
|
|
ATOM 376 CZ ARG A 47 23.488 34.647 -0.225 1.00 67.12 C
|
|
ATOM 377 NH1 ARG A 47 23.282 35.816 -0.824 1.00 69.14 N
|
|
ATOM 378 NH2 ARG A 47 23.264 33.519 -0.887 1.00 65.46 N
|
|
ATOM 379 C ARG A 47 19.892 35.020 4.435 1.00 22.48 C
|
|
ATOM 380 O ARG A 47 18.814 35.044 3.841 1.00 24.06 O
|
|
ATOM 381 N ALA A 48 20.164 34.205 5.438 1.00 27.06 N
|
|
ATOM 382 CA ALA A 48 19.206 33.238 5.924 1.00 21.10 C
|
|
ATOM 383 CB ALA A 48 19.908 32.239 6.782 1.00 13.10 C
|
|
ATOM 384 C ALA A 48 18.080 33.944 6.684 1.00 26.60 C
|
|
ATOM 385 O ALA A 48 16.902 33.638 6.496 1.00 22.86 O
|
|
ATOM 386 N ALA A 49 18.451 34.928 7.497 1.00 24.17 N
|
|
ATOM 387 CA ALA A 49 17.499 35.647 8.316 1.00 23.13 C
|
|
ATOM 388 CB ALA A 49 18.224 36.518 9.340 1.00 21.81 C
|
|
ATOM 389 C ALA A 49 16.576 36.474 7.464 1.00 23.27 C
|
|
ATOM 390 O ALA A 49 15.376 36.616 7.757 1.00 23.07 O
|
|
ATOM 391 N THR A 50 17.145 36.986 6.385 1.00 24.21 N
|
|
ATOM 392 CA THR A 50 16.413 37.774 5.420 1.00 25.31 C
|
|
ATOM 393 CB THR A 50 17.381 38.349 4.358 1.00 30.46 C
|
|
ATOM 394 OG1 THR A 50 18.477 39.008 5.010 1.00 25.59 O
|
|
ATOM 395 CG2 THR A 50 16.712 39.456 3.571 1.00 32.43 C
|
|
ATOM 396 C THR A 50 15.289 36.977 4.773 1.00 21.15 C
|
|
ATOM 397 O THR A 50 14.136 37.395 4.795 1.00 28.75 O
|
|
ATOM 398 N VAL A 51 15.612 35.837 4.192 1.00 23.32 N
|
|
ATOM 399 CA VAL A 51 14.553 35.032 3.590 1.00 25.55 C
|
|
ATOM 400 CB VAL A 51 15.077 33.943 2.627 1.00 20.30 C
|
|
ATOM 401 CG1 VAL A 51 15.856 34.572 1.486 1.00 26.99 C
|
|
ATOM 402 CG2 VAL A 51 15.896 32.930 3.346 1.00 29.58 C
|
|
ATOM 403 C VAL A 51 13.549 34.499 4.612 1.00 22.95 C
|
|
ATOM 404 O VAL A 51 12.352 34.487 4.326 1.00 28.70 O
|
|
ATOM 405 N LEU A 52 14.001 34.106 5.804 1.00 20.38 N
|
|
ATOM 406 CA LEU A 52 13.029 33.710 6.793 1.00 19.93 C
|
|
ATOM 407 CB LEU A 52 13.678 33.117 8.040 1.00 20.87 C
|
|
ATOM 408 CG LEU A 52 14.434 31.880 7.571 1.00 24.92 C
|
|
ATOM 409 CD1 LEU A 52 15.293 31.302 8.643 1.00 27.31 C
|
|
ATOM 410 CD2 LEU A 52 13.466 30.869 7.066 1.00 22.59 C
|
|
ATOM 411 C LEU A 52 12.096 34.865 7.134 1.00 21.29 C
|
|
ATOM 412 O LEU A 52 10.893 34.654 7.288 1.00 22.63 O
|
|
ATOM 413 N ARG A 53 12.634 36.081 7.242 1.00 17.85 N
|
|
ATOM 414 CA ARG A 53 11.799 37.211 7.613 1.00 18.45 C
|
|
ATOM 415 CB ARG A 53 12.615 38.476 7.922 1.00 17.92 C
|
|
ATOM 416 CG ARG A 53 11.772 39.618 8.552 1.00 23.61 C
|
|
ATOM 417 CD ARG A 53 12.603 40.579 9.402 1.00 28.54 C
|
|
ATOM 418 NE ARG A 53 11.898 41.772 9.872 1.00 36.47 N
|
|
ATOM 419 CZ ARG A 53 12.009 42.982 9.328 1.00 36.42 C
|
|
ATOM 420 NH1 ARG A 53 12.778 43.179 8.262 1.00 33.23 N
|
|
ATOM 421 NH2 ARG A 53 11.339 43.997 9.846 1.00 40.68 N
|
|
ATOM 422 C ARG A 53 10.739 37.467 6.544 1.00 19.21 C
|
|
ATOM 423 O ARG A 53 9.580 37.654 6.864 1.00 18.91 O
|
|
ATOM 424 N GLN A 54 11.139 37.471 5.279 1.00 13.68 N
|
|
ATOM 425 CA GLN A 54 10.155 37.562 4.205 1.00 25.40 C
|
|
ATOM 426 CB GLN A 54 10.784 37.367 2.838 1.00 30.18 C
|
|
ATOM 427 CG GLN A 54 12.102 38.027 2.629 1.00 47.09 C
|
|
ATOM 428 CD GLN A 54 12.513 38.063 1.167 1.00 51.19 C
|
|
ATOM 429 OE1 GLN A 54 13.402 37.315 0.739 1.00 49.89 O
|
|
ATOM 430 NE2 GLN A 54 11.866 38.928 0.395 1.00 50.67 N
|
|
ATOM 431 C GLN A 54 9.099 36.486 4.348 1.00 24.66 C
|
|
ATOM 432 O GLN A 54 7.908 36.765 4.197 1.00 24.45 O
|
|
ATOM 433 N PHE A 55 9.536 35.257 4.611 1.00 19.51 N
|
|
ATOM 434 CA PHE A 55 8.589 34.158 4.706 1.00 22.23 C
|
|
ATOM 435 CB PHE A 55 9.235 32.804 4.960 1.00 19.71 C
|
|
ATOM 436 CG PHE A 55 8.263 31.689 4.839 1.00 18.64 C
|
|
ATOM 437 CD1 PHE A 55 7.522 31.270 5.928 1.00 17.07 C
|
|
ATOM 438 CE1 PHE A 55 6.613 30.242 5.786 1.00 22.08 C
|
|
ATOM 439 CZ PHE A 55 6.397 29.679 4.546 1.00 21.81 C
|
|
ATOM 440 CE2 PHE A 55 7.117 30.110 3.458 1.00 20.07 C
|
|
ATOM 441 CD2 PHE A 55 8.016 31.127 3.606 1.00 14.79 C
|
|
ATOM 442 C PHE A 55 7.542 34.409 5.763 1.00 20.75 C
|
|
ATOM 443 O PHE A 55 6.354 34.290 5.482 1.00 22.01 O
|
|
ATOM 444 N TYR A 56 7.958 34.825 6.950 1.00 15.79 N
|
|
ATOM 445 CA TYR A 56 6.980 34.951 8.001 1.00 13.42 C
|
|
ATOM 446 CB TYR A 56 7.571 34.707 9.397 1.00 13.96 C
|
|
ATOM 447 CG TYR A 56 8.417 35.794 9.972 1.00 18.32 C
|
|
ATOM 448 CD1 TYR A 56 7.856 36.992 10.396 1.00 17.70 C
|
|
ATOM 449 CE1 TYR A 56 8.639 37.974 10.962 1.00 17.13 C
|
|
ATOM 450 CZ TYR A 56 10.013 37.773 11.114 1.00 18.27 C
|
|
ATOM 451 OH TYR A 56 10.779 38.771 11.655 1.00 19.74 O
|
|
ATOM 452 CE2 TYR A 56 10.580 36.598 10.722 1.00 6.42 C
|
|
ATOM 453 CD2 TYR A 56 9.779 35.613 10.155 1.00 13.09 C
|
|
ATOM 454 C TYR A 56 6.116 36.195 7.892 1.00 19.66 C
|
|
ATOM 455 O TYR A 56 4.919 36.148 8.171 1.00 13.86 O
|
|
ATOM 456 N SER A 57 6.717 37.280 7.438 1.00 18.48 N
|
|
ATOM 457 CA SER A 57 6.004 38.520 7.185 1.00 30.21 C
|
|
ATOM 458 CB SER A 57 6.965 39.543 6.610 1.00 29.85 C
|
|
ATOM 459 OG SER A 57 7.941 39.840 7.568 1.00 38.59 O
|
|
ATOM 460 C SER A 57 4.870 38.360 6.199 1.00 28.74 C
|
|
ATOM 461 O SER A 57 3.826 38.979 6.345 1.00 36.29 O
|
|
ATOM 462 N HIS A 58 5.112 37.562 5.169 1.00 25.58 N
|
|
ATOM 463 CA HIS A 58 4.147 37.313 4.099 1.00 31.30 C
|
|
ATOM 464 CB HIS A 58 4.882 37.055 2.785 1.00 41.14 C
|
|
ATOM 465 CG HIS A 58 5.647 38.236 2.268 1.00 57.75 C
|
|
ATOM 466 ND1 HIS A 58 6.856 38.120 1.610 1.00 62.46 N
|
|
ATOM 467 CE1 HIS A 58 7.289 39.320 1.268 1.00 64.94 C
|
|
ATOM 468 NE2 HIS A 58 6.407 40.212 1.683 1.00 64.51 N
|
|
ATOM 469 CD2 HIS A 58 5.371 39.561 2.309 1.00 61.87 C
|
|
ATOM 470 C HIS A 58 3.180 36.147 4.315 1.00 26.23 C
|
|
ATOM 471 O HIS A 58 2.145 36.079 3.659 1.00 22.44 O
|
|
ATOM 472 N HIS A 59 3.506 35.200 5.185 1.00 23.70 N
|
|
ATOM 473 CA HIS A 59 2.605 34.071 5.346 1.00 23.57 C
|
|
ATOM 474 CB HIS A 59 3.312 32.747 5.036 1.00 22.12 C
|
|
ATOM 475 CG HIS A 59 3.807 32.657 3.627 1.00 35.22 C
|
|
ATOM 476 ND1 HIS A 59 3.038 33.025 2.545 1.00 35.30 N
|
|
ATOM 477 CE1 HIS A 59 3.731 32.849 1.434 1.00 27.93 C
|
|
ATOM 478 NE2 HIS A 59 4.921 32.376 1.758 1.00 33.41 N
|
|
ATOM 479 CD2 HIS A 59 4.995 32.249 3.124 1.00 36.33 C
|
|
ATOM 480 C HIS A 59 1.907 34.028 6.681 1.00 18.96 C
|
|
ATOM 481 O HIS A 59 1.069 33.183 6.901 1.00 23.78 O
|
|
ATOM 482 N GLU A 60 2.238 34.935 7.579 1.00 22.64 N
|
|
