ground_truth.pdb

HEADER    ----                                    02-NOV-23   xxxx              
TITLE     ---                                                                   
COMPND    ---
REMARK   3
REMARK   3 REFINEMENT.
REMARK   3   PROGRAM     : REFMAC 5.8.0405   
REMARK   3   AUTHORS     : MURSHUDOV,SKUBAK,LEBEDEV,PANNU,
REMARK   3                 STEINER,NICHOLLS,WINN,LONG,VAGIN
REMARK   3
REMARK   3    REFINEMENT TARGET : MAXIMUM LIKELIHOOD
REMARK   3
REMARK   3  DATA USED IN REFINEMENT.
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) :   0.96
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) :  15.83
REMARK   3   DATA CUTOFF            (SIGMA(F)) : NONE
REMARK   3   COMPLETENESS FOR RANGE        (%) :  89.45
REMARK   3   NUMBER OF REFLECTIONS             :   29557
REMARK   3
REMARK   3  FIT TO DATA USED IN REFINEMENT.
REMARK   3   CROSS-VALIDATION METHOD          : THROUGHOUT
REMARK   3   FREE R VALUE TEST SET SELECTION  : RANDOM
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.16505
REMARK   3   R VALUE            (WORKING SET) :  0.16492
REMARK   3   FREE R VALUE                     :  0.16785
REMARK   3   FREE R VALUE TEST SET SIZE   (%) :  4.7
REMARK   3   FREE R VALUE TEST SET COUNT      :  1444
REMARK   3
REMARK   3  FIT IN THE HIGHEST RESOLUTION BIN.
REMARK   3   TOTAL NUMBER OF BINS USED           :      20
REMARK   3   BIN RESOLUTION RANGE HIGH           :    0.965
REMARK   3   BIN RESOLUTION RANGE LOW            :    0.990
REMARK   3   REFLECTION IN BIN     (WORKING SET) :     1524
REMARK   3   BIN COMPLETENESS (WORKING+TEST) (%) :    63.32
REMARK   3   BIN R VALUE           (WORKING SET) :    0.281
REMARK   3   BIN FREE R VALUE SET COUNT          :       64
REMARK   3   BIN FREE R VALUE                    :    0.278
REMARK   3
REMARK   3  NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.
REMARK   3   ALL ATOMS                :     1164
REMARK   3
REMARK   3  B VALUES.
REMARK   3   FROM WILSON PLOT           (A**2) : NULL
REMARK   3   MEAN B VALUE      (OVERALL, A**2) :   7.641
REMARK   3   OVERALL ANISOTROPIC B VALUE.
REMARK   3    B11 (A**2) :    -0.13
REMARK   3    B22 (A**2) :    -0.12
REMARK   3    B33 (A**2) :     0.25
REMARK   3    B12 (A**2) :    -0.00
REMARK   3    B13 (A**2) :    -0.00
REMARK   3    B23 (A**2) :     0.00
REMARK   3
REMARK   3  ESTIMATED OVERALL COORDINATE ERROR.
REMARK   3   ESU BASED ON R VALUE                            (A):   0.036
REMARK   3   ESU BASED ON FREE R VALUE                       (A):   0.034
REMARK   3   ESU BASED ON MAXIMUM LIKELIHOOD                 (A):   0.028
REMARK   3   ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2):   0.513
REMARK   3
REMARK   3 CORRELATION COEFFICIENTS.
REMARK   3   CORRELATION COEFFICIENT FO-FC      :   0.969
REMARK   3   CORRELATION COEFFICIENT FO-FC FREE :   0.968
REMARK   3
REMARK   3  RMS DEVIATIONS FROM IDEAL VALUES        COUNT    RMS    WEIGHT
REMARK   3   BOND LENGTHS REFINED ATOMS        (A):  1046 ; 0.008 ; 0.011
REMARK   3   BOND LENGTHS OTHERS               (A):   886 ; 0.024 ; 0.016
REMARK   3   BOND ANGLES REFINED ATOMS   (DEGREES):  1420 ; 1.392 ; 1.679
REMARK   3   BOND ANGLES OTHERS          (DEGREES):  2054 ; 1.953 ; 1.590
REMARK   3   TORSION ANGLES, PERIOD 1    (DEGREES):   126 ; 5.137 ; 5.000
REMARK   3   TORSION ANGLES, PERIOD 2    (DEGREES):     6 ; 3.842 ; 5.000
REMARK   3   TORSION ANGLES, PERIOD 3    (DEGREES):   158 ;11.965 ;10.000
REMARK   3   CHIRAL-CENTER RESTRAINTS       (A**3):   134 ; 0.068 ; 0.200
REMARK   3   GENERAL PLANES REFINED ATOMS      (A):  1248 ; 0.005 ; 0.020
REMARK   3   GENERAL PLANES OTHERS             (A):   256 ; 0.002 ; 0.020
REMARK   3
REMARK   3  ISOTROPIC THERMAL FACTOR RESTRAINTS.     COUNT   RMS    WEIGHT
REMARK   3   MAIN-CHAIN BOND REFINED ATOMS  (A**2):   510 ; 0.191 ; 0.672
REMARK   3   MAIN-CHAIN BOND OTHER ATOMS    (A**2):   510 ; 0.191 ; 0.672
REMARK   3   MAIN-CHAIN ANGLE REFINED ATOMS (A**2):   634 ; 0.352 ; 1.206
REMARK   3   MAIN-CHAIN ANGLE OTHER ATOMS (A**2)  :   635 ; 0.352 ; 1.206
REMARK   3   SIDE-CHAIN BOND REFINED ATOMS  (A**2):   536 ; 0.187 ; 0.709
REMARK   3   SIDE-CHAIN BOND OTHER ATOMS  (A**2)  :   537 ; 0.187 ; 0.709
REMARK   3   SIDE-CHAIN ANGLE OTHER ATOMS (A**2)  :   787 ; 0.337 ; 1.291
REMARK   3   LONG RANGE B REFINED ATOMS (A**2)    :   540 ; 0.543 ;   5.56
REMARK   3   LONG RANGE B OTHER ATOMS (A**2)      :   541 ; 0.542 ;   5.57
REMARK   3
REMARK   3  NCS RESTRAINTS STATISTICS
REMARK   3   NUMBER OF NCS GROUPS : NULL
REMARK   3
REMARK   3  TWIN DETAILS
REMARK   3   NUMBER OF TWIN DOMAINS  : NULL
REMARK   3
REMARK   3
REMARK   3  TLS DETAILS
REMARK   3   NUMBER OF TLS GROUPS  : NULL
REMARK   3
REMARK   3
REMARK   3  BULK SOLVENT MODELLING.
REMARK   3   METHOD USED :  MASK
REMARK   3   PARAMETERS FOR MASK CALCULATION
REMARK   3   VDW PROBE RADIUS   :   1.10
REMARK   3   ION PROBE RADIUS   :   1.10
REMARK   3   SHRINKAGE RADIUS   :   0.80
REMARK   3
REMARK   3  OTHER REFINEMENT REMARKS:
REMARK   3  HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT
REMARK   3  U VALUES      : REFINED INDIVIDUALLY
REMARK   3
LINKR        SG ACYS A  12                 SG ACYS A  63     1555   1555disulf
LINKR        SG ACYS A  16                 SG ACYS A  36     1555   1555disulf
LINKR        SG ACYS A  22                 SG ACYS A  46     1555   1555disulf
LINKR        SG ACYS A  26                 SG ACYS A  48     1555   1555disulf
LINKR        SG BCYS B  12                 SG BCYS B  63     1555   1555disulf
LINKR        SG BCYS B  16                 SG BCYS B  36     1555   1555disulf
LINKR        SG BCYS B  22                 SG BCYS B  46     1555   1555disulf
LINKR        SG BCYS B  26                 SG BCYS B  48     1555   1555disulf
CRYST1   45.900   40.700   30.100  90.00  90.00  90.00 P 21 21 21               
SCALE1      0.021786  0.000000  0.000000        0.00000                         
SCALE2     -0.000000  0.024570  0.000000        0.00000                         
SCALE3      0.000000 -0.000000  0.033223        0.00000                         
ATOM      1  N  AVAL A   1      -5.314   0.017  13.098  0.50  7.72           N
ATOM      2  N  BVAL A   1      -4.891   0.068  13.365  0.50  7.49           N
ATOM      3  CA AVAL A   1      -4.864   0.496  11.798  0.50  7.67           C
ATOM      4  CA BVAL A   1      -4.616   0.707  12.085  0.50  7.49           C
ATOM      5  C  AVAL A   1      -3.752   1.523  11.977  0.50  7.49           C
ATOM      6  C  BVAL A   1      -3.461   1.690  12.230  0.50  7.34           C
ATOM      7  O  AVAL A   1      -3.556   2.053  13.074  0.50  7.58           O
ATOM      8  O  BVAL A   1      -3.128   2.109  13.339  0.50  7.39           O
ATOM      9  CB AVAL A   1      -6.030   1.059  10.966  0.50  7.81           C
ATOM     10  CB BVAL A   1      -5.874   1.391  11.507  0.50  7.64           C
ATOM     11  CG1AVAL A   1      -7.018  -0.047  10.630  0.50  7.89           C
ATOM     12  CG1BVAL A   1      -6.972   0.369  11.257  0.50  7.69           C
ATOM     13  CG2AVAL A   1      -6.715   2.204  11.705  0.50  7.87           C
ATOM     14  CG2BVAL A   1      -6.366   2.497  12.435  0.50  7.70           C
ATOM     15  H  AVAL A   1      -6.145   0.168  13.260  0.50  7.70           H
ATOM     16  H  BVAL A   1      -5.653   0.278  13.704  0.50  7.49           H
ATOM     17  H2 AVAL A   1      -4.826   0.469  13.790  0.50  7.70           H
ATOM     18  H2 BVAL A   1      -4.251   0.367  14.014  0.50  7.49           H
ATOM     19  H3 AVAL A   1      -5.159  -0.928  13.164  0.50  7.70           H
ATOM     20  H3 BVAL A   1      -4.828  -0.884  13.269  0.50  7.49           H
ATOM     21  HA AVAL A   1      -4.500  -0.250  11.297  0.50  7.67           H
ATOM     22  HA BVAL A   1      -4.350   0.026  11.447  0.50  7.49           H
ATOM     23  HB AVAL A   1      -5.684   1.415  10.133  0.50  7.81           H
ATOM     24  HB BVAL A   1      -5.642   1.799  10.658  0.50  7.63           H
ATOM     25 HG11AVAL A   1      -7.396  -0.394  11.453  0.50  7.86           H
ATOM     26 HG11BVAL A   1      -7.235  -0.025  12.104  0.50  7.67           H
ATOM     27 HG12AVAL A   1      -6.552  -0.754  10.157  0.50  7.86           H
ATOM     28 HG12BVAL A   1      -6.633  -0.318  10.663  0.50  7.67           H
ATOM     29 HG13AVAL A   1      -7.722   0.317  10.070  0.50  7.86           H
ATOM     30 HG13BVAL A   1      -7.731   0.815  10.850  0.50  7.67           H
ATOM     31 HG21AVAL A   1      -7.419   2.566  11.144  0.50  7.85           H
ATOM     32 HG21BVAL A   1      -7.137   2.926  12.034  0.50  7.68           H
ATOM     33 HG22AVAL A   1      -6.059   2.892  11.899  0.50  7.85           H
ATOM     34 HG22BVAL A   1      -5.654   3.144  12.560  0.50  7.68           H
ATOM     35 HG23AVAL A   1      -7.093   1.865  12.532  0.50  7.85           H
ATOM     36 HG23BVAL A   1      -6.611   2.106  13.289  0.50  7.68           H
ATOM     37  N  ALYS A   2      -3.034   1.811  10.891  0.50  7.25           N
ATOM     38  N  BLYS A   2      -2.854   2.063  11.105  0.50  7.11           N
ATOM     39  CA ALYS A   2      -1.871   2.683  10.951  0.50  7.16           C
ATOM     40  CA BLYS A   2      -1.753   3.016  11.110  0.50  7.03           C
ATOM     41  C  ALYS A   2      -1.667   3.375   9.610  0.50  6.97           C
ATOM     42  C  BLYS A   2      -1.660   3.673   9.741  0.50  6.85           C
ATOM     43  O  ALYS A   2      -2.047   2.856   8.559  0.50  7.00           O
ATOM     44  O  BLYS A   2      -2.238   3.198   8.760  0.50  6.87           O
ATOM     45  CB ALYS A   2      -0.617   1.885  11.310  0.50  7.24           C
ATOM     46  CB BLYS A   2      -0.427   2.336  11.457  0.50  7.10           C
ATOM     47  CG ALYS A   2      -0.291   0.780  10.330  0.50  7.32           C
ATOM     48  CG BLYS A   2      -0.030   1.280  10.453  0.50  7.15           C
ATOM     49  CD ALYS A   2       0.959   0.059  10.765  0.50  7.39           C
ATOM     50  CD BLYS A   2       1.341   0.733  10.733  0.50  7.17           C
ATOM     51  CE ALYS A   2       1.517  -0.787   9.649  0.50  7.41           C
ATOM     52  CE BLYS A   2       1.734  -0.253   9.668  0.50  7.17           C
ATOM     53  NZ ALYS A   2       2.921  -1.164   9.926  0.50  7.42           N
ATOM     54  NZ BLYS A   2       3.130  -0.700   9.836  0.50  7.15           N
ATOM     55  H  ALYS A   2      -3.205   1.510  10.104  0.50  7.29           H
ATOM     56  H  BLYS A   2      -3.064   1.775  10.322  0.50  7.15           H
ATOM     57  HA ALYS A   2      -2.024   3.370  11.617  0.50  7.16           H