ATOM 483 CA GLU A 60 1.580 34.909 8.881 1.00 24.18 C
|
|
ATOM 484 CB GLU A 60 2.011 36.091 9.732 1.00 24.43 C
|
|
ATOM 485 CG GLU A 60 1.363 36.146 11.096 1.00 31.81 C
|
|
ATOM 486 CD GLU A 60 2.164 36.988 12.070 1.00 33.19 C
|
|
ATOM 487 OE1 GLU A 60 3.065 37.728 11.615 1.00 37.03 O
|
|
ATOM 488 OE2 GLU A 60 1.914 36.892 13.289 1.00 26.77 O
|
|
ATOM 489 C GLU A 60 0.074 34.904 8.773 1.00 24.05 C
|
|
ATOM 490 O GLU A 60 -0.579 34.133 9.454 1.00 23.57 O
|
|
ATOM 491 N LYS A 61 -0.482 35.790 7.951 1.00 22.16 N
|
|
ATOM 492 CA LYS A 61 -1.932 35.857 7.777 1.00 29.18 C
|
|
ATOM 493 CB LYS A 61 -2.438 37.279 7.989 1.00 42.44 C
|
|
ATOM 494 CG LYS A 61 -2.434 37.715 9.440 1.00 54.33 C
|
|
ATOM 495 CD LYS A 61 -2.830 39.183 9.584 1.00 64.43 C
|
|
ATOM 496 CE LYS A 61 -2.630 39.681 11.016 1.00 70.84 C
|
|
ATOM 497 NZ LYS A 61 -2.848 41.154 11.149 1.00 72.16 N
|
|
ATOM 498 C LYS A 61 -2.399 35.342 6.412 1.00 25.53 C
|
|
ATOM 499 O LYS A 61 -3.480 35.681 5.960 1.00 24.43 O
|
|
ATOM 500 N ASP A 62 -1.588 34.499 5.778 1.00 22.22 N
|
|
ATOM 501 CA ASP A 62 -1.890 33.971 4.457 1.00 17.63 C
|
|
ATOM 502 CB ASP A 62 -0.607 33.363 3.882 1.00 22.25 C
|
|
ATOM 503 CG ASP A 62 -0.793 32.770 2.504 1.00 25.12 C
|
|
ATOM 504 OD1 ASP A 62 -1.856 32.132 2.251 1.00 30.83 O
|
|
ATOM 505 OD2 ASP A 62 0.070 32.907 1.606 1.00 26.75 O
|
|
ATOM 506 C ASP A 62 -3.004 32.905 4.540 1.00 16.91 C
|
|
ATOM 507 O ASP A 62 -2.807 31.810 5.113 1.00 12.49 O
|
|
ATOM 508 N THR A 63 -4.159 33.209 3.939 1.00 9.64 N
|
|
ATOM 509 CA THR A 63 -5.319 32.347 4.038 1.00 15.68 C
|
|
ATOM 510 CB THR A 63 -6.506 32.805 3.161 1.00 22.87 C
|
|
ATOM 511 OG1 THR A 63 -6.177 32.650 1.774 1.00 39.63 O
|
|
ATOM 512 CG2 THR A 63 -6.730 34.262 3.320 1.00 22.63 C
|
|
ATOM 513 C THR A 63 -4.985 30.887 3.720 1.00 19.74 C
|
|
ATOM 514 O THR A 63 -5.684 29.997 4.187 1.00 22.46 O
|
|
ATOM 515 N ARG A 64 -3.930 30.642 2.948 1.00 21.21 N
|
|
ATOM 516 CA ARG A 64 -3.538 29.291 2.588 1.00 22.30 C
|
|
ATOM 517 CB ARG A 64 -2.513 29.306 1.441 1.00 22.53 C
|
|
ATOM 518 CG ARG A 64 -3.072 29.175 0.018 1.00 20.52 C
|
|
ATOM 519 CD ARG A 64 -2.039 29.459 -1.052 1.00 17.71 C
|
|
ATOM 520 NE ARG A 64 -1.170 30.574 -0.669 1.00 20.34 N
|
|
ATOM 521 CZ ARG A 64 -0.162 31.022 -1.391 1.00 21.66 C
|
|
ATOM 522 NH1 ARG A 64 0.122 30.431 -2.538 1.00 20.42 N
|
|
ATOM 523 NH2 ARG A 64 0.575 32.049 -0.963 1.00 17.69 N
|
|
ATOM 524 C ARG A 64 -2.912 28.589 3.775 1.00 21.31 C
|
|
ATOM 525 O ARG A 64 -2.857 27.386 3.806 1.00 29.45 O
|
|
ATOM 526 N CYS A 65 -2.418 29.340 4.738 1.00 20.16 N
|
|
ATOM 527 CA CYS A 65 -1.701 28.783 5.869 1.00 24.28 C
|
|
ATOM 528 CB CYS A 65 -0.383 29.527 6.047 1.00 24.76 C
|
|
ATOM 529 SG CYS A 65 0.703 29.385 4.601 1.00 31.83 S
|
|
ATOM 530 C CYS A 65 -2.480 28.820 7.166 1.00 23.45 C
|
|
ATOM 531 O CYS A 65 -2.250 27.996 8.011 1.00 20.75 O
|
|
ATOM 532 N LEU A 66 -3.392 29.785 7.312 1.00 22.00 N
|
|
ATOM 533 CA LEU A 66 -4.115 29.946 8.556 1.00 22.95 C
|
|
ATOM 534 CB LEU A 66 -5.110 31.085 8.440 1.00 17.25 C
|
|
ATOM 535 CG LEU A 66 -4.504 32.473 8.489 1.00 20.30 C
|
|
ATOM 536 CD1 LEU A 66 -5.562 33.489 8.112 1.00 18.10 C
|
|
ATOM 537 CD2 LEU A 66 -3.870 32.762 9.837 1.00 14.07 C
|
|
ATOM 538 C LEU A 66 -4.817 28.690 9.082 1.00 17.94 C
|
|
ATOM 539 O LEU A 66 -4.930 28.509 10.274 1.00 21.20 O
|
|
ATOM 540 N GLY A 67 -5.320 27.845 8.207 1.00 18.40 N
|
|
ATOM 541 CA GLY A 67 -5.886 26.589 8.682 1.00 19.19 C
|
|
ATOM 542 C GLY A 67 -7.381 26.578 8.846 1.00 21.53 C
|
|
ATOM 543 O GLY A 67 -7.975 27.601 9.095 1.00 17.57 O
|
|
ATOM 544 N ALA A 68 -7.985 25.406 8.684 1.00 23.67 N
|
|
ATOM 545 CA ALA A 68 -9.409 25.235 8.905 1.00 24.35 C
|
|
ATOM 546 CB ALA A 68 -9.974 24.235 7.936 1.00 31.19 C
|
|
ATOM 547 C ALA A 68 -9.675 24.760 10.311 1.00 20.92 C
|
|
ATOM 548 O ALA A 68 -10.541 25.331 11.001 1.00 18.93 O
|
|
ATOM 549 N THR A 69 -8.942 23.713 10.717 1.00 23.12 N
|
|
ATOM 550 CA THR A 69 -9.073 23.136 12.067 1.00 22.92 C
|
|
ATOM 551 CB THR A 69 -8.913 21.589 12.133 1.00 22.87 C
|
|
ATOM 552 OG1 THR A 69 -7.545 21.189 11.911 1.00 27.63 O
|
|
ATOM 553 CG2 THR A 69 -9.683 20.905 11.034 1.00 22.86 C
|
|
ATOM 554 C THR A 69 -8.235 23.820 13.130 1.00 22.34 C
|
|
ATOM 555 O THR A 69 -7.334 24.601 12.827 1.00 30.91 O
|
|
ATOM 556 N ALA A 70 -8.606 23.578 14.380 1.00 27.15 N
|
|
ATOM 557 CA ALA A 70 -7.924 24.168 15.519 1.00 26.41 C
|
|
ATOM 558 CB ALA A 70 -8.623 23.799 16.799 1.00 26.24 C
|
|
ATOM 559 C ALA A 70 -6.505 23.678 15.535 1.00 25.47 C
|
|
ATOM 560 O ALA A 70 -5.596 24.432 15.841 1.00 28.79 O
|
|
ATOM 561 N GLN A 71 -6.331 22.405 15.206 1.00 24.43 N
|
|
ATOM 562 CA GLN A 71 -5.013 21.840 15.115 1.00 36.66 C
|
|
ATOM 563 CB GLN A 71 -5.056 20.345 14.781 1.00 48.93 C
|
|
ATOM 564 CG GLN A 71 -3.672 19.737 14.547 1.00 65.36 C
|
|
ATOM 565 CD GLN A 71 -3.692 18.223 14.440 1.00 77.70 C
|
|
ATOM 566 OE1 GLN A 71 -3.914 17.674 13.361 1.00 83.97 O
|
|
ATOM 567 NE2 GLN A 71 -3.438 17.546 15.553 1.00 79.65 N
|
|
ATOM 568 C GLN A 71 -4.240 22.597 14.043 1.00 32.74 C
|
|
ATOM 569 O GLN A 71 -3.115 23.001 14.250 1.00 25.34 O
|
|
ATOM 570 N GLN A 72 -4.841 22.808 12.888 1.00 30.13 N
|
|
ATOM 571 CA GLN A 72 -4.061 23.440 11.847 1.00 27.32 C
|
|
ATOM 572 CB GLN A 72 -4.808 23.403 10.542 1.00 22.99 C
|
|
ATOM 573 CG GLN A 72 -4.891 22.023 9.898 1.00 18.15 C
|
|
ATOM 574 CD GLN A 72 -5.889 22.065 8.765 1.00 19.48 C
|
|
ATOM 575 OE1 GLN A 72 -6.806 22.897 8.772 1.00 21.70 O
|
|
ATOM 576 NE2 GLN A 72 -5.705 21.219 7.789 1.00 26.40 N
|
|
ATOM 577 C GLN A 72 -3.728 24.864 12.219 1.00 21.20 C
|
|
ATOM 578 O GLN A 72 -2.633 25.362 11.973 1.00 21.20 O
|
|
ATOM 579 N PHE A 73 -4.690 25.532 12.819 1.00 17.32 N
|
|
ATOM 580 CA PHE A 73 -4.458 26.895 13.215 1.00 13.68 C
|
|
ATOM 581 CB PHE A 73 -5.741 27.512 13.785 1.00 16.17 C
|
|
ATOM 582 CG PHE A 73 -5.608 28.944 14.189 1.00 23.87 C
|
|
ATOM 583 CD1 PHE A 73 -4.935 29.852 13.392 1.00 26.41 C
|
|
ATOM 584 CE1 PHE A 73 -4.832 31.183 13.784 1.00 25.84 C
|
|
ATOM 585 CZ PHE A 73 -5.418 31.601 14.973 1.00 25.72 C
|
|
ATOM 586 CE2 PHE A 73 -6.053 30.695 15.773 1.00 29.50 C
|
|
ATOM 587 CD2 PHE A 73 -6.155 29.381 15.382 1.00 31.15 C
|
|
ATOM 588 C PHE A 73 -3.334 26.936 14.260 1.00 20.51 C
|
|
ATOM 589 O PHE A 73 -2.461 27.818 14.232 1.00 20.30 O