ATOM     58  HA BLYS A   2      -1.934   3.704  11.770  0.50  7.03           H
ATOM     59  HB3ALYS A   2      -0.746   1.479  12.181  0.50  7.24           H
ATOM     60  HB3BLYS A   2      -0.509   1.910  12.324  0.50  7.10           H
ATOM     61  HB2ALYS A   2       0.140   2.491  11.335  0.50  7.24           H
ATOM     62  HB2BLYS A   2       0.274   3.006  11.481  0.50  7.10           H
ATOM     63  HG3ALYS A   2      -0.142   1.158   9.449  0.50  7.32           H
ATOM     64  HG3BLYS A   2      -0.026   1.668   9.564  0.50  7.14           H
ATOM     65  HG2ALYS A   2      -1.022   0.144  10.298  0.50  7.32           H
ATOM     66  HG2BLYS A   2      -0.663   0.546  10.492  0.50  7.14           H
ATOM     67  HD3ALYS A   2       0.752  -0.520  11.514  0.50  7.38           H
ATOM     68  HD3BLYS A   2       1.342   0.279  11.591  0.50  7.16           H
ATOM     69  HD2ALYS A   2       1.632   0.708  11.023  0.50  7.38           H
ATOM     70  HD2BLYS A   2       1.986   1.457  10.740  0.50  7.16           H
ATOM     71  HE3ALYS A   2       1.491  -0.286   8.819  0.50  7.41           H
ATOM     72  HE3BLYS A   2       1.650   0.166   8.797  0.50  7.16           H
ATOM     73  HE2ALYS A   2       0.992  -1.598   9.564  0.50  7.41           H
ATOM     74  HE2BLYS A   2       1.156  -1.030   9.720  0.50  7.16           H
ATOM     75  HZ1ALYS A   2       2.962  -1.662  10.662  0.50  7.41           H
ATOM     76  HZ1BLYS A   2       3.222  -1.127  10.611  0.50  7.16           H
ATOM     77  HZ2ALYS A   2       3.415  -0.433  10.044  0.50  7.41           H
ATOM     78  HZ2BLYS A   2       3.678   0.001   9.825  0.50  7.16           H
ATOM     79  HZ3ALYS A   2       3.252  -1.629   9.243  0.50  7.41           H
ATOM     80  HZ3BLYS A   2       3.355  -1.252   9.174  0.50  7.16           H
ATOM     81  N  AASP A   3      -1.048   4.551   9.656  0.50  6.83           N
ATOM     82  N  BASP A   3      -0.920   4.779   9.690  0.50  6.68           N
ATOM     83  CA AASP A   3      -0.649   5.282   8.463  0.50  6.74           C
ATOM     84  CA BASP A   3      -0.615   5.481   8.451  0.50  6.57           C
ATOM     85  C  AASP A   3       0.834   5.049   8.206  0.50  6.50           C
ATOM     86  C  BASP A   3       0.882   5.423   8.180  0.50  6.29           C
ATOM     87  O  AASP A   3       1.585   4.698   9.119  0.50  6.59           O
ATOM     88  O  BASP A   3       1.683   5.340   9.117  0.50  6.26           O
ATOM     89  CB AASP A   3      -0.870   6.789   8.640  0.50  6.90           C
ATOM     90  CB BASP A   3      -1.034   6.959   8.503  0.50  6.73           C
ATOM     91  CG AASP A   3      -2.270   7.152   9.124  0.50  7.03           C
ATOM     92  CG BASP A   3      -2.429   7.175   9.052  0.50  6.85           C
ATOM     93  OD1AASP A   3      -3.260   6.502   8.729  0.50  7.04           O
ATOM     94  OD1BASP A   3      -3.259   6.244   9.015  0.50  6.93           O
ATOM     95  OD2AASP A   3      -2.374   8.136   9.890  0.50  7.30           O
ATOM     96  OD2BASP A   3      -2.689   8.316   9.500  0.50  7.04           O
ATOM     97  H  AASP A   3      -0.844   4.955  10.388  0.50  6.85           H
ATOM     98  H  BASP A   3      -0.573   5.151  10.383  0.50  6.69           H
ATOM     99  HA AASP A   3      -1.178   4.974   7.711  0.50  6.74           H
ATOM    100  HA BASP A   3      -1.096   5.047   7.729  0.50  6.57           H
ATOM    101  HB3AASP A   3      -0.729   7.227   7.786  0.50  6.89           H
ATOM    102  HB3BASP A   3      -1.010   7.323   7.604  0.50  6.72           H
ATOM    103  HB2AASP A   3      -0.235   7.123   9.293  0.50  6.89           H
ATOM    104  HB2BASP A   3      -0.414   7.440   9.073  0.50  6.72           H
ATOM    105  N  AGLY A   4       1.272   5.248   6.971  0.50  6.26           N
ATOM    106  N  BGLY A   4       1.276   5.479   6.912  0.50  6.07           N
ATOM    107  CA AGLY A   4       2.693   5.189   6.696  0.50  6.15           C
ATOM    108  CA BGLY A   4       2.693   5.560   6.618  0.50  5.94           C
ATOM    109  C  AGLY A   4       2.999   4.953   5.232  0.50  6.02           C
ATOM    110  C  BGLY A   4       3.005   5.207   5.176  0.50  5.84           C
ATOM    111  O  AGLY A   4       2.125   4.751   4.387  0.50  5.93           O
ATOM    112  O  BGLY A   4       2.125   5.024   4.336  0.50  5.77           O
ATOM    113  H  AGLY A   4       0.774   5.416   6.290  0.50  6.29           H
ATOM    114  H  BGLY A   4       0.755   5.473   6.227  0.50  6.09           H
ATOM    115  HA3AGLY A   4       3.088   4.466   7.208  0.50  6.15           H
ATOM    116  HA3BGLY A   4       3.176   4.947   7.194  0.50  5.95           H
ATOM    117  HA2AGLY A   4       3.105   6.026   6.960  0.50  6.15           H
ATOM    118  HA2BGLY A   4       3.005   6.463   6.786  0.50  5.95           H
ATOM    119  N  ATYR A   5       4.306   4.971   4.966  0.50  5.99           N
ATOM    120  N  BTYR A   5       4.311   5.146   4.910  0.50  5.82           N
ATOM    121  CA ATYR A   5       4.867   4.716   3.647  0.50  6.05           C
ATOM    122  CA BTYR A   5       4.826   4.766   3.600  0.50  5.88           C
ATOM    123  C  ATYR A   5       4.947   3.212   3.427  0.50  6.01           C
ATOM    124  C  BTYR A   5       4.858   3.248   3.488  0.50  5.81           C
ATOM    125  O  ATYR A   5       5.772   2.530   4.048  0.50  5.94           O
ATOM    126  O  BTYR A   5       5.487   2.575   4.313  0.50  5.76           O
ATOM    127  CB ATYR A   5       6.258   5.332   3.543  0.50  6.18           C
ATOM    128  CB BTYR A   5       6.239   5.300   3.390  0.50  6.04           C
ATOM    129  CG ATYR A   5       6.285   6.839   3.455  0.50  6.31           C
ATOM    130  CG BTYR A   5       6.392   6.801   3.465  0.50  6.21           C
ATOM    131  CD1ATYR A   5       6.059   7.480   2.247  0.50  6.40           C
ATOM    132  CD1BTYR A   5       6.839   7.413   4.625  0.50  6.36           C
ATOM    133  CD2ATYR A   5       6.559   7.618   4.573  0.50  6.44           C
ATOM    134  CD2BTYR A   5       6.121   7.600   2.366  0.50  6.31           C
ATOM    135  CE1ATYR A   5       6.093   8.856   2.153  0.50  6.47           C
ATOM    136  CE1BTYR A   5       6.998   8.783   4.694  0.50  6.43           C
ATOM    137  CE2ATYR A   5       6.596   8.997   4.489  0.50  6.51           C
ATOM    138  CE2BTYR A   5       6.276   8.972   2.425  0.50  6.39           C
ATOM    139  CZ ATYR A   5       6.367   9.611   3.274  0.50  6.52           C
ATOM    140  CZ BTYR A   5       6.714   9.559   3.588  0.50  6.46           C
ATOM    141  OH ATYR A   5       6.400  10.983   3.177  0.50  6.71           O
ATOM    142  OH BTYR A   5       6.869  10.926   3.644  0.50  6.67           O
ATOM    143  H  ATYR A   5       4.908   5.135   5.558  0.50  6.01           H
ATOM    144  H  BTYR A   5       4.927   5.324   5.483  0.50  5.84           H
ATOM    145  HA ATYR A   5       4.290   5.108   2.972  0.50  6.05           H
ATOM    146  HA BTYR A   5       4.239   5.139   2.923  0.50  5.88           H
ATOM    147  HB3ATYR A   5       6.688   4.987   2.744  0.50  6.18           H
ATOM    148  HB3BTYR A   5       6.541   5.024   2.511  0.50  6.04           H
ATOM    149  HB2ATYR A   5       6.766   5.078   4.329  0.50  6.18           H
ATOM    150  HB2BTYR A   5       6.813   4.919   4.073  0.50  6.04           H
ATOM    151  HD1ATYR A   5       5.883   6.974   1.487  0.50  6.40           H
ATOM    152  HD1BTYR A   5       7.036   6.892   5.370  0.50  6.34           H
ATOM    153  HD2ATYR A   5       6.721   7.205   5.390  0.50  6.42           H
ATOM    154  HD2BTYR A   5       5.831   7.206   1.575  0.50  6.31           H
ATOM    155  HE1ATYR A   5       5.931   9.272   1.337  0.50  6.46           H
ATOM    156  HE1BTYR A   5       7.295   9.181   5.480  0.50  6.42           H
ATOM    157  HE2ATYR A   5       6.773   9.508   5.246  0.50  6.49           H
ATOM    158  HE2BTYR A   5       6.084   9.496   1.680  0.50  6.39           H
ATOM    159  N  AILE A   6       4.098   2.691   2.539  0.50  6.05           N
ATOM    160  N  BILE A   6       4.214   2.709   2.455  0.50  5.79           N
ATOM    161  CA AILE A   6       4.108   1.264   2.236  0.50  6.12           C
ATOM    162  CA BILE A   6       4.210   1.265   2.255  0.50  5.81           C
ATOM    163  C  AILE A   6       5.452   0.849   1.657  0.50  6.26           C
ATOM    164  C  BILE A   6       5.499   0.828   1.565  0.50  5.89           C
ATOM    165  O  AILE A   6       6.054   1.565   0.849  0.50  6.23           O
ATOM    166  O  BILE A   6       6.169   1.606   0.884  0.50  5.87           O
ATOM    167  CB AILE A   6       2.951   0.884   1.291  0.50  6.08           C
ATOM    168  CB BILE A   6       2.958   0.784   1.494  0.50  5.80           C
ATOM    169  CG1AILE A   6       2.803   1.887   0.128  0.50  6.07           C
ATOM    170  CG1BILE A   6       2.738   1.595   0.211  0.50  5.79           C
ATOM    171  CG2AILE A   6       1.659   0.757   2.088  0.50  6.13           C
ATOM    172  CG2BILE A   6       1.744   0.861   2.408  0.50  5.82           C
ATOM    173  CD1AILE A   6       1.825   1.444  -0.952  0.50  6.06           C
ATOM    174  CD1BILE A   6       1.697   0.999  -0.726  0.50  5.80           C
ATOM    175  H  AILE A   6       3.510   3.141   2.101  0.50  6.06           H
ATOM    176  H  BILE A   6       3.777   3.154   1.863  0.50  5.80           H
ATOM    177  HA AILE A   6       3.979   0.785   3.069  0.50  6.12           H
ATOM    178  HA BILE A   6       4.185   0.841   3.127  0.50  5.82           H
ATOM    179  HB AILE A   6       3.158   0.026   0.889  0.50  6.10           H
ATOM    180  HB BILE A   6       3.096  -0.138   1.227  0.50  5.80           H
ATOM    181 HG12AILE A   6       3.670   2.008  -0.290  0.50  6.07           H
ATOM    182 HG12BILE A   6       3.577   1.645  -0.274  0.50  5.79           H
ATOM    183 HG13AILE A   6       2.486   2.732   0.485  0.50  6.07           H
ATOM    184 HG13BILE A   6       2.440   2.486   0.453  0.50  5.79           H
ATOM    185 HG21AILE A   6       1.466   1.606   2.515  0.50  6.11           H
ATOM    186 HG21BILE A   6       1.590   1.787   2.652  0.50  5.81           H
ATOM    187 HG22AILE A   6       1.769   0.066   2.760  0.50  6.11           H
ATOM    188 HG22BILE A   6       1.914   0.333   3.204  0.50  5.81           H
ATOM    189 HG23AILE A   6       0.938   0.519   1.484  0.50  6.11           H
ATOM    190 HG23BILE A   6       0.972   0.510   1.937  0.50  5.81           H