|
|
ATOM 590 N HIS A 74 -3.364 25.983 15.182 1.00 13.04 N
|
|
ATOM 591 CA HIS A 74 -2.375 25.952 16.229 1.00 24.29 C
|
|
ATOM 592 CB HIS A 74 -2.609 24.804 17.207 1.00 23.59 C
|
|
ATOM 593 CG HIS A 74 -1.490 24.617 18.178 1.00 32.66 C
|
|
ATOM 594 ND1 HIS A 74 -1.202 25.531 19.170 1.00 32.17 N
|
|
ATOM 595 CE1 HIS A 74 -0.163 25.109 19.862 1.00 29.21 C
|
|
ATOM 596 NE2 HIS A 74 0.240 23.960 19.351 1.00 33.26 N
|
|
ATOM 597 CD2 HIS A 74 -0.567 23.632 18.292 1.00 29.82 C
|
|
ATOM 598 C HIS A 74 -1.009 25.832 15.611 1.00 19.38 C
|
|
ATOM 599 O HIS A 74 -0.146 26.626 15.918 1.00 21.32 O
|
|
ATOM 600 N ARG A 75 -0.859 24.877 14.698 1.00 20.26 N
|
|
ATOM 601 CA ARG A 75 0.429 24.582 14.080 1.00 24.76 C
|
|
ATOM 602 CB ARG A 75 0.352 23.305 13.225 1.00 31.02 C
|
|
ATOM 603 CG ARG A 75 0.077 22.041 14.040 1.00 46.35 C
|
|
ATOM 604 CD ARG A 75 0.437 20.719 13.355 1.00 57.52 C
|
|
ATOM 605 NE ARG A 75 0.629 19.649 14.335 1.00 69.58 N
|
|
ATOM 606 CZ ARG A 75 0.614 18.345 14.058 1.00 75.13 C
|
|
ATOM 607 NH1 ARG A 75 0.412 17.923 12.818 1.00 74.49 N
|
|
ATOM 608 NH2 ARG A 75 0.796 17.460 15.028 1.00 75.54 N
|
|
ATOM 609 C ARG A 75 0.993 25.753 13.289 1.00 22.55 C
|
|
ATOM 610 O ARG A 75 2.193 26.000 13.304 1.00 19.42 O
|
|
ATOM 611 N HIS A 76 0.124 26.486 12.608 1.00 22.60 N
|
|
ATOM 612 CA HIS A 76 0.574 27.651 11.853 1.00 18.48 C
|
|
ATOM 613 CB HIS A 76 -0.527 28.223 10.984 1.00 15.20 C
|
|
ATOM 614 CG HIS A 76 -0.146 29.498 10.305 1.00 17.68 C
|
|
ATOM 615 ND1 HIS A 76 0.533 29.530 9.110 1.00 17.06 N
|
|
ATOM 616 CE1 HIS A 76 0.721 30.784 8.751 1.00 20.40 C
|
|
ATOM 617 NE2 HIS A 76 0.202 31.566 9.676 1.00 14.67 N
|
|
ATOM 618 CD2 HIS A 76 -0.323 30.783 10.671 1.00 15.65 C
|
|
ATOM 619 C HIS A 76 1.196 28.716 12.759 1.00 21.19 C
|
|
ATOM 620 O HIS A 76 2.302 29.184 12.484 1.00 14.99 O
|
|
ATOM 621 N LYS A 77 0.518 29.056 13.854 1.00 20.53 N
|
|
ATOM 622 CA LYS A 77 1.019 30.069 14.784 1.00 26.70 C
|
|
ATOM 623 CB LYS A 77 -0.013 30.360 15.880 1.00 21.94 C
|
|
ATOM 624 CG LYS A 77 -1.161 31.232 15.403 1.00 26.24 C
|
|
ATOM 625 CD LYS A 77 -2.109 31.640 16.534 1.00 30.08 C
|
|
ATOM 626 CE LYS A 77 -2.740 30.428 17.233 1.00 27.49 C
|
|
ATOM 627 NZ LYS A 77 -3.712 30.827 18.321 1.00 26.84 N
|
|
ATOM 628 C LYS A 77 2.361 29.611 15.369 1.00 23.66 C
|
|
ATOM 629 O LYS A 77 3.313 30.392 15.530 1.00 24.18 O
|
|
ATOM 630 N GLN A 78 2.419 28.323 15.675 1.00 22.04 N
|
|
ATOM 631 CA GLN A 78 3.634 27.726 16.152 1.00 23.71 C
|
|
ATOM 632 CB GLN A 78 3.414 26.253 16.493 1.00 22.87 C
|
|
ATOM 633 CG GLN A 78 2.753 26.003 17.843 1.00 29.80 C
|
|
ATOM 634 CD GLN A 78 3.463 26.669 19.010 1.00 35.91 C
|
|
ATOM 635 OE1 GLN A 78 3.317 27.883 19.233 1.00 39.63 O
|
|
ATOM 636 NE2 GLN A 78 4.219 25.876 19.774 1.00 31.71 N
|
|
ATOM 637 C GLN A 78 4.657 27.921 15.037 1.00 19.25 C
|
|
ATOM 638 O GLN A 78 5.766 28.375 15.296 1.00 15.65 O
|
|
ATOM 639 N LEU A 79 4.273 27.645 13.792 1.00 7.58 N
|
|
ATOM 640 CA LEU A 79 5.229 27.852 12.710 1.00 9.72 C
|
|
ATOM 641 CB LEU A 79 4.702 27.403 11.336 1.00 16.91 C
|
|
ATOM 642 CG LEU A 79 5.682 27.681 10.209 1.00 22.42 C
|
|
ATOM 643 CD1 LEU A 79 6.856 26.749 10.339 1.00 23.11 C
|
|
ATOM 644 CD2 LEU A 79 5.007 27.461 8.934 1.00 25.27 C
|
|
ATOM 645 C LEU A 79 5.827 29.265 12.670 1.00 16.38 C
|
|
ATOM 646 O LEU A 79 7.046 29.418 12.623 1.00 11.80 O
|
|
ATOM 647 N ILE A 80 4.989 30.299 12.718 1.00 17.38 N
|
|
ATOM 648 CA ILE A 80 5.521 31.644 12.655 1.00 17.51 C
|
|
ATOM 649 CB ILE A 80 4.319 32.622 12.441 1.00 17.67 C
|
|
ATOM 650 CG1 ILE A 80 3.484 32.148 11.241 1.00 15.17 C
|
|
ATOM 651 CD1 ILE A 80 4.079 32.449 9.905 1.00 9.31 C
|
|
ATOM 652 CG2 ILE A 80 4.767 34.084 12.304 1.00 18.68 C
|
|
ATOM 653 C ILE A 80 6.357 32.017 13.891 1.00 19.77 C
|
|
ATOM 654 O ILE A 80 7.381 32.710 13.776 1.00 13.60 O
|
|
ATOM 655 N ARG A 81 5.911 31.568 15.058 1.00 17.44 N
|
|
ATOM 656 CA ARG A 81 6.577 31.850 16.330 1.00 18.96 C
|
|
ATOM 657 CB ARG A 81 5.750 31.215 17.463 1.00 23.04 C
|
|
ATOM 658 CG ARG A 81 6.149 31.577 18.888 1.00 34.37 C
|
|
ATOM 659 CD ARG A 81 5.439 30.749 19.945 1.00 41.83 C
|
|
ATOM 660 NE ARG A 81 5.985 30.979 21.279 1.00 56.76 N
|
|
ATOM 661 CZ ARG A 81 5.710 30.230 22.350 1.00 64.57 C
|
|
ATOM 662 NH1 ARG A 81 4.890 29.186 22.248 1.00 68.66 N
|
|
ATOM 663 NH2 ARG A 81 6.253 30.521 23.528 1.00 63.53 N
|
|
ATOM 664 C ARG A 81 8.039 31.316 16.299 1.00 18.08 C
|
|
ATOM 665 O ARG A 81 9.012 31.997 16.665 1.00 14.32 O
|
|
ATOM 666 N PHE A 82 8.147 30.085 15.820 1.00 14.04 N
|
|
ATOM 667 CA PHE A 82 9.434 29.433 15.719 1.00 23.26 C
|
|
ATOM 668 CB PHE A 82 9.279 27.908 15.604 1.00 17.48 C
|
|
ATOM 669 CG PHE A 82 8.895 27.230 16.909 1.00 25.14 C
|
|
ATOM 670 CD1 PHE A 82 7.762 27.592 17.595 1.00 29.87 C
|
|
ATOM 671 CE1 PHE A 82 7.423 26.955 18.792 1.00 28.49 C
|
|
ATOM 672 CZ PHE A 82 8.224 25.974 19.313 1.00 25.83 C
|
|
ATOM 673 CE2 PHE A 82 9.348 25.617 18.652 1.00 28.98 C
|
|
ATOM 674 CD2 PHE A 82 9.681 26.235 17.450 1.00 24.45 C
|
|
ATOM 675 C PHE A 82 10.289 30.028 14.591 1.00 21.85 C
|
|
ATOM 676 O PHE A 82 11.499 30.091 14.723 1.00 15.04 O
|
|
ATOM 677 N LEU A 83 9.671 30.514 13.513 1.00 18.75 N
|
|
ATOM 678 CA LEU A 83 10.476 31.084 12.435 1.00 12.32 C
|
|
ATOM 679 CB LEU A 83 9.689 31.245 11.129 1.00 14.71 C
|
|
ATOM 680 CG LEU A 83 9.296 29.993 10.300 1.00 7.14 C
|
|
ATOM 681 CD1 LEU A 83 8.308 30.383 9.203 1.00 6.36 C
|
|
ATOM 682 CD2 LEU A 83 10.517 29.321 9.692 1.00 11.67 C
|
|
ATOM 683 C LEU A 83 11.136 32.371 12.911 1.00 20.26 C
|
|
ATOM 684 O LEU A 83 12.273 32.687 12.556 1.00 20.33 O
|
|
ATOM 685 N LYS A 84 10.404 33.074 13.767 1.00 20.74 N
|
|
ATOM 686 CA LYS A 84 10.809 34.336 14.345 1.00 21.95 C
|
|
ATOM 687 CB LYS A 84 9.611 35.032 14.974 1.00 26.76 C
|
|
ATOM 688 CG LYS A 84 8.703 35.759 14.004 1.00 26.31 C
|
|
ATOM 689 CD LYS A 84 7.511 36.300 14.723 1.00 23.02 C
|
|
ATOM 690 CE LYS A 84 6.762 37.311 13.886 1.00 23.78 C
|
|
ATOM 691 NZ LYS A 84 5.424 37.629 14.512 1.00 36.46 N
|
|
ATOM 692 C LYS A 84 11.873 34.113 15.393 1.00 18.21 C
|
|
ATOM 693 O LYS A 84 12.879 34.849 15.453 1.00 17.45 O
|
|
ATOM 694 N ARG A 85 11.700 33.079 16.207 1.00 13.59 N
|
|
ATOM 695 CA ARG A 85 12.718 32.736 17.192 1.00 19.51 C
|
|
ATOM 696 CB ARG A 85 12.293 31.503 17.989 1.00 23.30 C
|
|
ATOM 697 CG ARG A 85 13.251 31.064 19.115 1.00 23.73 C
|
|
ATOM 698 CD ARG A 85 12.765 29.867 19.886 1.00 22.68 C
|
|
ATOM 699 NE ARG A 85 11.615 30.190 20.705 1.00 23.93 N
|
|
ATOM 700 CZ ARG A 85 10.817 29.293 21.262 1.00 21.42 C
|
|
ATOM 701 NH1 ARG A 85 11.042 28.010 21.093 1.00 25.73 N
|
|
ATOM 702 NH2 ARG A 85 9.782 29.677 21.992 1.00 23.48 N
|
|
ATOM 703 C ARG A 85 14.034 32.449 16.458 1.00 19.84 C
|
|
ATOM 704 O ARG A 85 15.133 32.892 16.858 1.00 13.28 O
|
|
ATOM 705 N LEU A 86 13.901 31.707 15.365 1.00 17.96 N
|
|
ATOM 706 CA LEU A 86 15.053 31.300 14.550 1.00 22.23 C
|
|
ATOM 707 CB LEU A 86 14.605 30.440 13.372 1.00 20.73 C
|
|
ATOM 708 CG LEU A 86 15.664 29.888 12.404 1.00 21.35 C
|
|
ATOM 709 CD1 LEU A 86 16.749 29.037 13.103 1.00 23.97 C
|
|
ATOM 710 CD2 LEU A 86 14.995 29.088 11.288 1.00 20.92 C
|
|
ATOM 711 C LEU A 86 15.740 32.517 14.002 1.00 19.77 C
|
|
ATOM 712 O LEU A 86 16.976 32.609 13.981 1.00 11.42 O
|
|
ATOM 713 N ASP A 87 14.904 33.435 13.545 1.00 12.94 N
|
|
ATOM 714 CA ASP A 87 15.344 34.646 12.914 1.00 19.30 C
|
|
ATOM 715 CB ASP A 87 14.112 35.359 12.357 1.00 19.00 C
|
|
ATOM 716 CG ASP A 87 14.395 36.093 11.084 1.00 17.34 C
|
|
ATOM 717 OD1 ASP A 87 15.026 35.514 10.191 1.00 12.81 O
|
|
ATOM 718 OD2 ASP A 87 14.013 37.266 10.894 1.00 21.41 O
|
|
ATOM 719 C ASP A 87 16.032 35.572 13.901 1.00 15.06 C
|
|
ATOM 720 O ASP A 87 17.013 36.181 13.556 1.00 16.46 O
|
|
ATOM 721 N ARG A 88 15.473 35.696 15.099 1.00 9.80 N
|
|
ATOM 722 CA ARG A 88 16.025 36.469 16.206 1.00 16.29 C
|
|
ATOM 723 CB ARG A 88 15.111 36.241 17.427 1.00 19.80 C
|
|
ATOM 724 CG ARG A 88 15.543 36.865 18.720 1.00 34.93 C
|
|
ATOM 725 CD ARG A 88 14.492 36.801 19.813 1.00 38.96 C
|
|
ATOM 726 NE ARG A 88 14.542 35.572 20.601 1.00 44.44 N
|
|
ATOM 727 CZ ARG A 88 13.492 34.774 20.823 1.00 46.13 C
|
|
ATOM 728 NH1 ARG A 88 12.293 35.059 20.312 1.00 41.27 N
|
|
ATOM 729 NH2 ARG A 88 13.637 33.684 21.570 1.00 46.88 N
|
|
ATOM 730 C ARG A 88 17.489 36.018 16.486 1.00 14.52 C
|
|
ATOM 731 O ARG A 88 18.432 36.823 16.558 1.00 24.21 O
|
|
ATOM 732 N ASN A 89 17.639 34.708 16.626 1.00 16.55 N
|
|
ATOM 733 CA ASN A 89 18.929 34.093 16.864 1.00 19.49 C
|
|
ATOM 734 CB ASN A 89 18.743 32.600 17.141 1.00 20.96 C
|
|
ATOM 735 CG ASN A 89 18.219 32.320 18.558 1.00 25.33 C
|
|
ATOM 736 OD1 ASN A 89 18.968 32.336 19.536 1.00 29.49 O
|
|
ATOM 737 ND2 ASN A 89 16.941 32.036 18.657 1.00 17.35 N
|
|
ATOM 738 C ASN A 89 19.911 34.371 15.699 1.00 13.56 C
|
|
ATOM 739 O ASN A 89 20.966 34.914 15.902 1.00 12.00 O
|
|
ATOM 740 N LEU A 90 19.452 34.062 14.484 1.00 13.46 N
|
|
ATOM 741 CA LEU A 90 20.138 34.334 13.229 1.00 16.90 C
|
|
ATOM 742 CB LEU A 90 19.218 33.989 12.042 1.00 21.05 C
|
|
ATOM 743 CG LEU A 90 19.502 32.534 11.557 1.00 21.80 C
|
|
ATOM 744 CD1 LEU A 90 18.473 32.141 10.467 1.00 19.86 C
|
|
ATOM 745 CD2 LEU A 90 20.921 32.371 11.065 1.00 24.01 C
|
|
ATOM 746 C LEU A 90 20.686 35.751 13.112 1.00 22.38 C
|
|
ATOM 747 O LEU A 90 21.818 35.969 12.716 1.00 13.02 O
|
|
ATOM 748 N TRP A 91 19.880 36.734 13.462 1.00 18.84 N
|
|
ATOM 749 CA TRP A 91 20.322 38.089 13.340 1.00 21.65 C
|
|
ATOM 750 CB TRP A 91 19.113 39.020 13.476 1.00 24.38 C
|
|
ATOM 751 CG TRP A 91 18.164 39.085 12.298 1.00 22.05 C
|
|
ATOM 752 CD1 TRP A 91 16.826 38.738 12.276 1.00 20.37 C
|
|
ATOM 753 NE1 TRP A 91 16.296 38.982 11.032 1.00 17.26 N
|
|
ATOM 754 CE2 TRP A 91 17.263 39.541 10.247 1.00 21.74 C
|
|
ATOM 755 CD2 TRP A 91 18.432 39.652 11.017 1.00 26.31 C
|
|
ATOM 756 CE3 TRP A 91 19.564 40.203 10.423 1.00 29.85 C
|
|
ATOM 757 CZ3 TRP A 91 19.480 40.628 9.135 1.00 30.11 C
|
|
ATOM 758 CH2 TRP A 91 18.298 40.518 8.404 1.00 26.79 C
|
|
ATOM 759 CZ2 TRP A 91 17.190 39.975 8.938 1.00 24.47 C
|
|
ATOM 760 C TRP A 91 21.384 38.452 14.377 1.00 16.84 C
|
|
ATOM 761 O TRP A 91 22.318 39.149 14.061 1.00 14.05 O
|
|
ATOM 762 N GLY A 92 21.233 37.986 15.610 1.00 21.11 N
|
|
ATOM 763 CA GLY A 92 22.182 38.319 16.651 1.00 33.09 C
|
|
ATOM 764 C GLY A 92 23.554 37.826 16.248 1.00 33.44 C
|
|
ATOM 765 O GLY A 92 24.572 38.372 16.646 1.00 30.71 O
|
|
ATOM 766 N LEU A 93 23.553 36.789 15.425 1.00 31.62 N
|
|
ATOM 767 CA LEU A 93 24.783 36.181 14.954 1.00 42.13 C
|
|
ATOM 768 CB LEU A 93 24.499 34.728 14.562 1.00 45.73 C
|
|
ATOM 769 CG LEU A 93 25.434 33.600 14.996 1.00 47.58 C
|
|
ATOM 770 CD1 LEU A 93 25.424 33.489 16.495 1.00 48.49 C
|
|
ATOM 771 CD2 LEU A 93 25.093 32.243 14.370 1.00 43.34 C
|
|
ATOM 772 C LEU A 93 25.323 36.956 13.751 1.00 44.72 C
|
|
ATOM 773 O LEU A 93 26.519 37.109 13.584 1.00 50.69 O
|
|
ATOM 774 N ALA A 94 24.426 37.510 12.950 1.00 48.82 N
|
|
ATOM 775 CA ALA A 94 24.810 38.130 11.679 1.00 50.10 C
|
|
ATOM 776 CB ALA A 94 23.574 38.415 10.860 1.00 49.50 C
|
|
ATOM 777 C ALA A 94 25.736 39.348 11.648 1.00 59.75 C
|
|
ATOM 778 O ALA A 94 26.369 39.616 10.630 1.00 62.89 O
|
|
ATOM 779 N GLY A 95 25.818 40.114 12.721 1.00 68.00 N
|
|
ATOM 780 CA GLY A 95 26.559 41.355 12.615 1.00 79.70 C
|
|
ATOM 781 C GLY A 95 25.723 42.302 11.761 1.00 85.41 C
|
|
ATOM 782 O GLY A 95 26.238 43.179 11.076 1.00 83.37 O
|
|
ATOM 783 N LEU A 96 24.417 42.055 11.778 1.00 94.14 N
|
|
ATOM 784 CA LEU A 96 23.372 42.896 11.161 1.00103.31 C
|
|
ATOM 785 CB LEU A 96 23.425 44.355 11.635 1.00107.56 C
|
|
ATOM 786 CG LEU A 96 22.060 45.057 11.536 1.00109.46 C
|
|
ATOM 787 CD1 LEU A 96 20.964 44.218 12.193 1.00107.98 C
|
|
ATOM 788 CD2 LEU A 96 22.090 46.462 12.118 1.00112.49 C
|
|
ATOM 789 C LEU A 96 23.081 42.830 9.658 1.00106.86 C
|
|
ATOM 790 O LEU A 96 23.437 41.870 8.983 1.00106.58 O
|
|
ATOM 791 N ASN A 97 22.467 43.917 9.176 1.00112.39 N
|
|
ATOM 792 CA ASN A 97 21.783 44.035 7.867 1.00117.25 C
|
|
ATOM 793 CB ASN A 97 20.723 45.140 7.954 1.00120.92 C
|
|
ATOM 794 CG ASN A 97 19.548 44.740 8.811 1.00123.89 C
|
|
ATOM 795 OD1 ASN A 97 18.800 43.826 8.471 1.00124.77 O
|
|
ATOM 796 ND2 ASN A 97 19.381 45.418 9.933 1.00126.35 N
|
|
ATOM 797 C ASN A 97 22.423 44.096 6.463 1.00116.54 C
|
|
ATOM 798 O ASN A 97 21.754 43.744 5.489 1.00114.65 O
|
|
ATOM 799 N SER A 98 23.651 44.582 6.317 1.00115.58 N
|
|
ATOM 800 CA SER A 98 24.199 44.722 4.959 1.00111.89 C
|
|