ATOM    191 HD11AILE A   6       0.942   1.352  -0.561  0.50  6.07           H
ATOM    192 HD11BILE A   6       0.835   1.001  -0.282  0.50  5.80           H
ATOM    193 HD12AILE A   6       2.118   0.592  -1.313  0.50  6.07           H
ATOM    194 HD12BILE A   6       1.954   0.089  -0.945  0.50  5.80           H
ATOM    195 HD13AILE A   6       1.807   2.112  -1.655  0.50  6.07           H
ATOM    196 HD13BILE A   6       1.655   1.534  -1.533  0.50  5.80           H
ATOM    197  N  AVAL A   7       5.923  -0.332   2.063  0.50  6.51           N
ATOM    198  N  BVAL A   7       5.853  -0.446   1.757  0.50  6.05           N
ATOM    199  CA AVAL A   7       7.151  -0.907   1.530  0.50  6.78           C
ATOM    200  CA BVAL A   7       7.123  -0.983   1.291  0.50  6.21           C
ATOM    201  C  AVAL A   7       6.919  -2.373   1.194  0.50  7.14           C
ATOM    202  C  BVAL A   7       6.945  -2.400   0.772  0.50  6.45           C
ATOM    203  O  AVAL A   7       6.000  -3.015   1.706  0.50  7.11           O
ATOM    204  O  BVAL A   7       5.935  -3.060   1.024  0.50  6.55           O
ATOM    205  CB AVAL A   7       8.348  -0.754   2.496  0.50  6.79           C
ATOM    206  CB BVAL A   7       8.205  -0.994   2.396  0.50  6.20           C
ATOM    207  CG1AVAL A   7       8.699   0.717   2.678  0.50  6.79           C
ATOM    208  CG1BVAL A   7       8.638   0.416   2.740  0.50  6.20           C
ATOM    209  CG2AVAL A   7       8.046  -1.414   3.838  0.50  6.79           C
ATOM    210  CG2BVAL A   7       7.703  -1.724   3.645  0.50  6.21           C
ATOM    211  H  AVAL A   7       5.540  -0.824   2.655  0.50  6.51           H
ATOM    212  H  BVAL A   7       5.361  -1.024   2.162  0.50  6.05           H
ATOM    213  HA AVAL A   7       7.372  -0.447   0.705  0.50  6.79           H
ATOM    214  HA BVAL A   7       7.416  -0.426   0.553  0.50  6.22           H
ATOM    215  HB AVAL A   7       9.120  -1.201   2.114  0.50  6.79           H
ATOM    216  HB BVAL A   7       8.980  -1.473   2.061  0.50  6.20           H
ATOM    217 HG11AVAL A   7       7.963   1.165   3.123  0.50  6.79           H
ATOM    218 HG11BVAL A   7       7.871   0.911   3.068  0.50  6.20           H
ATOM    219 HG12AVAL A   7       8.851   1.116   1.807  0.50  6.79           H
ATOM    220 HG12BVAL A   7       8.990   0.841   1.942  0.50  6.20           H
ATOM    221 HG13AVAL A   7       9.502   0.786   3.217  0.50  6.79           H
ATOM    222 HG13BVAL A   7       9.324   0.377   3.424  0.50  6.20           H
ATOM    223 HG21AVAL A   7       8.827  -1.343   4.408  0.50  6.79           H
ATOM    224 HG21BVAL A   7       8.423  -1.775   4.292  0.50  6.21           H
ATOM    225 HG22AVAL A   7       7.829  -2.347   3.689  0.50  6.79           H
ATOM    226 HG22BVAL A   7       7.419  -2.618   3.395  0.50  6.21           H
ATOM    227 HG23AVAL A   7       7.293  -0.961   4.250  0.50  6.79           H
ATOM    228 HG23BVAL A   7       6.955  -1.232   4.019  0.50  6.21           H
ATOM    229  N  AASP A   8       7.772  -2.902   0.317  0.50  7.58           N
ATOM    230  N  BASP A   8       7.957  -2.864   0.036  0.50  6.72           N
ATOM    231  CA AASP A   8       7.776  -4.329   0.031  0.50  8.01           C
ATOM    232  CA BASP A   8       7.998  -4.256  -0.392  0.50  6.96           C
ATOM    233  C  AASP A   8       8.501  -5.074   1.150  0.50  8.40           C
ATOM    234  C  BASP A   8       8.563  -5.080   0.762  0.50  7.35           C
ATOM    235  O  AASP A   8       8.979  -4.485   2.126  0.50  8.44           O
ATOM    236  O  BASP A   8       8.496  -4.654   1.921  0.50  7.55           O
ATOM    237  CB AASP A   8       8.394  -4.610  -1.340  0.50  8.05           C
ATOM    238  CB BASP A   8       8.779  -4.436  -1.706  0.50  6.86           C
ATOM    239  CG AASP A   8       9.886  -4.326  -1.395  0.50  8.08           C
ATOM    240  CG BASP A   8      10.247  -4.032  -1.614  0.50  6.78           C
ATOM    241  OD1AASP A   8      10.479  -3.945  -0.364  0.50  8.11           O
ATOM    242  OD1BASP A   8      10.749  -3.731  -0.512  0.50  6.70           O
ATOM    243  OD2AASP A   8      10.464  -4.488  -2.493  0.50  8.22           O
ATOM    244  OD2BASP A   8      10.898  -4.019  -2.685  0.50  6.77           O
ATOM    245  H  AASP A   8       8.357  -2.453  -0.125  0.50  7.57           H
ATOM    246  H  BASP A   8       8.627  -2.392  -0.225  0.50  6.71           H
ATOM    247  HA AASP A   8       6.860  -4.645  -0.001  0.50  8.00           H
ATOM    248  HA BASP A   8       7.110  -4.582  -0.606  0.50  6.96           H
ATOM    249  HB3AASP A   8       7.960  -4.049  -2.002  0.50  8.05           H
ATOM    250  HB3BASP A   8       8.366  -3.889  -2.392  0.50  6.86           H
ATOM    251  HB2AASP A   8       8.261  -5.545  -1.559  0.50  8.05           H
ATOM    252  HB2BASP A   8       8.746  -5.371  -1.963  0.50  6.86           H
ATOM    253  N  AASP A   9       8.595  -6.395   1.002  0.50  8.86           N
ATOM    254  N  BASP A   9       9.087  -6.265   0.478  0.50  7.67           N
ATOM    255  CA AASP A   9       9.120  -7.222   2.081  0.50  9.23           C
ATOM    256  CA BASP A   9       9.592  -7.136   1.531  0.50  7.98           C
ATOM    257  C  AASP A   9      10.606  -7.000   2.336  0.50  8.99           C
ATOM    258  C  BASP A   9      11.059  -6.880   1.864  0.50  7.67           C
ATOM    259  O  AASP A   9      11.133  -7.612   3.270  0.50  9.14           O
ATOM    260  O  BASP A   9      11.627  -7.621   2.674  0.50  7.89           O
ATOM    261  CB AASP A   9       8.843  -8.707   1.803  0.50  9.73           C
ATOM    262  CB BASP A   9       9.384  -8.607   1.148  0.50  8.48           C
ATOM    263  CG AASP A   9       9.596  -9.238   0.596  0.50 10.20           C
ATOM    264  CG BASP A   9       7.929  -9.039   1.253  0.50  8.98           C
ATOM    265  OD1AASP A   9      10.218  -8.439  -0.133  0.50 10.71           O
ATOM    266  OD1BASP A   9       7.204  -8.519   2.130  0.50  9.47           O
ATOM    267  OD2AASP A   9       9.566 -10.469   0.380  0.50 10.67           O
ATOM    268  OD2BASP A   9       7.509  -9.905   0.458  0.50  9.51           O
ATOM    269  H  AASP A   9       8.363  -6.828   0.296  0.50  8.84           H
ATOM    270  H  BASP A   9       9.162  -6.586  -0.316  0.50  7.66           H
ATOM    271  HA AASP A   9       8.650  -6.990   2.897  0.50  9.21           H
ATOM    272  HA BASP A   9       9.080  -6.974   2.339  0.50  7.95           H
ATOM    273  HB3AASP A   9       7.894  -8.825   1.639  0.50  9.72           H
ATOM    274  HB3BASP A   9       9.907  -9.167   1.743  0.50  8.47           H
ATOM    275  HB2AASP A   9       9.113  -9.228   2.576  0.50  9.72           H
ATOM    276  HB2BASP A   9       9.671  -8.739   0.231  0.50  8.47           H
ATOM    277  N  AVAL A  10      11.294  -6.159   1.564  0.50  8.68           N
ATOM    278  N  BVAL A  10      11.686  -5.863   1.265  0.50  7.22           N
ATOM    279  CA AVAL A  10      12.674  -5.829   1.886  0.50  8.42           C
ATOM    280  CA BVAL A  10      13.059  -5.511   1.619  0.50  6.92           C
ATOM    281  C  AVAL A  10      12.827  -4.341   2.213  0.50  8.09           C
ATOM    282  C  BVAL A  10      13.174  -4.029   1.981  0.50  6.53           C
ATOM    283  O  AVAL A  10      13.903  -3.776   2.070  0.50  8.07           O
ATOM    284  O  BVAL A  10      14.245  -3.427   1.851  0.50  6.60           O
ATOM    285  CB AVAL A  10      13.637  -6.263   0.763  0.50  8.49           C
ATOM    286  CB BVAL A  10      14.057  -5.900   0.507  0.50  7.02           C
ATOM    287  CG1AVAL A  10      13.672  -7.794   0.686  0.50  8.51           C
ATOM    288  CG1BVAL A  10      14.091  -7.425   0.334  0.50  7.08           C
ATOM    289  CG2AVAL A  10      13.240  -5.665  -0.566  0.50  8.55           C
ATOM    290  CG2BVAL A  10      13.716  -5.216  -0.801  0.50  7.04           C
ATOM    291  H  AVAL A  10      10.984  -5.775   0.860  0.50  8.69           H
ATOM    292  H  BVAL A  10      11.338  -5.367   0.655  0.50  7.25           H
ATOM    293  HA AVAL A  10      12.920  -6.328   2.681  0.50  8.42           H
ATOM    294  HA BVAL A  10      13.288  -6.012   2.417  0.50  6.92           H
ATOM    295  HB AVAL A  10      14.528  -5.936   0.964  0.50  8.49           H
ATOM    296  HB BVAL A  10      14.942  -5.602   0.767  0.50  7.02           H
ATOM    297 HG11AVAL A  10      12.808  -8.115   0.383  0.50  8.50           H
ATOM    298 HG11BVAL A  10      13.226  -7.725   0.015  0.50  7.06           H
ATOM    299 HG12AVAL A  10      13.866  -8.150   1.567  0.50  8.50           H
ATOM    300 HG12BVAL A  10      14.288  -7.835   1.191  0.50  7.06           H
ATOM    301 HG13AVAL A  10      14.362  -8.064   0.061  0.50  8.50           H
ATOM    302 HG13BVAL A  10      14.779  -7.654  -0.309  0.50  7.06           H
ATOM    303 HG21AVAL A  10      13.876  -5.948  -1.242  0.50  8.53           H
ATOM    304 HG21BVAL A  10      14.362  -5.482  -1.475  0.50  7.04           H
ATOM    305 HG22AVAL A  10      13.245  -4.698  -0.491  0.50  8.53           H
ATOM    306 HG22BVAL A  10      13.750  -4.255  -0.673  0.50  7.04           H
ATOM    307 HG23AVAL A  10      12.351  -5.975  -0.798  0.50  8.53           H
ATOM    308 HG23BVAL A  10      12.824  -5.482  -1.074  0.50  7.04           H
ATOM    309  N  AASN A  11      11.732  -3.696   2.627  0.50  7.73           N
ATOM    310  N  BASN A  11      12.066  -3.425   2.417  0.50  6.16           N
ATOM    311  CA AASN A  11      11.764  -2.318   3.127  0.50  7.49           C
ATOM    312  CA BASN A  11      12.024  -2.052   2.932  0.50  5.94           C
ATOM    313  C  AASN A  11      12.007  -1.264   2.036  0.50  7.36           C
ATOM    314  C  BASN A  11      12.139  -0.966   1.856  0.50  5.70           C
ATOM    315  O  AASN A  11      12.636  -0.235   2.295  0.50  7.31           O
ATOM    316  O  BASN A  11      12.500   0.172   2.176  0.50  5.70           O
ATOM    317  CB AASN A  11      12.797  -2.169   4.254  0.50  7.41           C
ATOM    318  CB BASN A  11      13.105  -1.852   4.017  0.50  5.97           C
ATOM    319  CG AASN A  11      12.569  -0.952   5.119  0.50  7.34           C
ATOM    320  CG BASN A  11      12.827  -0.669   4.939  0.50  5.99           C
ATOM    321  OD1AASN A  11      11.440  -0.630   5.483  0.50  7.38           O
ATOM    322  OD1BASN A  11      11.704  -0.475   5.404  0.50  6.04           O
ATOM    323  ND2AASN A  11      13.656  -0.276   5.475  0.50  7.30           N
ATOM    324  ND2BASN A  11      13.868   0.102   5.239  0.50  6.02           N