ATOM 801 CB SER A 98 25.415 45.678 4.928 1.00113.88 C
|
|
ATOM 802 OG SER A 98 26.020 45.824 6.204 1.00113.28 O
|
|
ATOM 803 C SER A 98 24.442 43.392 4.188 1.00105.98 C
|
|
ATOM 804 O SER A 98 25.568 42.892 4.117 1.00107.38 O
|
|
ATOM 805 N CYS A 99 23.367 42.827 3.624 1.00 95.44 N
|
|
ATOM 806 CA CYS A 99 23.431 41.596 2.813 1.00 83.12 C
|
|
ATOM 807 CB CYS A 99 23.532 40.356 3.688 1.00 65.37 C
|
|
ATOM 808 SG CYS A 99 21.965 39.895 4.440 1.00 41.71 S
|
|
ATOM 809 C CYS A 99 22.235 41.454 1.860 1.00 88.23 C
|
|
ATOM 810 O CYS A 99 21.116 41.213 2.284 1.00 84.72 O
|
|
ATOM 811 N PRO A 100 22.497 41.651 0.575 1.00 94.90 N
|
|
ATOM 812 CA PRO A 100 21.482 41.581 -0.475 1.00 98.11 C
|
|
ATOM 813 CB PRO A 100 22.109 42.403 -1.607 1.00100.47 C
|
|
ATOM 814 CG PRO A 100 23.383 42.992 -1.019 1.00100.51 C
|
|
ATOM 815 CD PRO A 100 23.814 42.021 0.037 1.00 98.27 C
|
|
ATOM 816 C PRO A 100 21.261 40.149 -0.931 1.00 99.50 C
|
|
ATOM 817 O PRO A 100 22.190 39.342 -0.915 1.00100.16 O
|
|
ATOM 818 N VAL A 101 20.038 39.839 -1.337 1.00 99.44 N
|
|
ATOM 819 CA VAL A 101 19.706 38.492 -1.767 1.00100.03 C
|
|
ATOM 820 CB VAL A 101 18.448 38.010 -1.065 1.00102.57 C
|
|
ATOM 821 CG1 VAL A 101 18.270 36.526 -1.283 1.00101.89 C
|
|
ATOM 822 CG2 VAL A 101 18.546 38.323 0.417 1.00105.54 C
|
|
ATOM 823 C VAL A 101 19.508 38.425 -3.274 1.00 98.44 C
|
|
ATOM 824 O VAL A 101 18.516 38.934 -3.800 1.00 94.98 O
|
|
ATOM 825 N LYS A 102 20.448 37.767 -3.955 1.00 99.16 N
|
|
ATOM 826 CA LYS A 102 20.465 37.713 -5.419 1.00100.28 C
|
|
ATOM 827 CB LYS A 102 21.881 37.971 -5.959 1.00107.36 C
|
|
ATOM 828 CG LYS A 102 22.525 39.275 -5.552 1.00114.59 C
|
|
ATOM 829 CD LYS A 102 23.692 39.042 -4.603 1.00120.01 C
|
|
ATOM 830 CE LYS A 102 24.656 40.227 -4.639 1.00123.27 C
|
|
ATOM 831 NZ LYS A 102 25.637 40.209 -3.521 1.00124.88 N
|
|
ATOM 832 C LYS A 102 19.977 36.428 -6.080 1.00 93.97 C
|
|
ATOM 833 O LYS A 102 19.675 36.435 -7.271 1.00 95.76 O
|
|
ATOM 834 N GLU A 103 19.930 35.324 -5.341 1.00 86.51 N
|
|
ATOM 835 CA GLU A 103 19.570 34.036 -5.950 1.00 78.91 C
|
|
ATOM 836 CB GLU A 103 19.669 32.873 -4.955 1.00 81.01 C
|
|
ATOM 837 CG GLU A 103 20.997 32.131 -4.995 1.00 83.64 C
|
|
ATOM 838 CD GLU A 103 22.185 33.027 -4.702 1.00 86.03 C
|
|
ATOM 839 OE1 GLU A 103 22.109 33.824 -3.740 1.00 87.18 O
|
|
ATOM 840 OE2 GLU A 103 23.198 32.935 -5.431 1.00 87.18 O
|
|
ATOM 841 C GLU A 103 18.232 34.022 -6.679 1.00 70.42 C
|
|
ATOM 842 O GLU A 103 17.242 34.619 -6.249 1.00 70.79 O
|
|
ATOM 843 N ALA A 104 18.221 33.333 -7.806 1.00 60.83 N
|
|
ATOM 844 CA ALA A 104 17.017 33.251 -8.593 1.00 57.60 C
|
|
ATOM 845 CB ALA A 104 17.354 33.131 -10.069 1.00 58.24 C
|
|
ATOM 846 C ALA A 104 16.164 32.089 -8.147 1.00 46.89 C
|
|
ATOM 847 O ALA A 104 15.018 32.278 -7.786 1.00 45.71 O
|
|
ATOM 848 N ASN A 105 16.729 30.890 -8.136 1.00 39.30 N
|
|
ATOM 849 CA ASN A 105 15.921 29.730 -7.791 1.00 39.08 C
|
|
ATOM 850 CB ASN A 105 16.581 28.410 -8.223 1.00 48.32 C
|
|
ATOM 851 CG ASN A 105 17.110 27.615 -7.074 1.00 51.65 C
|
|
ATOM 852 OD1 ASN A 105 18.230 27.837 -6.631 1.00 58.36 O
|
|
ATOM 853 ND2 ASN A 105 16.324 26.654 -6.598 1.00 44.32 N
|
|
ATOM 854 C ASN A 105 15.345 29.724 -6.358 1.00 31.77 C
|
|
ATOM 855 O ASN A 105 15.853 30.364 -5.432 1.00 22.85 O
|
|
ATOM 856 N GLN A 106 14.244 29.019 -6.208 1.00 27.48 N
|
|
ATOM 857 CA GLN A 106 13.506 29.019 -4.975 1.00 24.57 C
|
|
ATOM 858 CB GLN A 106 12.072 29.457 -5.271 1.00 26.93 C
|
|
ATOM 859 CG GLN A 106 11.909 30.836 -5.886 1.00 23.61 C
|
|
ATOM 860 CD GLN A 106 11.932 31.939 -4.860 1.00 28.28 C
|
|
ATOM 861 OE1 GLN A 106 12.766 32.830 -4.911 1.00 36.73 O
|
|
ATOM 862 NE2 GLN A 106 11.000 31.896 -3.941 1.00 30.94 N
|
|
ATOM 863 C GLN A 106 13.439 27.609 -4.498 1.00 26.16 C
|
|
ATOM 864 O GLN A 106 13.467 26.686 -5.299 1.00 28.16 O
|
|
ATOM 865 N SER A 107 13.353 27.414 -3.201 1.00 26.72 N
|
|
ATOM 866 CA SER A 107 13.133 26.069 -2.730 1.00 23.41 C
|
|
ATOM 867 CB SER A 107 14.396 25.453 -2.165 1.00 23.77 C
|
|
ATOM 868 OG SER A 107 14.496 25.623 -0.778 1.00 21.05 O
|
|
ATOM 869 C SER A 107 12.009 26.141 -1.737 1.00 24.85 C
|
|
ATOM 870 O SER A 107 11.596 27.231 -1.360 1.00 24.48 O
|
|
ATOM 871 N THR A 108 11.453 24.995 -1.375 1.00 23.44 N
|
|
ATOM 872 CA THR A 108 10.392 24.993 -0.391 1.00 22.94 C
|
|
ATOM 873 CB THR A 108 9.757 23.615 -0.292 1.00 25.50 C
|
|
ATOM 874 OG1 THR A 108 10.728 22.678 0.194 1.00 17.11 O
|
|
ATOM 875 CG2 THR A 108 9.394 23.104 -1.680 1.00 27.98 C
|
|
ATOM 876 C THR A 108 10.982 25.349 0.957 1.00 22.35 C
|
|
ATOM 877 O THR A 108 12.147 25.063 1.215 1.00 22.11 O
|
|
ATOM 878 N LEU A 109 10.175 25.935 1.833 1.00 20.46 N
|
|
ATOM 879 CA LEU A 109 10.691 26.339 3.137 1.00 18.55 C
|
|
ATOM 880 CB LEU A 109 9.585 27.007 3.979 1.00 14.23 C
|
|
ATOM 881 CG LEU A 109 9.830 27.229 5.466 1.00 17.18 C
|
|
ATOM 882 CD1 LEU A 109 11.062 28.098 5.650 1.00 21.47 C
|
|
ATOM 883 CD2 LEU A 109 8.617 27.930 6.072 1.00 23.68 C
|
|
ATOM 884 C LEU A 109 11.269 25.121 3.844 1.00 20.25 C
|
|
ATOM 885 O LEU A 109 12.353 25.161 4.422 1.00 24.38 O
|
|
ATOM 886 N GLU A 110 10.547 24.016 3.766 1.00 22.74 N
|
|
ATOM 887 CA GLU A 110 10.995 22.781 4.394 1.00 33.96 C
|
|
ATOM 888 CB GLU A 110 10.042 21.598 4.128 1.00 32.56 C
|
|
ATOM 889 CG GLU A 110 10.331 20.386 4.997 1.00 42.40 C
|
|
ATOM 890 CD GLU A 110 10.317 20.711 6.485 1.00 50.24 C
|
|
ATOM 891 OE1 GLU A 110 9.695 21.733 6.893 1.00 53.67 O
|
|
ATOM 892 OE2 GLU A 110 10.920 19.933 7.255 1.00 49.49 O
|
|
ATOM 893 C GLU A 110 12.403 22.397 3.967 1.00 27.04 C
|
|
ATOM 894 O GLU A 110 13.222 22.031 4.805 1.00 24.80 O
|
|
ATOM 895 N ASN A 111 12.707 22.479 2.675 1.00 23.38 N
|
|
ATOM 896 CA ASN A 111 14.053 22.066 2.271 1.00 23.91 C
|
|
ATOM 897 CB ASN A 111 14.119 21.667 0.783 1.00 29.93 C
|
|
ATOM 898 CG ASN A 111 13.462 20.309 0.497 1.00 30.09 C
|
|
ATOM 899 OD1 ASN A 111 13.409 19.429 1.361 1.00 37.62 O
|
|
ATOM 900 ND2 ASN A 111 12.948 20.142 -0.726 1.00 30.90 N
|
|
ATOM 901 C ASN A 111 15.122 23.077 2.687 1.00 23.18 C
|
|
ATOM 902 O ASN A 111 16.257 22.707 3.017 1.00 29.07 O
|
|
ATOM 903 N PHE A 112 14.762 24.355 2.686 1.00 20.81 N
|
|
ATOM 904 CA PHE A 112 15.697 25.396 3.062 1.00 16.72 C
|
|
ATOM 905 CB PHE A 112 15.073 26.758 2.856 1.00 16.89 C
|
|
ATOM 906 CG PHE A 112 15.823 27.876 3.505 1.00 23.48 C
|
|
ATOM 907 CD1 PHE A 112 15.694 28.135 4.855 1.00 18.59 C
|
|
ATOM 908 CE1 PHE A 112 16.392 29.184 5.439 1.00 27.91 C
|
|
ATOM 909 CZ PHE A 112 17.221 29.963 4.677 1.00 25.73 C
|
|
ATOM 910 CE2 PHE A 112 17.345 29.713 3.336 1.00 30.09 C
|
|
ATOM 911 CD2 PHE A 112 16.654 28.673 2.756 1.00 28.72 C
|
|
ATOM 912 C PHE A 112 16.100 25.230 4.517 1.00 17.61 C
|
|
ATOM 913 O PHE A 112 17.258 25.427 4.876 1.00 17.70 O
|
|
ATOM 914 N LEU A 113 15.128 24.864 5.347 1.00 18.35 N
|
|
ATOM 915 CA LEU A 113 15.353 24.651 6.767 1.00 17.66 C
|
|
ATOM 916 CB LEU A 113 14.025 24.522 7.478 1.00 13.76 C
|
|
ATOM 917 CG LEU A 113 13.056 25.717 7.539 1.00 3.81 C
|
|
ATOM 918 CD1 LEU A 113 11.859 25.249 8.301 1.00 8.05 C
|
|
ATOM 919 CD2 LEU A 113 13.584 27.030 8.224 1.00 10.86 C
|
|
ATOM 920 C LEU A 113 16.260 23.427 7.080 1.00 19.64 C
|
|
ATOM 921 O LEU A 113 17.156 23.500 7.920 1.00 15.44 O
|
|
ATOM 922 N GLU A 114 16.045 22.308 6.407 1.00 20.14 N
|
|
ATOM 923 CA GLU A 114 16.899 21.137 6.638 1.00 20.25 C
|
|
ATOM 924 CB GLU A 114 16.407 19.966 5.827 1.00 21.07 C
|
|
ATOM 925 CG GLU A 114 15.165 19.279 6.371 1.00 31.94 C
|
|
ATOM 926 CD GLU A 114 15.383 18.486 7.665 1.00 38.16 C
|
|
ATOM 927 OE1 GLU A 114 16.451 18.595 8.323 1.00 37.35 O
|
|
ATOM 928 OE2 GLU A 114 14.447 17.736 8.034 1.00 40.82 O
|
|
ATOM 929 C GLU A 114 18.341 21.434 6.230 1.00 23.47 C
|
|
ATOM 930 O GLU A 114 19.300 20.956 6.835 1.00 18.05 O
|
|
ATOM 931 N ARG A 115 18.492 22.235 5.188 1.00 23.09 N
|
|
ATOM 932 CA ARG A 115 19.821 22.563 4.726 1.00 25.61 C
|
|
ATOM 933 CB ARG A 115 19.753 23.204 3.354 1.00 24.30 C
|
|
ATOM 934 CG ARG A 115 21.078 23.270 2.629 1.00 26.48 C
|
|
ATOM 935 CD ARG A 115 21.928 21.988 2.678 1.00 39.38 C
|
|
ATOM 936 NE ARG A 115 23.316 22.371 2.419 1.00 46.23 N
|
|
ATOM 937 CZ ARG A 115 24.389 21.584 2.480 1.00 44.97 C
|
|
ATOM 938 NH1 ARG A 115 24.270 20.298 2.786 1.00 40.74 N
|
|
ATOM 939 NH2 ARG A 115 25.591 22.115 2.227 1.00 41.42 N
|
|
ATOM 940 C ARG A 115 20.512 23.436 5.757 1.00 24.03 C
|
|
ATOM 941 O ARG A 115 21.651 23.136 6.160 1.00 16.83 O
|
|
ATOM 942 N LEU A 116 19.773 24.428 6.251 1.00 15.13 N
|
|
ATOM 943 CA LEU A 116 20.293 25.354 7.241 1.00 19.06 C
|
|
ATOM 944 CB LEU A 116 19.237 26.390 7.647 1.00 16.80 C
|
|
ATOM 945 CG LEU A 116 19.648 27.511 8.617 1.00 14.67 C
|
|
ATOM 946 CD1 LEU A 116 20.891 28.196 8.217 1.00 16.98 C
|
|
ATOM 947 CD2 LEU A 116 18.553 28.568 8.763 1.00 23.25 C
|
|
ATOM 948 C LEU A 116 20.659 24.506 8.430 1.00 18.59 C
|
|
ATOM 949 O LEU A 116 21.677 24.734 9.068 1.00 15.78 O
|
|
ATOM 950 N LYS A 117 19.831 23.503 8.702 1.00 18.28 N
|
|
ATOM 951 CA LYS A 117 20.076 22.662 9.846 1.00 20.46 C
|
|
ATOM 952 CB LYS A 117 18.951 21.648 10.070 1.00 16.36 C
|
|
ATOM 953 CG LYS A 117 19.129 20.892 11.379 1.00 19.01 C
|
|
ATOM 954 CD LYS A 117 18.288 19.629 11.488 1.00 28.33 C
|
|
ATOM 955 CE LYS A 117 16.809 19.840 11.560 1.00 30.98 C
|
|
ATOM 956 NZ LYS A 117 16.072 18.546 11.376 1.00 34.47 N
|
|
ATOM 957 C LYS A 117 21.424 21.965 9.691 1.00 22.47 C
|
|
ATOM 958 O LYS A 117 22.258 21.952 10.614 1.00 18.07 O
|
|
ATOM 959 N THR A 118 21.632 21.396 8.516 1.00 15.39 N
|
|
ATOM 960 CA THR A 118 22.847 20.662 8.237 1.00 17.40 C
|
|
ATOM 961 CB THR A 118 22.823 20.125 6.811 1.00 16.99 C
|
|
ATOM 962 OG1 THR A 118 21.866 19.065 6.709 1.00 18.04 O
|
|
ATOM 963 CG2 THR A 118 24.156 19.477 6.465 1.00 15.22 C
|
|
ATOM 964 C THR A 118 23.986 21.661 8.376 1.00 18.38 C
|
|
ATOM 965 O THR A 118 24.968 21.427 9.045 1.00 19.78 O
|
|
ATOM 966 N ILE A 119 23.842 22.792 7.732 1.00 13.51 N
|
|
ATOM 967 CA ILE A 119 24.874 23.780 7.867 1.00 22.03 C
|
|
ATOM 968 CB ILE A 119 24.515 25.005 7.082 1.00 17.77 C
|
|
ATOM 969 CG1 ILE A 119 24.692 24.688 5.600 1.00 22.51 C
|
|
ATOM 970 CD1 ILE A 119 24.262 25.774 4.666 1.00 32.06 C
|
|
ATOM 971 CG2 ILE A 119 25.420 26.167 7.520 1.00 13.81 C
|
|
ATOM 972 C ILE A 119 25.155 24.155 9.338 1.00 24.28 C
|
|
ATOM 973 O ILE A 119 26.307 24.271 9.730 1.00 18.31 O
|
|
ATOM 974 N MET A 120 24.112 24.356 10.138 1.00 14.52 N
|
|
ATOM 975 CA MET A 120 24.330 24.759 11.508 1.00 18.24 C
|
|
ATOM 976 CB MET A 120 23.019 25.128 12.177 1.00 15.01 C
|
|
ATOM 977 CG MET A 120 22.341 26.402 11.624 1.00 16.48 C
|
|
ATOM 978 SD MET A 120 23.460 27.796 11.374 1.00 22.77 S
|
|
ATOM 979 CE MET A 120 24.067 28.037 13.052 1.00 24.21 C
|
|
ATOM 980 C MET A 120 24.966 23.660 12.317 1.00 20.17 C
|
|
ATOM 981 O MET A 120 25.847 23.912 13.138 1.00 17.52 O
|
|
ATOM 982 N ARG A 121 24.496 22.439 12.103 1.00 13.18 N
|
|
ATOM 983 CA ARG A 121 25.032 21.311 12.832 1.00 16.07 C
|
|
ATOM 984 CB ARG A 121 24.328 20.006 12.452 1.00 11.27 C
|
|
ATOM 985 CG ARG A 121 22.982 19.812 13.092 1.00 30.15 C
|
|
ATOM 986 CD ARG A 121 22.345 18.453 12.880 1.00 34.72 C
|
|
ATOM 987 NE ARG A 121 22.525 17.606 14.059 1.00 47.34 N
|
|
ATOM 988 CZ ARG A 121 22.743 16.289 14.041 1.00 53.05 C
|
|
ATOM 989 NH1 ARG A 121 22.816 15.611 12.898 1.00 52.36 N
|
|
ATOM 990 NH2 ARG A 121 22.875 15.642 15.189 1.00 56.35 N
|
|
ATOM 991 C ARG A 121 26.528 21.129 12.528 1.00 14.78 C
|
|
ATOM 992 O ARG A 121 27.312 20.681 13.369 1.00 20.99 O
|
|
ATOM 993 N GLU A 122 26.912 21.457 11.301 1.00 17.70 N
|
|
ATOM 994 CA GLU A 122 28.293 21.313 10.878 1.00 18.48 C
|
|
ATOM 995 CB GLU A 122 28.428 21.438 9.343 1.00 19.63 C
|
|
ATOM 996 CG GLU A 122 29.822 21.767 8.827 1.00 26.98 C
|
|
ATOM 997 CD GLU A 122 30.773 20.583 8.913 1.00 33.19 C
|
|
ATOM 998 OE1 GLU A 122 30.333 19.505 9.389 1.00 27.84 O
|
|
ATOM 999 OE2 GLU A 122 31.963 20.736 8.517 1.00 31.72 O
|
|
ATOM 1000 C GLU A 122 29.095 22.357 11.652 1.00 24.34 C
|
|
ATOM 1001 O GLU A 122 30.181 22.101 12.113 1.00 20.00 O
|
|
ATOM 1002 N LYS A 123 28.553 23.540 11.841 1.00 27.09 N
|
|
ATOM 1003 CA LYS A 123 29.287 24.492 12.656 1.00 32.04 C
|
|
ATOM 1004 CB LYS A 123 28.682 25.870 12.564 1.00 35.38 C
|
|
ATOM 1005 CG LYS A 123 28.986 26.562 11.266 1.00 47.97 C
|
|
ATOM 1006 CD LYS A 123 28.106 27.767 11.127 1.00 54.01 C
|
|
ATOM 1007 CE LYS A 123 27.972 28.450 12.474 1.00 63.35 C
|
|
ATOM 1008 NZ LYS A 123 29.142 29.301 12.825 1.00 63.66 N
|
|
ATOM 1009 C LYS A 123 29.391 24.041 14.114 1.00 26.45 C