ATOM    325  H  AASN A  11      10.944  -4.042   2.627  0.50  7.76           H
ATOM    326  H  BASN A  11      11.294  -3.805   2.424  0.50  6.19           H
ATOM    327  HA AASN A  11      10.879  -2.128   3.475  0.50  7.50           H
ATOM    328  HA BASN A  11      11.150  -1.919   3.331  0.50  5.94           H
ATOM    329  HB3AASN A  11      13.680  -2.094   3.862  0.50  7.41           H
ATOM    330  HB3BASN A  11      13.958  -1.697   3.583  0.50  5.97           H
ATOM    331  HB2AASN A  11      12.753  -2.952   4.825  0.50  7.41           H
ATOM    332  HB2BASN A  11      13.151  -2.651   4.564  0.50  5.97           H
ATOM    333 HD21AASN A  11      14.431  -0.540   5.212  0.50  7.31           H
ATOM    334 HD21BASN A  11      14.645  -0.079   4.916  0.50  6.01           H
ATOM    335 HD22AASN A  11      13.584   0.425   5.967  0.50  7.31           H
ATOM    336 HD22BASN A  11      13.765   0.782   5.755  0.50  6.01           H
ATOM    337  N  ACYS A  12      11.469  -1.477   0.834  0.50  7.30           N
ATOM    338  N  BCYS A  12      11.808  -1.263   0.598  0.50  5.50           N
ATOM    339  CA ACYS A  12      11.600  -0.518  -0.262  0.50  7.31           C
ATOM    340  CA BCYS A  12      11.823  -0.274  -0.473  0.50  5.40           C
ATOM    341  C  ACYS A  12      10.259   0.152  -0.546  0.50  6.96           C
ATOM    342  C  BCYS A  12      10.427   0.291  -0.694  0.50  5.32           C
ATOM    343  O  ACYS A  12       9.237  -0.530  -0.657  0.50  6.86           O
ATOM    344  O  BCYS A  12       9.447  -0.456  -0.769  0.50  5.26           O
ATOM    345  CB ACYS A  12      12.110  -1.208  -1.528  0.50  7.69           C
ATOM    346  CB BCYS A  12      12.329  -0.891  -1.774  0.50  5.44           C
ATOM    347  SG ACYS A  12      13.703  -2.037  -1.332  0.50  8.38           S
ATOM    348  SG BCYS A  12      13.987  -0.379  -2.267  0.50  5.47           S
ATOM    349  H  ACYS A  12      11.017  -2.179   0.628  0.50  7.32           H
ATOM    350  H  BCYS A  12      11.568  -2.047   0.339  0.50  5.52           H
ATOM    351  HA ACYS A  12      12.230   0.171   0.000  0.50  7.31           H
ATOM    352  HA BCYS A  12      12.411   0.453  -0.214  0.50  5.41           H
ATOM    353  HB3ACYS A  12      12.209  -0.541  -2.226  0.50  7.72           H
ATOM    354  HB3BCYS A  12      11.723  -0.641  -2.489  0.50  5.44           H
ATOM    355  HB2ACYS A  12      11.462  -1.877  -1.799  0.50  7.72           H
ATOM    356  HB2BCYS A  12      12.342  -1.856  -1.672  0.50  5.44           H
ATOM    357  N  ATHR A  13      10.273   1.481  -0.687  0.50  6.67           N
ATOM    358  N  BTHR A  13      10.347   1.610  -0.815  0.50  5.28           N
ATOM    359  CA ATHR A  13       9.062   2.258  -0.938  0.50  6.51           C
ATOM    360  CA BTHR A  13       9.077   2.293  -0.983  0.50  5.25           C
ATOM    361  C  ATHR A  13       8.568   2.077  -2.378  0.50  6.35           C
ATOM    362  C  BTHR A  13       8.616   2.253  -2.443  0.50  5.23           C
ATOM    363  O  ATHR A  13       9.277   1.583  -3.262  0.50  6.24           O
ATOM    364  O  BTHR A  13       9.380   1.937  -3.362  0.50  5.14           O
ATOM    365  CB ATHR A  13       9.297   3.752  -0.668  0.50  6.53           C
ATOM    366  CB BTHR A  13       9.206   3.733  -0.483  0.50  5.28           C
ATOM    367  OG1ATHR A  13      10.474   4.200  -1.358  0.50  6.57           O
ATOM    368  OG1BTHR A  13      10.433   4.296  -0.966  0.50  5.31           O
ATOM    369  CG2ATHR A  13       9.447   4.025   0.831  0.50  6.53           C
ATOM    370  CG2BTHR A  13       9.204   3.774   1.044  0.50  5.30           C
ATOM    371  H  ATHR A  13      10.984   1.963  -0.639  0.50  6.70           H
ATOM    372  H  BTHR A  13      11.026   2.138  -0.802  0.50  5.28           H
ATOM    373  HA ATHR A  13       8.375   1.935  -0.335  0.50  6.51           H
ATOM    374  HA BTHR A  13       8.388   1.850  -0.463  0.50  5.25           H
ATOM    375  HB ATHR A  13       8.530   4.251  -0.988  0.50  6.53           H
ATOM    376  HB BTHR A  13       8.455   4.256  -0.806  0.50  5.28           H
ATOM    377 HG21ATHR A  13       9.615   4.968   0.982  0.50  6.53           H
ATOM    378 HG21BTHR A  13       9.310   4.688   1.351  0.50  5.30           H
ATOM    379 HG22ATHR A  13      10.188   3.512   1.190  0.50  6.53           H
ATOM    380 HG22BTHR A  13       9.934   3.239   1.391  0.50  5.30           H
ATOM    381 HG23ATHR A  13       8.635   3.772   1.297  0.50  6.53           H
ATOM    382 HG23BTHR A  13       8.366   3.423   1.384  0.50  5.30           H
ATOM    383  N  ATYR A  14       7.322   2.519  -2.600  0.50  6.31           N
ATOM    384  N  BTYR A  14       7.329   2.567  -2.632  0.50  5.31           N
ATOM    385  CA ATYR A  14       6.631   2.434  -3.886  0.50  6.35           C
ATOM    386  CA BTYR A  14       6.665   2.589  -3.934  0.50  5.43           C
ATOM    387  C  ATYR A  14       6.773   3.754  -4.641  0.50  6.29           C
ATOM    388  C  BTYR A  14       6.939   3.911  -4.641  0.50  5.52           C
ATOM    389  O  ATYR A  14       6.146   4.757  -4.273  0.50  6.21           O
ATOM    390  O  BTYR A  14       6.435   4.957  -4.216  0.50  5.53           O
ATOM    391  CB ATYR A  14       5.143   2.162  -3.675  0.50  6.44           C
ATOM    392  CB BTYR A  14       5.153   2.443  -3.775  0.50  5.48           C
ATOM    393  CG ATYR A  14       4.763   0.734  -3.354  0.50  6.60           C
ATOM    394  CG BTYR A  14       4.645   1.045  -3.478  0.50  5.55           C
ATOM    395  CD1ATYR A  14       5.156   0.130  -2.167  0.50  6.70           C
ATOM    396  CD1BTYR A  14       4.986   0.369  -2.315  0.50  5.59           C
ATOM    397  CD2ATYR A  14       3.952   0.011  -4.218  0.50  6.74           C
ATOM    398  CD2BTYR A  14       3.708   0.457  -4.319  0.50  5.61           C
ATOM    399  CE1ATYR A  14       4.777  -1.168  -1.865  0.50  6.84           C
ATOM    400  CE1BTYR A  14       4.453  -0.884  -2.032  0.50  5.64           C
ATOM    401  CE2ATYR A  14       3.569  -1.286  -3.926  0.50  6.86           C
ATOM    402  CE2BTYR A  14       3.173  -0.789  -4.049  0.50  5.64           C
ATOM    403  CZ ATYR A  14       3.986  -1.870  -2.748  0.50  6.93           C
ATOM    404  CZ BTYR A  14       3.547  -1.457  -2.904  0.50  5.66           C
ATOM    405  OH ATYR A  14       3.617  -3.163  -2.447  0.50  7.16           O
ATOM    406  OH BTYR A  14       3.010  -2.697  -2.625  0.50  5.78           O
ATOM    407  H  ATYR A  14       6.838   2.887  -1.992  0.50  6.33           H
ATOM    408  H  BTYR A  14       6.798   2.781  -1.990  0.50  5.32           H
ATOM    409  HA ATYR A  14       7.046   1.722  -4.398  0.50  6.35           H
ATOM    410  HA BTYR A  14       7.026   1.853  -4.454  0.50  5.43           H
ATOM    411  HB3ATYR A  14       4.673   2.407  -4.487  0.50  6.46           H
ATOM    412  HB3BTYR A  14       4.733   2.730  -4.601  0.50  5.49           H
ATOM    413  HB2ATYR A  14       4.837   2.712  -2.936  0.50  6.46           H
ATOM    414  HB2BTYR A  14       4.870   3.012  -3.043  0.50  5.49           H
ATOM    415  HD1ATYR A  14       5.681   0.604  -1.564  0.50  6.71           H
ATOM    416  HD1BTYR A  14       5.579   0.761  -1.715  0.50  5.59           H
ATOM    417  HD2ATYR A  14       3.660   0.407  -5.008  0.50  6.73           H
ATOM    418  HD2BTYR A  14       3.434   0.913  -5.082  0.50  5.60           H
ATOM    419  HE1ATYR A  14       5.056  -1.564  -1.071  0.50  6.83           H
ATOM    420  HE1BTYR A  14       4.706  -1.335  -1.259  0.50  5.63           H
ATOM    421  HE2ATYR A  14       3.035  -1.762  -4.520  0.50  6.84           H
ATOM    422  HE2BTYR A  14       2.565  -1.174  -4.637  0.50  5.64           H
ATOM    423  N  APHE A  15       7.551   3.745  -5.722  0.50  6.33           N
ATOM    424  N  BPHE A  15       7.677   3.876  -5.744  0.50  5.69           N
ATOM    425  CA APHE A  15       7.644   4.916  -6.583  0.50  6.35           C
ATOM    426  CA BPHE A  15       7.843   5.083  -6.535  0.50  5.84           C
ATOM    427  C  APHE A  15       6.268   5.298  -7.121  0.50  6.17           C
ATOM    428  C  BPHE A  15       6.516   5.452  -7.193  0.50  5.79           C
ATOM    429  O  APHE A  15       5.402   4.447  -7.334  0.50  6.24           O
ATOM    430  O  BPHE A  15       5.728   4.583  -7.574  0.50  5.85           O
ATOM    431  CB APHE A  15       8.589   4.657  -7.760  0.50  6.55           C
ATOM    432  CB BPHE A  15       8.897   4.890  -7.619  0.50  6.03           C
ATOM    433  CG APHE A  15       8.566   5.757  -8.779  0.50  6.77           C
ATOM    434  CG BPHE A  15       8.971   6.044  -8.559  0.50  6.22           C
ATOM    435  CD1APHE A  15       9.284   6.924  -8.576  0.50  6.93           C
ATOM    436  CD1BPHE A  15       9.718   7.160  -8.234  0.50  6.35           C
ATOM    437  CD2APHE A  15       7.777   5.652  -9.911  0.50  6.91           C
ATOM    438  CD2BPHE A  15       8.247   6.044  -9.740  0.50  6.33           C
ATOM    439  CE1APHE A  15       9.237   7.956  -9.500  0.50  6.98           C
ATOM    440  CE1BPHE A  15       9.765   8.244  -9.080  0.50  6.42           C
ATOM    441  CE2APHE A  15       7.725   6.676 -10.836  0.50  6.95           C
ATOM    442  CE2BPHE A  15       8.290   7.128 -10.590  0.50  6.41           C
ATOM    443  CZ APHE A  15       8.455   7.831 -10.629  0.50  6.99           C
ATOM    444  CZ BPHE A  15       9.051   8.229 -10.261  0.50  6.44           C
ATOM    445  H  APHE A  15       8.031   3.078  -5.975  0.50  6.32           H
ATOM    446  H  BPHE A  15       8.081   3.181  -6.049  0.50  5.69           H
ATOM    447  HA APHE A  15       7.998   5.655  -6.065  0.50  6.35           H
ATOM    448  HA BPHE A  15       8.137   5.805  -5.958  0.50  5.84           H
ATOM    449  HB3APHE A  15       8.325   3.834  -8.200  0.50  6.55           H
ATOM    450  HB3BPHE A  15       8.679   4.096  -8.133  0.50  6.03           H
ATOM    451  HB2APHE A  15       9.495   4.577  -7.424  0.50  6.55           H
ATOM    452  HB2BPHE A  15       9.766   4.786  -7.201  0.50  6.03           H
ATOM    453  HD1APHE A  15       9.804   7.016  -7.810  0.50  6.90           H
ATOM    454  HD1BPHE A  15      10.194   7.178  -7.435  0.50  6.34           H
ATOM    455  HD2APHE A  15       7.276   4.882 -10.051  0.50  6.88           H
ATOM    456  HD2BPHE A  15       7.728   5.305  -9.962  0.50  6.32           H
ATOM    457  HE1APHE A  15       9.731   8.731  -9.359  0.50  6.97           H