|
|
ATOM 1010 O LYS A 123 30.415 24.248 14.754 1.00 21.23 O
|
|
ATOM 1011 N TYR A 124 28.334 23.426 14.638 1.00 23.40 N
|
|
ATOM 1012 CA TYR A 124 28.353 23.003 16.033 1.00 18.27 C
|
|
ATOM 1013 CB TYR A 124 27.015 22.395 16.415 1.00 13.05 C
|
|
ATOM 1014 CG TYR A 124 26.869 21.949 17.857 1.00 11.53 C
|
|
ATOM 1015 CD1 TYR A 124 27.461 20.774 18.286 1.00 10.62 C
|
|
ATOM 1016 CE1 TYR A 124 27.358 20.352 19.559 1.00 13.06 C
|
|
ATOM 1017 CZ TYR A 124 26.641 21.077 20.456 1.00 17.54 C
|
|
ATOM 1018 OH TYR A 124 26.580 20.599 21.751 1.00 15.90 O
|
|
ATOM 1019 CE2 TYR A 124 26.029 22.257 20.066 1.00 12.68 C
|
|
ATOM 1020 CD2 TYR A 124 26.163 22.690 18.780 1.00 9.90 C
|
|
ATOM 1021 C TYR A 124 29.504 21.993 16.192 1.00 21.38 C
|
|
ATOM 1022 O TYR A 124 30.356 22.109 17.083 1.00 14.33 O
|
|
ATOM 1023 N SER A 125 29.508 21.024 15.281 1.00 21.61 N
|
|
ATOM 1024 CA SER A 125 30.477 19.942 15.225 1.00 25.37 C
|
|
ATOM 1025 CB SER A 125 30.138 19.032 14.039 1.00 27.54 C
|
|
ATOM 1026 OG SER A 125 31.166 18.118 13.752 1.00 28.66 O
|
|
ATOM 1027 C SER A 125 31.876 20.493 15.155 1.00 25.03 C
|
|
ATOM 1028 O SER A 125 32.724 20.051 15.900 1.00 30.33 O
|
|
ATOM 1029 N LYS A 126 32.086 21.493 14.308 1.00 24.20 N
|
|
ATOM 1030 CA LYS A 126 33.355 22.185 14.193 1.00 25.26 C
|
|
ATOM 1031 CB LYS A 126 33.379 23.111 12.975 1.00 29.91 C
|
|
ATOM 1032 CG LYS A 126 33.821 22.490 11.673 1.00 42.88 C
|
|
ATOM 1033 CD LYS A 126 35.326 22.622 11.468 1.00 49.37 C
|
|
ATOM 1034 CE LYS A 126 35.804 21.679 10.385 1.00 53.02 C
|
|
ATOM 1035 NZ LYS A 126 35.348 20.294 10.680 1.00 54.75 N
|
|
ATOM 1036 C LYS A 126 33.640 23.011 15.420 1.00 29.06 C
|
|
ATOM 1037 O LYS A 126 34.697 23.604 15.514 1.00 34.14 O
|
|
ATOM 1038 N CYS A 127 32.729 23.085 16.369 1.00 28.24 N
|
|
ATOM 1039 CA CYS A 127 33.074 23.840 17.554 1.00 19.40 C
|
|
ATOM 1040 CB CYS A 127 31.897 24.670 18.021 1.00 26.36 C
|
|
ATOM 1041 SG CYS A 127 31.756 26.240 17.184 1.00 19.31 S
|
|
ATOM 1042 C CYS A 127 33.509 22.934 18.652 1.00 20.53 C
|
|
ATOM 1043 O CYS A 127 34.358 23.307 19.446 1.00 28.76 O
|
|
ATOM 1044 N SER A 128 32.944 21.732 18.717 1.00 23.29 N
|
|
ATOM 1045 CA SER A 128 33.263 20.858 19.828 1.00 27.85 C
|
|
ATOM 1046 CB SER A 128 32.036 20.159 20.348 1.00 26.09 C
|
|
ATOM 1047 OG SER A 128 31.393 19.547 19.274 1.00 26.90 O
|
|
ATOM 1048 C SER A 128 34.263 19.814 19.431 1.00 37.49 C
|
|
ATOM 1049 O SER A 128 34.687 19.730 18.277 1.00 40.22 O
|
|
ATOM 1050 N SER A 129 34.622 19.009 20.415 1.00 36.60 N
|
|
ATOM 1051 CA SER A 129 35.639 17.989 20.250 1.00 36.92 C
|
|
ATOM 1052 CB SER A 129 36.071 17.510 21.625 1.00 30.21 C
|
|
ATOM 1053 OG SER A 129 34.910 17.230 22.368 1.00 26.18 O
|
|
ATOM 1054 C SER A 129 35.149 16.805 19.412 1.00 38.45 C
|
|
ATOM 1055 O SER A 129 33.946 16.494 19.402 1.00 39.04 O
|
|
ATOM 1056 OXT SER A 129 35.966 16.164 18.743 1.00 31.03 O
|
|
ATOM 1057 S SUL X 1 9.401 41.699 12.824 1.00 32.50 S
|
|
ATOM 1058 O1 SUL X 1 9.414 40.906 14.033 1.00 38.91 O
|
|
ATOM 1059 O2 SUL X 1 8.040 42.095 12.632 1.00 42.57 O
|
|
ATOM 1060 O3 SUL X 1 10.343 42.807 12.936 1.00 38.81 O
|
|
ATOM 1061 O4 SUL X 1 9.723 40.893 11.666 1.00 37.92 O
|
|
ATOM 1062 S SUL X 2 3.923 32.852 -2.845 1.00 58.54 S
|
|
ATOM 1063 O1 SUL X 2 5.357 32.601 -2.663 1.00 58.24 O
|
|
ATOM 1064 O2 SUL X 2 3.598 33.052 -4.247 1.00 60.43 O
|
|
ATOM 1065 O3 SUL X 2 3.176 31.694 -2.392 1.00 59.34 O
|
|
ATOM 1066 O4 SUL X 2 3.530 34.048 -2.103 1.00 57.38 O
|
|
ATOM 1067 S SUL X 3 7.897 26.822 23.102 1.00 65.02 S
|
|
ATOM 1068 O1 SUL X 3 7.186 25.590 22.756 1.00 63.53 O
|
|
ATOM 1069 O2 SUL X 3 7.361 27.918 22.306 1.00 64.38 O
|
|
ATOM 1070 O3 SUL X 3 7.673 27.070 24.522 1.00 63.27 O
|
|
ATOM 1071 O4 SUL X 3 9.319 26.648 22.827 1.00 59.81 O
|
|
ATOM 1072 S SUL X 4 10.054 33.515 21.902 1.00 60.48 S
|
|
ATOM 1073 O1 SUL X 4 9.398 34.789 21.614 1.00 62.56 O
|
|
ATOM 1074 O2 SUL X 4 10.997 33.740 22.996 1.00 60.65 O
|
|
ATOM 1075 O3 SUL X 4 9.023 32.517 22.172 1.00 52.06 O
|
|
ATOM 1076 O4 SUL X 4 10.825 33.032 20.778 1.00 58.99 O
|
|
ATOM 1077 S SUL X 5 35.616 34.512 18.374 1.00 92.75 S
|
|
ATOM 1078 O1 SUL X 5 36.209 35.287 19.456 1.00 93.80 O
|
|
ATOM 1079 O2 SUL X 5 36.630 33.751 17.658 1.00 92.78 O
|
|
ATOM 1080 O3 SUL X 5 34.656 33.577 18.938 1.00 96.43 O
|
|
ATOM 1081 O4 SUL X 5 34.971 35.422 17.438 1.00 93.70 O
|
|
ATOM 1082 O24 FRA X 10 6.811 19.220 18.459 1.00 68.52 O
|
|
ATOM 1083 C5 FRA X 10 6.121 20.021 19.105 1.00 67.29 C
|
|
ATOM 1084 N4 FRA X 10 6.624 20.959 19.915 1.00 63.25 N
|
|
ATOM 1085 C3 FRA X 10 8.045 21.168 19.956 1.00 63.63 C
|
|
ATOM 1086 C2 FRA X 10 8.576 21.140 18.532 1.00 62.27 C
|
|
ATOM 1087 S1 FRA X 10 10.274 20.578 18.672 1.00 68.75 S
|
|
ATOM 1088 C7 FRA X 10 4.615 20.052 19.034 1.00 66.70 C
|
|
ATOM 1089 N8 FRA X 10 4.194 21.073 20.003 1.00 63.88 N
|
|
ATOM 1090 C9 FRA X 10 4.018 20.741 21.425 1.00 67.52 C
|
|
ATOM 1091 C10 FRA X 10 3.230 19.439 21.567 1.00 69.43 C
|
|
ATOM 1092 N11 FRA X 10 3.759 18.406 20.701 1.00 68.16 N
|
|
ATOM 1093 C12 FRA X 10 3.913 18.706 19.289 1.00 66.89 C
|
|
ATOM 1094 C13 FRA X 10 3.976 22.375 19.516 1.00 60.24 C
|
|
ATOM 1095 O14 FRA X 10 3.635 23.277 20.257 1.00 66.81 O
|
|
ATOM 1096 C15 FRA X 10 4.184 22.623 18.059 1.00 55.55 C
|
|
ATOM 1097 C16 FRA X 10 5.410 23.079 17.598 1.00 54.44 C
|
|
ATOM 1098 C17 FRA X 10 5.560 23.381 16.253 1.00 52.45 C
|
|
ATOM 1099 C21 FRA X 10 6.756 23.837 15.730 1.00 52.08 C
|
|
ATOM 1100 C18 FRA X 10 4.422 23.214 15.333 1.00 51.39 C
|
|
ATOM 1101 C19 FRA X 10 3.233 22.759 15.843 1.00 51.19 C
|
|
ATOM 1102 C20 FRA X 10 3.120 22.465 17.190 1.00 52.52 C
|
|
ATOM 1103 C24 FRA X 10 4.520 23.514 13.988 1.00 52.23 C
|
|
ATOM 1104 C23 FRA X 10 5.735 23.975 13.510 1.00 54.71 C
|
|
ATOM 1105 C22 FRA X 10 6.825 24.123 14.370 1.00 56.41 C
|
|
ATOM 1106 O HOH W 1 -5.982 27.247 5.752 1.00 10.55 O
|
|
ATOM 1107 O HOH W 2 2.380 33.041 15.905 1.00 21.51 O
|
|
ATOM 1108 O HOH W 3 13.652 26.741 20.261 1.00 33.00 O
|
|
ATOM 1109 O HOH W 4 21.396 20.578 -0.284 1.00 42.66 O
|
|
ATOM 1110 O HOH W 5 -6.394 18.748 11.169 1.00 26.24 O
|
|
ATOM 1111 O HOH W 6 8.871 34.061 18.663 1.00 19.20 O
|
|
ATOM 1112 O HOH W 7 20.912 17.712 17.637 1.00 40.80 O
|
|
ATOM 1113 O HOH W 8 0.988 27.291 8.221 1.00 32.68 O