ATOM    458  HE1BPHE A  15      10.278   8.987  -8.856  0.50  6.40           H
ATOM    459  HE2APHE A  15       7.198   6.589 -11.597  0.50  6.95           H
ATOM    460  HE2BPHE A  15       7.806   7.117 -11.384  0.50  6.40           H
ATOM    461  HZ APHE A  15       8.419   8.522 -11.251  0.50  6.98           H
ATOM    462  HZ BPHE A  15       9.083   8.961 -10.834  0.50  6.42           H
ATOM    463  N  ACYS A  16       6.073   6.596  -7.356  0.50  6.01           N
ATOM    464  N  BCYS A  16       6.278   6.752  -7.352  0.50  5.78           N
ATOM    465  CA ACYS A  16       4.789   7.096  -7.821  0.50  5.92           C
ATOM    466  CA BCYS A  16       5.017   7.192  -7.932  0.50  5.79           C
ATOM    467  C  ACYS A  16       4.968   8.393  -8.591  0.50  6.30           C
ATOM    468  C  BCYS A  16       5.136   8.608  -8.472  0.50  6.16           C
ATOM    469  O  ACYS A  16       5.933   9.131  -8.391  0.50  6.32           O
ATOM    470  O  BCYS A  16       6.074   9.346  -8.165  0.50  6.19           O
ATOM    471  CB ACYS A  16       3.836   7.357  -6.651  0.50  5.57           C
ATOM    472  CB BCYS A  16       3.893   7.157  -6.894  0.50  5.54           C
ATOM    473  SG ACYS A  16       4.480   8.465  -5.330  0.50  5.00           S
ATOM    474  SG BCYS A  16       4.206   8.213  -5.456  0.50  5.15           S
ATOM    475  H  ACYS A  16       6.671   7.205  -7.251  0.50  6.02           H
ATOM    476  H  BCYS A  16       6.820   7.383  -7.136  0.50  5.78           H
ATOM    477  HA ACYS A  16       4.414   6.431  -8.420  0.50  5.94           H
ATOM    478  HA BCYS A  16       4.822   6.598  -8.673  0.50  5.81           H
ATOM    479  HB3ACYS A  16       3.625   6.506  -6.235  0.50  5.54           H
ATOM    480  HB3BCYS A  16       3.788   6.247  -6.577  0.50  5.52           H
ATOM    481  HB2ACYS A  16       3.029   7.764  -7.001  0.50  5.54           H
ATOM    482  HB2BCYS A  16       3.072   7.460  -7.313  0.50  5.52           H
ATOM    483  N  AGLY A  17       3.993   8.669  -9.457  0.50  6.78           N
ATOM    484  N  BGLY A  17       4.130   8.975  -9.264  0.50  6.66           N
ATOM    485  CA AGLY A  17       3.903   9.937 -10.152  0.50  7.17           C
ATOM    486  CA BGLY A  17       3.944  10.315  -9.776  0.50  7.06           C
ATOM    487  C  AGLY A  17       2.535  10.590 -10.046  0.50  7.60           C
ATOM    488  C  BGLY A  17       2.508  10.773  -9.573  0.50  7.53           C
ATOM    489  O  AGLY A  17       2.382  11.761 -10.408  0.50  7.80           O
ATOM    490  O  BGLY A  17       2.263  11.954  -9.313  0.50  7.76           O
ATOM    491  H  AGLY A  17       3.361   8.123  -9.659  0.50  6.76           H
ATOM    492  H  BGLY A  17       3.515   8.435  -9.528  0.50  6.63           H
ATOM    493  HA3AGLY A  17       4.098   9.798 -11.092  0.50  7.17           H
ATOM    494  HA3BGLY A  17       4.147  10.334 -10.725  0.50  7.07           H
ATOM    495  HA2AGLY A  17       4.558  10.549  -9.781  0.50  7.17           H
ATOM    496  HA2BGLY A  17       4.537  10.928  -9.314  0.50  7.07           H
ATOM    497  N  AARG A  18       1.535   9.857  -9.547  0.50  7.95           N
ATOM    498  N  BARG A  18       1.555   9.843  -9.670  0.50  8.03           N
ATOM    499  CA AARG A  18       0.159  10.335  -9.506  0.50  8.18           C
ATOM    500  CA BARG A  18       0.128  10.130  -9.602  0.50  8.38           C
ATOM    501  C  AARG A  18      -0.530   9.854  -8.238  0.50  7.88           C
ATOM    502  C  BARG A  18      -0.444   9.782  -8.232  0.50  8.12           C
ATOM    503  O  AARG A  18      -0.416   8.679  -7.867  0.50  7.72           O
ATOM    504  O  BARG A  18      -0.054   8.789  -7.615  0.50  8.14           O
ATOM    505  CB AARG A  18      -0.651   9.832 -10.708  0.50  8.70           C
ATOM    506  CB BARG A  18      -0.641   9.305 -10.635  0.50  8.95           C
ATOM    507  CG AARG A  18      -0.105  10.234 -12.066  0.50  9.20           C
ATOM    508  CG BARG A  18      -0.257   9.521 -12.088  0.50  9.44           C
ATOM    509  CD AARG A  18      -0.824   9.506 -13.205  0.50  9.68           C
ATOM    510  CD BARG A  18      -1.378   9.021 -12.994  0.50  9.89           C
ATOM    511  NE AARG A  18      -0.516   8.076 -13.275  0.50 10.13           N
ATOM    512  NE BARG A  18      -2.622   9.722 -12.702  0.50 10.36           N
ATOM    513  CZ AARG A  18      -1.318   7.082 -12.897  0.50 10.53           C
ATOM    514  CZ BARG A  18      -3.832   9.308 -13.053  0.50 10.74           C
ATOM    515  NH1AARG A  18      -2.518   7.303 -12.375  0.50 10.73           N
ATOM    516  NH1BARG A  18      -4.011   8.197 -13.751  0.50 10.88           N
ATOM    517  NH2AARG A  18      -0.907   5.827 -13.050  0.50 10.70           N
ATOM    518  NH2BARG A  18      -4.891  10.024 -12.686  0.50 10.93           N
ATOM    519  H  AARG A  18       1.635   9.067  -9.222  0.50  7.92           H
ATOM    520  H  BARG A  18       1.721   9.006  -9.781  0.50  7.99           H
ATOM    521  HA AARG A  18       0.175  11.305  -9.507  0.50  8.17           H
ATOM    522  HA BARG A  18       0.008  11.078  -9.768  0.50  8.36           H
ATOM    523  HB3AARG A  18      -1.552  10.186 -10.641  0.50  8.69           H
ATOM    524  HB3BARG A  18      -1.583   9.521 -10.553  0.50  8.93           H
ATOM    525  HB2AARG A  18      -0.672   8.863 -10.680  0.50  8.69           H
ATOM    526  HB2BARG A  18      -0.497   8.366 -10.438  0.50  8.93           H
ATOM    527  HG3AARG A  18       0.838  10.012 -12.110  0.50  9.19           H
ATOM    528  HG3BARG A  18       0.553   9.028 -12.291  0.50  9.43           H
ATOM    529  HG2AARG A  18      -0.227  11.188 -12.190  0.50  9.19           H
ATOM    530  HG2BARG A  18      -0.120  10.467 -12.254  0.50  9.43           H
ATOM    531  HD3AARG A  18      -0.560   9.907 -14.048  0.50  9.67           H
ATOM    532  HD3BARG A  18      -1.515   8.072 -12.847  0.50  9.90           H
ATOM    533  HD2AARG A  18      -1.781   9.597 -13.080  0.50  9.67           H
ATOM    534  HD2BARG A  18      -1.142   9.182 -13.921  0.50  9.90           H
ATOM    535  HE AARG A  18       0.255   7.858 -13.588  0.50 10.11           H
ATOM    536  HE BARG A  18      -2.567  10.462 -12.267  0.50 10.34           H
ATOM    537 HH11AARG A  18      -2.800   8.109 -12.271  0.50 10.67           H
ATOM    538 HH11BARG A  18      -3.333   7.724 -13.988  0.50 10.83           H
ATOM    539 HH12AARG A  18      -3.014   6.640 -12.141  0.50 10.67           H
ATOM    540 HH12BARG A  18      -4.806   7.949 -13.967  0.50 10.83           H
ATOM    541 HH21AARG A  18      -1.415   5.175 -12.811  0.50 10.64           H
ATOM    542 HH21BARG A  18      -5.682   9.767 -12.907  0.50 10.87           H
ATOM    543 HH22AARG A  18      -0.132   5.666 -13.389  0.50 10.64           H
ATOM    544 HH22BARG A  18      -4.786  10.744 -12.228  0.50 10.87           H
ATOM    545  N  AASN A  19      -1.279  10.758  -7.598  0.50  7.65           N
ATOM    546  N  BASN A  19      -1.424  10.572  -7.784  0.50  7.84           N
ATOM    547  CA AASN A  19      -1.967  10.406  -6.359  0.50  7.52           C
ATOM    548  CA BASN A  19      -2.127  10.227  -6.551  0.50  7.65           C
ATOM    549  C  AASN A  19      -2.901   9.217  -6.554  0.50  7.40           C
ATOM    550  C  BASN A  19      -3.038   9.021  -6.749  0.50  7.52           C
ATOM    551  O  AASN A  19      -2.988   8.341  -5.683  0.50  7.39           O
ATOM    552  O  BASN A  19      -3.147   8.166  -5.861  0.50  7.54           O
ATOM    553  CB AASN A  19      -2.749  11.609  -5.830  0.50  7.52           C
ATOM    554  CB BASN A  19      -2.937  11.423  -6.050  0.50  7.65           C
ATOM    555  CG AASN A  19      -1.850  12.722  -5.335  0.50  7.51           C
ATOM    556  CG BASN A  19      -2.066  12.497  -5.428  0.50  7.62           C
ATOM    557  OD1AASN A  19      -0.756  12.477  -4.828  0.50  7.49           O
ATOM    558  OD1BASN A  19      -0.894  12.264  -5.137  0.50  7.60           O
ATOM    559  ND2AASN A  19      -2.312  13.960  -5.480  0.50  7.56           N
ATOM    560  ND2BASN A  19      -2.636  13.680  -5.215  0.50  7.65           N
ATOM    561  H  AASN A  19      -1.401  11.568  -7.858  0.50  7.67           H
ATOM    562  H  BASN A  19      -1.693  11.294  -8.167  0.50  7.86           H
ATOM    563  HA AASN A  19      -1.300  10.160  -5.699  0.50  7.52           H
ATOM    564  HA BASN A  19      -1.467  10.004  -5.875  0.50  7.66           H
ATOM    565  HB3AASN A  19      -3.307  11.323  -5.089  0.50  7.52           H
ATOM    566  HB3BASN A  19      -3.566  11.120  -5.377  0.50  7.64           H
ATOM    567  HB2AASN A  19      -3.302  11.965  -6.543  0.50  7.52           H
ATOM    568  HB2BASN A  19      -3.414  11.818  -6.797  0.50  7.64           H
ATOM    569 HD21AASN A  19      -3.083  14.092  -5.838  0.50  7.55           H
ATOM    570 HD21BASN A  19      -3.460  13.804  -5.428  0.50  7.64           H
ATOM    571 HD22AASN A  19      -1.841  14.628  -5.215  0.50  7.55           H
ATOM    572 HD22BASN A  19      -2.181  14.319  -4.864  0.50  7.64           H
ATOM    573  N  AALA A  20      -3.615   9.168  -7.684  0.50  7.32           N
ATOM    574  N  BALA A  20      -3.701   8.939  -7.905  0.50  7.40           N
ATOM    575  CA AALA A  20      -4.583   8.093  -7.892  0.50  7.29           C
ATOM    576  CA BALA A  20      -4.644   7.851  -8.144  0.50  7.34           C
ATOM    577  C  AALA A  20      -3.903   6.733  -8.001  0.50  7.21           C
ATOM    578  C  BALA A  20      -3.957   6.495  -8.061  0.50  7.20           C
ATOM    579  O  AALA A  20      -4.495   5.713  -7.630  0.50  7.39           O
ATOM    580  O  BALA A  20      -4.525   5.531  -7.531  0.50  7.36           O
ATOM    581  CB AALA A  20      -5.427   8.367  -9.137  0.50  7.32           C
ATOM    582  CB BALA A  20      -5.306   8.027  -9.509  0.50  7.37           C
ATOM    583  H  AALA A  20      -3.558   9.732  -8.330  0.50  7.33           H
ATOM    584  H  BALA A  20      -3.623   9.493  -8.558  0.50  7.41           H
ATOM    585  HA AALA A  20      -5.181   8.068  -7.129  0.50  7.29           H
ATOM    586  HA BALA A  20      -5.334   7.881  -7.464  0.50  7.33           H
ATOM    587  HB3AALA A  20      -4.843   8.427  -9.909  0.50  7.31           H
ATOM    588  HB3BALA A  20      -4.621   8.022 -10.196  0.50  7.37           H
ATOM    589  HB2AALA A  20      -5.905   9.202  -9.017  0.50  7.31           H
ATOM    590  HB2BALA A  20      -5.781   8.872  -9.522  0.50  7.37           H
ATOM    591  HB1AALA A  20      -6.058   7.640  -9.257  0.50  7.31           H
ATOM    592  HB1BALA A  20      -5.926   7.296  -9.656  0.50  7.37           H
ATOM    593  N  ATYR A  21      -2.669   6.696  -8.511  0.50  7.02           N
ATOM    594  N  BTYR A  21      -2.738   6.396  -8.592  0.50  6.99           N
ATOM    595  CA ATYR A  21      -1.914   5.448  -8.539  0.50  6.82           C
ATOM    596  CA BTYR A  21      -1.990   5.150  -8.495  0.50  6.81           C
ATOM    597  C  ATYR A  21      -1.691   4.914  -7.131  0.50  6.45           C
ATOM    598  C  BTYR A  21      -1.774   4.758  -7.039  0.50  6.45           C
ATOM    599  O  ATYR A  21      -1.828   3.710  -6.878  0.50  6.46           O
ATOM    600  O  BTYR A  21      -2.067   3.626  -6.637  0.50  6.38           O
ATOM    601  CB ATYR A  21      -0.578   5.673  -9.245  0.50  6.96           C
ATOM    602  CB BTYR A  21      -0.652   5.288  -9.220  0.50  6.95           C
ATOM    603  CG ATYR A  21       0.396   4.533  -9.069  0.50  7.11           C
ATOM    604  CG BTYR A  21       0.298   4.156  -8.919  0.50  7.07           C
ATOM    605  CD1ATYR A  21       0.249   3.356  -9.788  0.50  7.25           C
ATOM    606  CD1BTYR A  21       0.115   2.907  -9.492  0.50  7.14           C
ATOM    607  CD2ATYR A  21       1.460   4.631  -8.181  0.50  7.21           C
ATOM    608  CD2BTYR A  21       1.367   4.328  -8.049  0.50  7.13           C
ATOM    609  CE1ATYR A  21       1.131   2.308  -9.630  0.50  7.32           C
ATOM    610  CE1BTYR A  21       0.970   1.866  -9.219  0.50  7.18           C
ATOM    611  CE2ATYR A  21       2.351   3.586  -8.016  0.50  7.30           C
ATOM    612  CE2BTYR A  21       2.231   3.288  -7.769  0.50  7.18           C
ATOM    613  CZ ATYR A  21       2.181   2.425  -8.745  0.50  7.36           C
ATOM    614  CZ BTYR A  21       2.026   2.062  -8.359  0.50  7.20           C
ATOM    615  OH ATYR A  21       3.056   1.372  -8.595  0.50  7.56           O
ATOM    616  OH BTYR A  21       2.877   1.021  -8.086  0.50  7.28           O
ATOM    617  H  ATYR A  21      -2.252   7.372  -8.841  0.50  7.01           H
ATOM    618  H  BTYR A  21      -2.329   7.029  -9.007  0.50  7.00           H
ATOM    619  HA ATYR A  21      -2.415   4.783  -9.038  0.50  6.81           H
ATOM    620  HA BTYR A  21      -2.495   4.444  -8.928  0.50  6.80           H
ATOM    621  HB3ATYR A  21      -0.165   6.474  -8.886  0.50  6.96           H
ATOM    622  HB3BTYR A  21      -0.229   6.116  -8.945  0.50  6.94           H
ATOM    623  HB2ATYR A  21      -0.740   5.780 -10.196  0.50  6.96           H
ATOM    624  HB2BTYR A  21      -0.812   5.299 -10.177  0.50  6.94           H
ATOM    625  HD1ATYR A  21      -0.456   3.273 -10.389  0.50  7.23           H
ATOM    626  HD1BTYR A  21      -0.600   2.771 -10.072  0.50  7.13           H
ATOM    627  HD2ATYR A  21       1.575   5.412  -7.689  0.50  7.21           H
ATOM    628  HD2BTYR A  21       1.503   5.157  -7.649  0.50  7.13           H
ATOM    629  HE1ATYR A  21       1.017   1.524 -10.118  0.50  7.31           H
ATOM    630  HE1BTYR A  21       0.836   1.034  -9.613  0.50  7.18           H
ATOM    631  HE2ATYR A  21       3.059   3.665  -7.419  0.50  7.29           H
ATOM    632  HE2BTYR A  21       2.945   3.415  -7.186  0.50  7.17           H
ATOM    633  N  ACYS A  22      -1.346   5.796  -6.195  0.50  6.09           N
ATOM    634  N  BCYS A  22      -1.255   5.685  -6.229  0.50  6.15           N
ATOM    635  CA ACYS A  22      -1.113   5.348  -4.829  0.50  5.85           C
ATOM    636  CA BCYS A  22      -1.042   5.373  -4.819  0.50  5.96           C
ATOM    637  C  ACYS A  22      -2.406   5.008  -4.114  0.50  6.02           C
ATOM    638  C  BCYS A  22      -2.352   5.032  -4.125  0.50  6.17           C
ATOM    639  O  ACYS A  22      -2.410   4.150  -3.227  0.50  6.01           O
ATOM    640  O  BCYS A  22      -2.407   4.097  -3.319  0.50  6.16           O
ATOM    641  CB ACYS A  22      -0.369   6.417  -4.048  0.50  5.52           C
ATOM    642  CB BCYS A  22      -0.370   6.537  -4.092  0.50  5.62           C
ATOM    643  SG ACYS A  22       1.305   6.603  -4.625  0.50  5.04           S
ATOM    644  SG BCYS A  22       1.354   6.875  -4.533  0.50  5.15           S
ATOM    645  H  ACYS A  22      -1.243   6.640  -6.324  0.50  6.12           H
ATOM    646  H  BCYS A  22      -1.025   6.479  -6.465  0.50  6.17           H
ATOM    647  HA ACYS A  22      -0.563   4.549  -4.864  0.50  5.87           H
ATOM    648  HA BCYS A  22      -0.448   4.608  -4.773  0.50  5.97           H
ATOM    649  HB3ACYS A  22      -0.343   6.169  -3.110  0.50  5.50           H
ATOM    650  HB3BCYS A  22      -0.390   6.350  -3.141  0.50  5.60           H
ATOM    651  HB2ACYS A  22      -0.825   7.267  -4.154  0.50  5.50           H
ATOM    652  HB2BCYS A  22      -0.876   7.343  -4.282  0.50  5.60           H
ATOM    653  N  AASN A  23      -3.511   5.660  -4.457  0.50  6.31           N
ATOM    654  N  BASN A  23      -3.416   5.789  -4.397  0.50  6.52           N
ATOM    655  CA AASN A  23      -4.767   5.291  -3.829  0.50  6.62           C
ATOM    656  CA BASN A  23      -4.680   5.468  -3.747  0.50  6.89           C
ATOM    657  C  AASN A  23      -5.121   3.855  -4.195  0.50  6.95           C
ATOM    658  C  BASN A  23      -5.074   4.021  -4.029  0.50  7.20           C
ATOM    659  O  AASN A  23      -5.568   3.078  -3.345  0.50  7.05           O
ATOM    660  O  BASN A  23      -5.497   3.297  -3.120  0.50  7.23           O
ATOM    661  CB AASN A  23      -5.868   6.272  -4.228  0.50  6.67           C
ATOM    662  CB BASN A  23      -5.776   6.440  -4.177  0.50  7.00           C
ATOM    663  CG AASN A  23      -7.047   6.215  -3.289  0.50  6.71           C
ATOM    664  CG BASN A  23      -7.060   6.210  -3.422  0.50  7.12           C
ATOM    665  OD1AASN A  23      -6.989   6.789  -2.197  0.50  6.76           O
ATOM    666  OD1BASN A  23      -7.100   6.326  -2.197  0.50  7.27           O
ATOM    667  ND2AASN A  23      -8.114   5.536  -3.689  0.50  6.77           N
ATOM    668  ND2BASN A  23      -8.123   5.891  -4.146  0.50  7.22           N
ATOM    669  H  AASN A  23      -3.557   6.297  -5.032  0.50  6.31           H
ATOM    670  H  BASN A  23      -3.429   6.464  -4.930  0.50  6.52           H
ATOM    671  HA AASN A  23      -4.689   5.349  -2.864  0.50  6.63           H
ATOM    672  HA BASN A  23      -4.579   5.572  -2.788  0.50  6.89           H
ATOM    673  HB3AASN A  23      -6.181   6.054  -5.120  0.50  6.67           H
ATOM    674  HB3BASN A  23      -5.955   6.322  -5.123  0.50  7.00           H
ATOM    675  HB2AASN A  23      -5.512   7.174  -4.213  0.50  6.67           H
ATOM    676  HB2BASN A  23      -5.482   7.348  -4.006  0.50  7.00           H
ATOM    677 HD21AASN A  23      -8.115   5.150  -4.457  0.50  6.75           H
ATOM    678 HD21BASN A  23      -8.058   5.825  -5.001  0.50  7.19           H
ATOM    679 HD22AASN A  23      -8.805   5.482  -3.180  0.50  6.75           H
ATOM    680 HD22BASN A  23      -8.879   5.750  -3.761  0.50  7.19           H
ATOM    681  N  AGLU A  24      -4.835   3.465  -5.440  0.50  7.35           N
ATOM    682  N  BGLU A  24      -4.897   3.567  -5.273  0.50  7.60           N
ATOM    683  CA AGLU A  24      -5.055   2.088  -5.871  0.50  7.70           C
ATOM    684  CA BGLU A  24      -5.232   2.185  -5.606  0.50  7.99           C
ATOM    685  C  AGLU A  24      -4.192   1.111  -5.078  0.50  7.61           C
ATOM    686  C  BGLU A  24      -4.269   1.202  -4.948  0.50  7.92           C
ATOM    687  O  AGLU A  24      -4.699   0.127  -4.529  0.50  7.75           O
ATOM    688  O  BGLU A  24      -4.695   0.156  -4.445  0.50  8.07           O
ATOM    689  CB AGLU A  24      -4.776   1.963  -7.371  0.50  8.17           C
ATOM    690  CB BGLU A  24      -5.250   1.986  -7.124  0.50  8.45           C
ATOM    691  CG AGLU A  24      -5.829   2.611  -8.248  0.50  8.62           C
ATOM    692  CG BGLU A  24      -5.791   0.621  -7.543  0.50  8.92           C
ATOM    693  CD AGLU A  24      -5.392   2.724  -9.695  0.50  9.06           C
ATOM    694  CD BGLU A  24      -5.702   0.369  -9.037  0.50  9.34           C
ATOM    695  OE1AGLU A  24      -4.321   2.182 -10.044  0.50  9.49           O
ATOM    696  OE1BGLU A  24      -5.412   1.321  -9.791  0.50  9.78           O
ATOM    697  OE2AGLU A  24      -6.118   3.366 -10.483  0.50  9.56           O
ATOM    698  OE2BGLU A  24      -5.920  -0.789  -9.456  0.50  9.80           O
ATOM    699  H  AGLU A  24      -4.513   3.978  -6.051  0.50  7.34           H
ATOM    700  H  BGLU A  24      -4.591   4.032  -5.929  0.50  7.60           H
ATOM    701  HA AGLU A  24      -5.983   1.857  -5.714  0.50  7.70           H
ATOM    702  HA BGLU A  24      -6.124   2.001  -5.273  0.50  7.99           H
ATOM    703  HB3AGLU A  24      -4.736   1.022  -7.603  0.50  8.16           H
ATOM    704  HB3BGLU A  24      -4.345   2.065  -7.462  0.50  8.45           H
ATOM    705  HB2AGLU A  24      -3.926   2.389  -7.566  0.50  8.16           H
ATOM    706  HB2BGLU A  24      -5.814   2.667  -7.524  0.50  8.45           H
ATOM    707  HG3AGLU A  24      -6.011   3.504  -7.918  0.50  8.62           H
ATOM    708  HG3BGLU A  24      -6.725   0.562  -7.287  0.50  8.91           H
ATOM    709  HG2AGLU A  24      -6.638   2.075  -8.219  0.50  8.62           H
ATOM    710  HG2BGLU A  24      -5.280  -0.070  -7.094  0.50  8.91           H
ATOM    711  N  AGLU A  25      -2.880   1.353  -5.014  0.50  7.45           N
ATOM    712  N  BGLU A  25      -2.967   1.505  -4.945  0.50  7.77           N
ATOM    713  CA AGLU A  25      -2.013   0.424  -4.293  0.50  7.38           C
ATOM    714  CA BGLU A  25      -2.014   0.588  -4.321  0.50  7.69           C
ATOM    715  C  AGLU A  25      -2.383   0.365  -2.814  0.50  7.04           C
ATOM    716  C  BGLU A  25      -2.233   0.493  -2.813  0.50  7.32           C
ATOM    717  O  AGLU A  25      -2.460  -0.721  -2.225  0.50  7.03           O
ATOM    718  O  BGLU A  25      -1.959  -0.556  -2.215  0.50  7.34           O
ATOM    719  CB AGLU A  25      -0.545   0.815  -4.481  0.50  7.62           C
ATOM    720  CB BGLU A  25      -0.574   0.999  -4.650  0.50  7.96           C
ATOM    721  CG AGLU A  25      -0.081   0.818  -5.940  0.50  7.81           C
ATOM    722  CG BGLU A  25      -0.205   0.791  -6.114  0.50  8.19           C
ATOM    723  CD AGLU A  25      -0.005  -0.576  -6.554  0.50  7.98           C
ATOM    724  CD BGLU A  25      -0.454  -0.632  -6.590  0.50  8.39           C