|
|
ATOM 1114 O HOH W 9 16.714 19.209 20.094 1.00 26.95 O
|
|
ATOM 1115 O HOH W 10 -1.333 33.878 12.537 1.00 29.91 O
|
|
ATOM 1116 O HOH W 11 12.445 22.515 -3.532 1.00 32.83 O
|
|
ATOM 1117 O HOH W 12 16.199 30.989 21.224 1.00 23.01 O
|
|
ATOM 1118 O HOH W 13 1.186 37.587 6.336 1.00 28.61 O
|
|
ATOM 1119 O HOH W 14 14.021 20.642 19.358 1.00 41.66 O
|
|
ATOM 1120 O HOH W 15 0.674 34.692 14.155 1.00 17.28 O
|
|
ATOM 1121 O HOH W 16 6.360 31.899 -0.435 1.00 17.68 O
|
|
ATOM 1122 O HOH W 17 17.548 25.733 0.411 1.00 27.59 O
|
|
ATOM 1123 O HOH W 18 12.699 37.245 22.687 1.00 25.42 O
|
|
ATOM 1124 O HOH W 19 12.223 24.623 20.815 1.00 84.95 O
|
|
ATOM 1125 O HOH W 20 14.556 27.892 22.980 1.00 45.98 O
|
|
ATOM 1126 O HOH W 21 19.394 17.069 13.920 1.00 57.23 O
|
|
ATOM 1127 O HOH W 22 4.387 34.942 16.204 1.00 44.24 O
|
|
ATOM 1128 O HOH W 23 17.966 22.688 -0.386 1.00 38.90 O
|
|
ATOM 1129 O HOH W 24 10.898 34.314 -2.639 1.00 30.89 O
|
|
ATOM 1130 O HOH W 25 11.128 36.075 18.431 1.00 27.59 O
|
|
ATOM 1131 O HOH W 26 26.797 32.574 -6.463 1.00 21.85 O
|
|
ATOM 1132 O HOH W 27 21.468 18.341 4.046 1.00 37.29 O
|
|
ATOM 1133 O HOH W 28 22.522 19.665 19.003 1.00 42.26 O
|
|
ATOM 1134 O HOH W 29 25.960 18.680 9.398 1.00 28.72 O
|
|
ATOM 1135 O HOH W 30 32.012 25.929 14.190 1.00 34.45 O
|
|
ATOM 1136 O HOH W 31 7.650 41.621 10.011 1.00 38.61 O
|
|
ATOM 1137 O HOH W 32 18.865 32.603 22.066 1.00 18.35 O
|
|
ATOM 1138 O HOH W 33 25.164 29.008 -8.205 1.00 32.85 O
|
|
ATOM 1139 O HOH W 34 23.876 19.437 17.538 1.00 42.38 O
|
|
ATOM 1140 O HOH W 35 3.247 40.633 8.652 1.00 27.74 O
|
|
ATOM 1141 O HOH W 36 -8.305 20.255 15.352 1.00 30.33 O
|
|
ATOM 1142 O HOH W 37 0.388 39.992 7.385 1.00 67.11 O
|
|
ATOM 1143 O HOH W 38 32.350 17.365 21.363 1.00 34.59 O
|
|
ATOM 1144 O HOH W 39 24.256 18.813 20.442 1.00 26.47 O
|
|
ATOM 1145 O HOH W 40 18.785 18.278 7.590 1.00 39.92 O
|
|
ATOM 1146 O HOH W 41 13.000 28.276 -8.844 1.00 29.95 O
|
|
ATOM 1147 O HOH W 42 32.898 26.297 11.130 1.00 30.62 O
|
|
ATOM 1148 O HOH W 43 12.307 34.365 -0.198 1.00 29.92 O
|
|
ATOM 1149 O HOH W 44 28.450 17.929 10.784 1.00 28.91 O
|
|
ATOM 1150 O HOH W 45 32.778 17.729 16.994 1.00 22.18 O
|
|
ATOM 1151 O HOH W 46 33.044 22.956 8.138 1.00 12.73 O
|
|
ATOM 1152 O HOH W 47 34.407 18.509 13.171 1.00 34.43 O
|
|
ATOM 1153 O HOH W 48 -0.922 21.425 9.669 1.00 21.06 O
|
|
ATOM 1154 O HOH W 49 -7.824 30.909 11.385 1.00 42.07 O
|
|
ATOM 1155 O HOH W 50 26.071 18.868 15.517 1.00 25.55 O
|
|
ATOM 1156 O HOH W 51 22.374 16.591 2.811 1.00 36.16 O
|
|
ATOM 1157 O HOH W 52 29.509 33.216 14.227 1.00 42.86 O
|
|
ATOM 1158 O HOH W 53 -5.934 26.528 17.943 1.00 34.64 O
|
|
ATOM 1159 O HOH W 54 17.350 20.501 1.587 1.00 86.94 O
|
|
ATOM 1160 O HOH W 55 23.481 16.662 9.393 1.00 24.27 O
|
|
ATOM 1161 O HOH W 56 38.016 23.070 13.909 1.00 50.20 O
|
|
ATOM 1162 O HOH W 57 12.406 18.726 18.730 1.00 37.20 O
|
|
ATOM 1163 O HOH W 58 -7.567 35.933 6.171 1.00 42.87 O
|
|
ATOM 1164 O HOH W 59 13.368 40.163 4.850 1.00 48.67 O
|
|
ATOM 1165 O HOH W 60 4.991 39.582 10.358 1.00 33.91 O
|
|
ATOM 1166 O HOH W 61 25.842 31.268 -8.990 1.00 51.17 O
|
|
ATOM 1167 O HOH W 62 35.719 19.254 15.276 1.00 51.16 O
|
|
ATOM 1168 O HOH W 63 13.989 37.673 -2.516 1.00 36.13 O
|
|
ATOM 1169 O HOH W 64 -0.869 24.061 9.831 1.00 37.46 O
|
|
ATOM 1170 O HOH W 65 9.692 19.970 0.456 1.00 29.42 O
|
|
ATOM 1171 O HOH W 66 14.392 41.641 6.610 1.00 60.66 O
|
|
ATOM 1172 O HOH W 67 11.053 34.321 2.061 1.00 77.52 O
|
|
ATOM 1173 O HOH W 68 7.047 36.375 -0.802 1.00 31.72 O
|
|
ATOM 1174 O HOH W 69 5.764 40.925 12.120 1.00 50.53 O
|
|
ATOM 1175 O HOH W 70 -12.542 23.716 11.377 1.00 53.35 O
|
|
ATOM 1176 O HOH W 71 11.033 41.401 5.194 1.00 56.52 O
|
|
ATOM 1177 O HOH W 72 6.309 35.267 18.042 1.00 27.65 O
|
|
ATOM 1178 O HOH W 73 -3.878 34.383 13.271 1.00 44.15 O
|
|
ATOM 1179 O HOH W 74 20.642 17.292 9.492 1.00 44.60 O
|
|
ATOM 1180 O HOH W 75 -5.732 21.641 18.643 1.00 37.39 O
|
|
ATOM 1181 O HOH W 76 17.959 16.367 4.881 1.00 67.30 O
|
|
ATOM 1182 O HOH W 77 5.401 29.827 -2.697 1.00 27.77 O
|
|
ATOM 1183 O HOH W 78 37.191 17.554 16.725 1.00 30.36 O
|
|
ATOM 1184 O HOH W 79 30.015 32.472 23.492 0.50 26.02 O
|
|
ATOM 1185 O HOH W 80 36.041 28.063 19.889 1.00 38.90 O
|
|
ATOM 1186 O HOH W 81 7.745 35.392 0.868 1.00 30.98 O
|
|
ATOM 1187 O HOH W 82 37.398 20.773 13.665 1.00 43.41 O
|
|
ATOM 1188 O HOH W 83 17.608 15.322 10.101 1.00 62.29 O
|
|
ATOM 1189 O HOH W 85 1.669 33.028 19.181 1.00 43.72 O
|
|
ATOM 1190 O HOH W 86 13.337 31.577 23.028 1.00 44.63 O
|
|
ATOM 1191 O HOH W 87 2.706 23.022 3.371 1.00 28.12 O
|
|
ATOM 1192 O HOH W 88 16.385 42.855 6.304 1.00 35.66 O
|
|
ATOM 1193 O HOH W 89 12.588 46.021 6.371 1.00 54.67 O
|
|
ATOM 1194 O HOH W 90 2.302 37.114 18.020 1.00 34.16 O
|
|
ATOM 1195 O HOH W 91 -5.474 33.596 18.411 1.00 43.94 O
|
|
ATOM 1196 O HOH W 92 15.136 35.469 -6.253 1.00 54.16 O
|
|
ATOM 1197 O HOH W 93 25.165 46.033 9.104 1.00 40.95 O
|
|
ATOM 1198 O HOH W 94 19.120 18.724 2.994 1.00 39.57 O
|
|
ATOM 1199 O HOH W 95 -0.604 28.657 -3.924 1.00 59.86 O
|
|
ATOM 1200 O HOH W 96 -3.206 34.861 16.269 1.00 43.30 O
|
|
ATOM 1201 O HOH W 97 34.048 26.092 20.806 1.00 21.33 O
|
|
ATOM 1202 O HOH W 98 4.798 27.671 -4.307 1.00 36.41 O
|
|
ATOM 1203 O HOH W 99 6.473 23.434 -4.102 1.00 25.02 O
|
|
ATOM 1204 O HOH W 100 -5.362 24.632 19.586 1.00 44.34 O
|
|
ATOM 1205 O HOH W 101 0.162 19.382 17.559 1.00 40.17 O
|
|
ATOM 1206 O HOH W 102 30.289 28.261 14.300 1.00 49.52 O
|
|
ATOM 1207 O HOH W 104 12.911 15.394 20.475 1.00 44.06 O
|
|
ATOM 1208 O HOH W 105 24.448 37.717 -0.130 1.00 36.54 O
|
|
ATOM 1209 O HOH W 107 18.761 42.296 4.434 1.00 35.47 O
|
|
ATOM 1210 O HOH W 108 0.762 34.046 -3.478 1.00 40.63 O
|
|
ATOM 1211 O HOH W 109 29.215 17.194 18.908 1.00 45.76 O
|
|
ATOM 1212 O HOH W 110 24.951 24.824 1.297 1.00 33.95 O
|
|
ATOM 1213 O HOH W 111 12.398 18.118 6.810 1.00 39.44 O
|
|
ATOM 1214 O HOH W 112 5.804 39.441 16.219 1.00 32.60 O
|
|
ATOM 1215 O HOH W 113 4.283 27.777 25.301 1.00 24.50 O
|
|
ATOM 1216 O HOH W 114 10.377 41.580 1.439 1.00 34.26 O
|
|
ATOM 1217 O HOH W 115 6.731 20.318 3.689 1.00 22.79 O
|
|
ATOM 1218 O HOH W 116 13.520 41.819 2.337 1.00 48.04 O
|