ATOM    725  OE1AGLU A  25       0.339  -1.535  -5.832  0.50  8.05           O
ATOM    726  OE1BGLU A  25      -0.179  -1.584  -5.830  0.50  8.58           O
ATOM    727  OE2AGLU A  25      -0.287  -0.713  -7.765  0.50  8.26           O
ATOM    728  OE2BGLU A  25      -0.970  -0.798  -7.714  0.50  8.61           O
ATOM    729  H  AGLU A  25      -2.480   2.027  -5.369  0.50  7.47           H
ATOM    730  H  BGLU A  25      -2.621   2.215  -5.287  0.50  7.79           H
ATOM    731  HA AGLU A  25      -2.125  -0.465  -4.663  0.50  7.37           H
ATOM    732  HA BGLU A  25      -2.146  -0.299  -4.692  0.50  7.68           H
ATOM    733  HB3AGLU A  25       0.009   0.183  -3.996  0.50  7.61           H
ATOM    734  HB3BGLU A  25       0.034   0.469  -4.111  0.50  7.95           H
ATOM    735  HB2AGLU A  25      -0.414   1.709  -4.128  0.50  7.61           H
ATOM    736  HB2BGLU A  25      -0.463   1.941  -4.446  0.50  7.95           H
ATOM    737  HG3AGLU A  25       0.803   1.212  -5.988  0.50  7.80           H
ATOM    738  HG3BGLU A  25       0.738   0.985  -6.232  0.50  8.18           H
ATOM    739  HG2AGLU A  25      -0.706   1.340  -6.467  0.50  7.80           H
ATOM    740  HG2BGLU A  25      -0.738   1.388  -6.662  0.50  8.18           H
ATOM    741  N  ACYS A  26      -2.632   1.521  -2.199  0.50  6.72           N
ATOM    742  N  BCYS A  26      -2.728   1.567  -2.188  0.50  6.97           N
ATOM    743  CA ACYS A  26      -2.995   1.537  -0.787  0.50  6.52           C
ATOM    744  CA BCYS A  26      -3.071   1.514  -0.769  0.50  6.73           C
ATOM    745  C  ACYS A  26      -4.284   0.762  -0.521  0.50  6.84           C
ATOM    746  C  BCYS A  26      -4.293   0.639  -0.528  0.50  6.99           C
ATOM    747  O  ACYS A  26      -4.450   0.185   0.563  0.50  6.87           O
ATOM    748  O  BCYS A  26      -4.275  -0.239   0.342  0.50  7.06           O
ATOM    749  CB ACYS A  26      -3.131   2.982  -0.317  0.50  6.10           C
ATOM    750  CB BCYS A  26      -3.345   2.914  -0.227  0.50  6.30           C
ATOM    751  SG ACYS A  26      -1.587   3.949  -0.339  0.50  5.45           S
ATOM    752  SG BCYS A  26      -1.933   3.996  -0.201  0.50  5.72           S
ATOM    753  H  ACYS A  26      -2.598   2.295  -2.571  0.50  6.75           H
ATOM    754  H  BCYS A  26      -2.872   2.329  -2.560  0.50  6.99           H
ATOM    755  HA ACYS A  26      -2.290   1.113  -0.273  0.50  6.54           H
ATOM    756  HA BCYS A  26      -2.311   1.139  -0.296  0.50  6.74           H
ATOM    757  HB3ACYS A  26      -3.458   2.978   0.596  0.50  6.07           H
ATOM    758  HB3BCYS A  26      -3.668   2.834   0.684  0.50  6.28           H
ATOM    759  HB2ACYS A  26      -3.765   3.434  -0.896  0.50  6.07           H
ATOM    760  HB2BCYS A  26      -4.022   3.332  -0.783  0.50  6.28           H
ATOM    761  N  ATHR A  27      -5.207   0.734  -1.485  0.50  7.17           N
ATOM    762  N  BTHR A  27      -5.378   0.887  -1.272  0.50  7.22           N
ATOM    763  CA ATHR A  27      -6.412  -0.074  -1.306  0.50  7.51           C
ATOM    764  CA BTHR A  27      -6.625   0.166  -1.029  0.50  7.49           C
ATOM    765  C  ATHR A  27      -6.156  -1.553  -1.588  0.50  7.55           C
ATOM    766  C  BTHR A  27      -6.517  -1.315  -1.383  0.50  7.75           C
ATOM    767  O  ATHR A  27      -6.815  -2.410  -0.989  0.50  7.54           O
ATOM    768  O  BTHR A  27      -7.255  -2.126  -0.817  0.50  7.72           O
ATOM    769  CB ATHR A  27      -7.562   0.437  -2.186  0.50  7.75           C
ATOM    770  CB BTHR A  27      -7.793   0.824  -1.780  0.50  7.51           C
ATOM    771  OG1ATHR A  27      -7.169   0.414  -3.563  0.50  8.12           O
ATOM    772  OG1BTHR A  27      -7.513   0.881  -3.183  0.50  7.57           O
ATOM    773  CG2ATHR A  27      -7.965   1.857  -1.788  0.50  7.83           C
ATOM    774  CG2BTHR A  27      -8.035   2.236  -1.248  0.50  7.53           C
ATOM    775  H  ATHR A  27      -5.161   1.161  -2.230  0.50  7.17           H
ATOM    776  H  BTHR A  27      -5.415   1.459  -1.913  0.50  7.23           H
ATOM    777  HA ATHR A  27      -6.697   0.017  -0.383  0.50  7.49           H
ATOM    778  HA BTHR A  27      -6.824   0.223  -0.081  0.50  7.49           H
ATOM    779  HB ATHR A  27      -8.334  -0.137  -2.066  0.50  7.79           H
ATOM    780  HB BTHR A  27      -8.597   0.299  -1.644  0.50  7.52           H
ATOM    781 HG21ATHR A  27      -8.689   2.168  -2.354  0.50  7.81           H
ATOM    782 HG21BTHR A  27      -8.763   2.653  -1.734  0.50  7.53           H
ATOM    783 HG22ATHR A  27      -7.209   2.457  -1.886  0.50  7.81           H
ATOM    784 HG22BTHR A  27      -7.235   2.773  -1.356  0.50  7.53           H
ATOM    785 HG23ATHR A  27      -8.260   1.872  -0.864  0.50  7.81           H
ATOM    786 HG23BTHR A  27      -8.265   2.201  -0.306  0.50  7.53           H
ATOM    787  N  ALYS A  28      -5.213  -1.877  -2.480  0.50  7.66           N
ATOM    788  N  BLYS A  28      -5.612  -1.693  -2.294  0.50  8.10           N
ATOM    789  CA ALYS A  28      -4.843  -3.277  -2.676  0.50  7.84           C
ATOM    790  CA BLYS A  28      -5.357  -3.113  -2.523  0.50  8.45           C
ATOM    791  C  ALYS A  28      -4.360  -3.911  -1.380  0.50  7.93           C
ATOM    792  C  BLYS A  28      -4.896  -3.798  -1.240  0.50  8.53           C
ATOM    793  O  ALYS A  28      -4.564  -5.112  -1.162  0.50  8.01           O
ATOM    794  O  BLYS A  28      -5.213  -4.972  -1.013  0.50  8.56           O
ATOM    795  CB ALYS A  28      -3.742  -3.401  -3.728  0.50  7.95           C
ATOM    796  CB BLYS A  28      -4.318  -3.291  -3.638  0.50  8.73           C
ATOM    797  CG ALYS A  28      -4.188  -3.128  -5.142  0.50  8.04           C
ATOM    798  CG BLYS A  28      -4.852  -3.008  -5.047  0.50  8.99           C
ATOM    799  CD ALYS A  28      -3.035  -3.317  -6.103  0.50  8.17           C
ATOM    800  CD BLYS A  28      -3.759  -2.665  -6.061  0.50  9.26           C
ATOM    801  CE ALYS A  28      -3.417  -2.952  -7.526  0.50  8.25           C
ATOM    802  CE BLYS A  28      -2.825  -3.817  -6.374  0.50  9.45           C
ATOM    803  NZ ALYS A  28      -2.247  -3.005  -8.444  0.50  8.32           N
ATOM    804  NZ BLYS A  28      -2.040  -3.534  -7.614  0.50  9.56           N
ATOM    805  H  ALYS A  28      -4.784  -1.317  -2.973  0.50  7.67           H
ATOM    806  H  BLYS A  28      -5.145  -1.159  -2.779  0.50  8.09           H
ATOM    807  HA ALYS A  28      -5.627  -3.752  -2.991  0.50  7.84           H
ATOM    808  HA BLYS A  28      -6.175  -3.543  -2.818  0.50  8.45           H
ATOM    809  HB3ALYS A  28      -3.391  -4.304  -3.701  0.50  7.95           H
ATOM    810  HB3BLYS A  28      -4.000  -4.207  -3.623  0.50  8.73           H
ATOM    811  HB2ALYS A  28      -3.040  -2.766  -3.515  0.50  7.95           H
ATOM    812  HB2BLYS A  28      -3.581  -2.682  -3.475  0.50  8.73           H
ATOM    813  HG3ALYS A  28      -4.504  -2.213  -5.214  0.50  8.05           H
ATOM    814  HG3BLYS A  28      -5.462  -2.255  -5.005  0.50  8.99           H
ATOM    815  HG2ALYS A  28      -4.898  -3.744  -5.384  0.50  8.05           H
ATOM    816  HG2BLYS A  28      -5.318  -3.795  -5.369  0.50  8.99           H
ATOM    817  HD3ALYS A  28      -2.760  -4.247  -6.093  0.50  8.16           H
ATOM    818  HD3BLYS A  28      -3.222  -1.939  -5.708  0.50  9.24           H
ATOM    819  HD2ALYS A  28      -2.297  -2.750  -5.832  0.50  8.16           H
ATOM    820  HD2BLYS A  28      -4.179  -2.394  -6.892  0.50  9.24           H
ATOM    821  HE3ALYS A  28      -3.773  -2.049  -7.540  0.50  8.25           H
ATOM    822  HE3BLYS A  28      -3.341  -4.626  -6.513  0.50  9.43           H
ATOM    823  HE2ALYS A  28      -4.085  -3.577  -7.849  0.50  8.25           H
ATOM    824  HE2BLYS A  28      -2.205  -3.942  -5.638  0.50  9.43           H
ATOM    825  HZ1ALYS A  28      -1.926  -3.834  -8.481  0.50  8.30           H
ATOM    826  HZ1BLYS A  28      -1.529  -2.816  -7.494  0.50  9.52           H
ATOM    827  HZ2ALYS A  28      -1.607  -2.459  -8.154  0.50  8.30           H
ATOM    828  HZ2BLYS A  28      -2.593  -3.384  -8.296  0.50  9.52           H
ATOM    829  HZ3ALYS A  28      -2.491  -2.754  -9.263  0.50  8.30           H
ATOM    830  HZ3BLYS A  28      -1.521  -4.229  -7.811  0.50  9.52           H
ATOM    831  N  ALEU A  29      -3.701  -3.129  -0.526  0.50  8.01           N
ATOM    832  N  BLEU A  29      -4.164  -3.076  -0.389  0.50  8.66           N
ATOM    833  CA ALEU A  29      -3.209  -3.586   0.766  0.50  8.14           C
ATOM    834  CA BLEU A  29      -3.692  -3.574   0.898  0.50  8.82           C
ATOM    835  C  ALEU A  29      -4.223  -3.378   1.886  0.50  8.16           C
ATOM    836  C  BLEU A  29      -4.717  -3.382   2.014  0.50  8.90           C
ATOM    837  O  ALEU A  29      -3.868  -3.520   3.061  0.50  8.22           O
ATOM    838  O  BLEU A  29      -4.402  -3.636   3.183  0.50  8.95           O
ATOM    839  CB ALEU A  29      -1.899  -2.867   1.099  0.50  8.24           C
ATOM    840  CB BLEU A  29      -2.380  -2.879   1.274  0.50  8.90           C
ATOM    841  CG ALEU A  29      -0.726  -3.286   0.214  0.50  8.39           C
ATOM    842  CG BLEU A  29      -1.266  -2.939   0.224  0.50  9.01           C
ATOM    843  CD1ALEU A  29       0.416  -2.297   0.291  0.50  8.46           C
ATOM    844  CD1BLEU A  29      -0.085  -2.078   0.659  0.50  9.06           C
ATOM    845  CD2ALEU A  29      -0.250  -4.665   0.624  0.50  8.44           C
ATOM    846  CD2BLEU A  29      -0.826  -4.374  -0.039  0.50  9.06           C
ATOM    847  H  ALEU A  29      -3.521  -2.303  -0.681  0.50  8.02           H
ATOM    848  H  BLEU A  29      -3.921  -2.265  -0.543  0.50  8.66           H
ATOM    849  HA ALEU A  29      -3.023  -4.536   0.715  0.50  8.14           H
ATOM    850  HA BLEU A  29      -3.516  -4.524   0.818  0.50  8.82           H
ATOM    851  HB3ALEU A  29      -1.662  -3.063   2.019  0.50  8.25           H
ATOM    852  HB3BLEU A  29      -2.038  -3.294   2.081  0.50  8.91           H
ATOM    853  HB2ALEU A  29      -2.030  -1.913   0.987  0.50  8.25           H
ATOM    854  HB2BLEU A  29      -2.570  -1.942   1.439  0.50  8.91           H
ATOM    855  HG ALEU A  29      -1.025  -3.307  -0.709  0.50  8.39           H
ATOM    856  HG BLEU A  29      -1.607  -2.589  -0.613  0.50  9.01           H
ATOM    857 HD11ALEU A  29       1.027  -2.462  -0.444  0.50  8.44           H
ATOM    858 HD11BLEU A  29       0.525  -1.978  -0.088  0.50  9.05           H
ATOM    859 HD12ALEU A  29       0.878  -2.413   1.136  0.50  8.44           H
ATOM    860 HD12BLEU A  29       0.366  -2.512   1.400  0.50  9.05           H
ATOM    861 HD13ALEU A  29       0.060  -1.397   0.230  0.50  8.44           H
ATOM    862 HD13BLEU A  29      -0.414  -1.208   0.936  0.50  9.05           H
ATOM    863 HD21ALEU A  29      -0.979  -5.296   0.516  0.50  8.42           H
ATOM    864 HD21BLEU A  29      -1.570  -4.868  -0.418  0.50  9.05           H
ATOM    865 HD22ALEU A  29       0.030  -4.639   1.553  0.50  8.42           H
ATOM    866 HD22BLEU A  29      -0.552  -4.780   0.798  0.50  9.05           H
ATOM    867 HD23ALEU A  29       0.496  -4.922   0.061  0.50  8.42           H
ATOM    868 HD23BLEU A  29      -0.082  -4.367  -0.662  0.50  9.05           H
ATOM    869  N  ALYS A  30      -5.466  -3.047   1.538  0.50  8.22           N
ATOM    870  N  BLYS A  30      -5.929  -2.944   1.669  0.50  8.99           N
ATOM    871  CA ALYS A  30      -6.606  -2.909   2.447  0.50  8.29           C
ATOM    872  CA BLYS A  30      -7.058  -2.733   2.583  0.50  9.12           C
ATOM    873  C  ALYS A  30      -6.566  -1.611   3.244  0.50  7.92           C
ATOM    874  C  BLYS A  30      -6.925  -1.452   3.394  0.50  8.85           C
ATOM    875  O  ALYS A  30      -7.211  -1.507   4.293  0.50  8.04           O
ATOM    876  O  BLYS A  30      -7.546  -1.319   4.454  0.50  9.03           O
ATOM    877  CB ALYS A  30      -6.738  -4.115   3.387  0.50  8.69           C
ATOM    878  CB BLYS A  30      -7.290  -3.937   3.504  0.50  9.49           C
ATOM    879  CG ALYS A  30      -7.040  -5.425   2.670  0.50  9.03           C
ATOM    880  CG BLYS A  30      -7.699  -5.165   2.727  0.50  9.85           C
ATOM    881  CD ALYS A  30      -8.343  -5.343   1.881  0.50  9.33           C
ATOM    882  CD BLYS A  30      -7.848  -6.381   3.613  0.50 10.17           C
ATOM    883  CE ALYS A  30      -8.768  -6.703   1.349  0.50  9.56           C
ATOM    884  CE BLYS A  30      -7.888  -7.643   2.774  0.50 10.40           C
ATOM    885  NZ ALYS A  30     -10.014  -6.612   0.537  0.50  9.71           N
ATOM    886  NZ BLYS A  30      -6.637  -7.754   1.966  0.50 10.56           N
ATOM    887  H  ALYS A  30      -5.689  -2.886   0.723  0.50  8.22           H
ATOM    888  H  BLYS A  30      -6.136  -2.750   0.858  0.50  9.00           H
ATOM    889  HA ALYS A  30      -7.413  -2.878   1.910  0.50  8.28           H
ATOM    890  HA BLYS A  30      -7.860  -2.635   2.046  0.50  9.11           H
ATOM    891  HB3ALYS A  30      -7.461  -3.945   4.011  0.50  8.68           H
ATOM    892  HB3BLYS A  30      -7.996  -3.725   4.135  0.50  9.49           H
ATOM    893  HB2ALYS A  30      -5.904  -4.227   3.869  0.50  8.68           H
ATOM    894  HB2BLYS A  30      -6.469  -4.137   3.980  0.50  9.49           H
ATOM    895  HG3ALYS A  30      -7.124  -6.137   3.323  0.50  9.02           H
ATOM    896  HG3BLYS A  30      -7.023  -5.359   2.059  0.50  9.84           H
ATOM    897  HG2ALYS A  30      -6.321  -5.625   2.051  0.50  9.02           H
ATOM    898  HG2BLYS A  30      -8.553  -4.999   2.296  0.50  9.84           H
ATOM    899  HD3ALYS A  30      -8.223  -4.746   1.126  0.50  9.31           H
ATOM    900  HD3BLYS A  30      -8.675  -6.318   4.116  0.50 10.15           H
ATOM    901  HD2ALYS A  30      -9.047  -5.010   2.459  0.50  9.31           H
ATOM    902  HD2BLYS A  30      -7.094  -6.436   4.219  0.50 10.15           H
ATOM    903  HE3ALYS A  30      -8.933  -7.301   2.094  0.50  9.54           H
ATOM    904  HE3BLYS A  30      -8.647  -7.612   2.170  0.50 10.38           H
ATOM    905  HE2ALYS A  30      -8.063  -7.061   0.786  0.50  9.54           H
ATOM    906  HE2BLYS A  30      -7.956  -8.419   3.352  0.50 10.38           H
ATOM    907  HZ1ALYS A  30     -10.118  -5.782   0.230  0.50  9.67           H
ATOM    908  HZ1BLYS A  30      -5.942  -7.465   2.441  0.50 10.51           H
ATOM    909  HZ2ALYS A  30     -10.719  -6.825   1.036  0.50  9.67           H
ATOM    910  HZ2BLYS A  30      -6.706  -7.261   1.228  0.50 10.51           H
ATOM    911  HZ3ALYS A  30      -9.969  -7.171  -0.154  0.50  9.67           H
ATOM    912  HZ3BLYS A  30      -6.497  -8.602   1.736  0.50 10.51           H
ATOM    913  N  AGLY A  31      -5.791  -0.631   2.798  0.50  7.47           N
ATOM    914  N  BGLY A  31      -6.098  -0.520   2.953  0.50  8.44           N
ATOM    915  CA AGLY A  31      -5.816   0.664   3.431  0.50  7.18           C
ATOM    916  CA BGLY A  31      -6.060   0.763   3.604  0.50  8.13           C
ATOM    917  C  AGLY A  31      -7.014   1.461   2.937  0.50  6.85           C
ATOM    918  C  BGLY A  31      -7.258   1.610   3.218  0.50  7.81           C
ATOM    919  O  AGLY A  31      -7.681   1.092   1.971  0.50  6.82           O
ATOM    920  O  BGLY A  31      -8.060   1.226   2.365  0.50  7.92           O
ATOM    921  H  AGLY A  31      -5.247  -0.697   2.134  0.50  7.50           H
ATOM    922  H  BGLY A  31      -5.560  -0.610   2.289  0.50  8.46           H
ATOM    923  HA3AGLY A  31      -5.004   1.150   3.220  0.50  7.17           H
ATOM    924  HA3BGLY A  31      -5.252   1.234   3.349  0.50  8.13           H
ATOM    925  HA2AGLY A  31      -5.881   0.559   4.393  0.50  7.17           H
ATOM    926  HA2BGLY A  31      -6.064   0.640   4.566  0.50  8.13           H
ATOM    927  N  AGLU A  32      -7.289   2.569   3.622  0.50  6.57           N
ATOM    928  N  BGLU A  32      -7.384   2.768   3.862  0.50  7.45           N
ATOM    929  CA AGLU A  32      -8.427   3.412   3.269  0.50  6.43           C
ATOM    930  CA BGLU A  32      -8.487   3.674   3.556  0.50  7.22           C
ATOM    931  C  AGLU A  32      -8.185   4.177   1.974  0.50  6.10           C
ATOM    932  C  BGLU A  32      -8.301   4.351   2.204  0.50  6.82           C
ATOM    933  O  AGLU A  32      -8.984   4.117   1.030  0.50  6.14           O
ATOM    934  O  BGLU A  32      -9.228   4.410   1.385  0.50  6.72           O
ATOM    935  CB AGLU A  32      -8.674   4.426   4.383  0.50  6.59           C
ATOM    936  CB BGLU A  32      -8.576   4.751   4.631  0.50  7.34           C
ATOM    937  CG AGLU A  32      -9.736   5.456   3.994  0.50  6.77           C
ATOM    938  CG BGLU A  32      -9.603   5.826   4.304  0.50  7.51           C
ATOM    939  CD AGLU A  32      -9.636   6.746   4.773  0.50  6.94           C
ATOM    940  CD BGLU A  32      -9.387   7.082   5.111  0.50  7.68           C
ATOM    941  OE1AGLU A  32      -8.626   7.450   4.560  0.50  7.07           O
ATOM    942  OE1BGLU A  32      -8.499   7.870   4.711  0.50  7.96           O
ATOM    943  OE2AGLU A  32     -10.557   7.083   5.543  0.50  7.18           O
ATOM    944  OE2BGLU A  32     -10.079   7.289   6.124  0.50  7.85           O
ATOM    945  H  AGLU A  32      -6.834   2.854   4.294  0.50  6.60           H
ATOM    946  H  BGLU A  32      -6.850   3.050   4.473  0.50  7.48           H
ATOM    947  HA AGLU A  32      -9.199   2.836   3.157  0.50  6.42           H
ATOM    948  HA BGLU A  32      -9.306   3.154   3.538  0.50  7.21           H
ATOM    949  HB3AGLU A  32      -7.848   4.899   4.573  0.50  6.59           H
ATOM    950  HB3BGLU A  32      -7.710   5.179   4.720  0.50  7.35           H
ATOM    951  HB2AGLU A  32      -8.979   3.960   5.177  0.50  6.59           H
ATOM    952  HB2BGLU A  32      -8.830   4.338   5.471  0.50  7.35           H
ATOM    953  HG3AGLU A  32     -10.614   5.077   4.157  0.50  6.77           H
ATOM    954  HG3BGLU A  32     -10.490   5.488   4.501  0.50  7.51           H
ATOM    955  HG2AGLU A  32      -9.636   5.668   3.053  0.50  6.77           H
ATOM    956  HG2BGLU A  32      -9.536   6.055   3.364  0.50  7.51           H
ATOM    957  N  ASER A  33      -7.114   4.966   1.959  0.50  5.80           N
ATOM    958  N  BSER A  33      -7.115   4.899   1.977  0.50  6.51           N
ATOM    959  CA ASER A  33      -6.785   5.860   0.864  0.50  5.57           C
ATOM    960  CA BSER A  33      -6.789   5.679   0.793  0.50  6.30           C
ATOM    961  C  ASER A  33      -5.294   6.136   0.900  0.50  5.37           C
ATOM    962  C  BSER A  33      -5.301   5.989   0.821  0.50  6.01           C
ATOM    963  O  ASER A  33      -4.612   5.831   1.883  0.50  5.29           O
ATOM    964  O  BSER A  33      -4.558   5.444   1.645  0.50  5.92           O
ATOM    965  CB ASER A  33      -7.537   7.178   1.036  0.50  5.56           C
ATOM    966  CB BSER A  33      -7.592   6.977   0.798  0.50  6.38           C
ATOM    967  OG ASER A  33      -7.119   7.815   2.241  0.50  5.62           O
ATOM    968  OG BSER A  33      -7.236   7.759   1.929  0.50  6.53           O
ATOM    969  H  ASER A  33      -6.541   5.001   2.600  0.50  5.81           H
ATOM    970  H  BSER A  33      -6.452   4.829   2.521  0.50  6.53           H
ATOM    971  HA ASER A  33      -7.013   5.442   0.019  0.50  5.57           H
ATOM    972  HA BSER A  33      -7.008   5.172  -0.004  0.50  6.30           H
ATOM    973  HB3ASER A  33      -8.489   7.000   1.082  0.50  5.58           H
ATOM    974  HB3BSER A  33      -8.539   6.767   0.840  0.50  6.40           H
ATOM    975  HB2ASER A  33      -7.343   7.758   0.283  0.50  5.58           H
ATOM    976  HB2BSER A  33      -7.398   7.476  -0.010  0.50  6.40           H
ATOM    977  N  AGLY A  34      -4.796   6.745  -0.173  0.50  5.24           N
ATOM    978  N  BGLY A  34      -4.867   6.891  -0.050  0.50  5.79           N
ATOM    979  CA AGLY A  34      -3.398   7.132  -0.210  0.50  5.19           C
ATOM    980  CA BGLY A  34      -3.497   7.356  -0.003  0.50  5.66           C
ATOM    981  C  AGLY A  34      -3.119   8.125  -1.316  0.50  5.11           C
ATOM    982  C  BGLY A  34      -3.216   8.289  -1.157  0.50  5.55           C
ATOM    983  O  AGLY A  34      -3.951   8.356  -2.200  0.50  5.13           O
ATOM    984  O  BGLY A  34      -4.118   8.682  -1.900  0.50  5.52           O
ATOM    985  H  AGLY A  34      -5.244   6.941  -0.880  0.50  5.26           H
ATOM    986  H  BGLY A  34      -5.345   7.245  -0.671  0.50  5.81           H
ATOM    987  HA3AGLY A  34      -2.848   6.347  -0.355  0.50  5.19           H
ATOM    988  HA3BGLY A  34      -2.891   6.601  -0.056  0.50  5.67           H
ATOM    989  HA2AGLY A  34      -3.152   7.538   0.637  0.50  5.19           H
ATOM    990  HA2BGLY A  34      -3.339   7.830   0.829  0.50  5.67           H
ATOM    991  N  ATYR A  35      -1.918   8.708  -1.251  0.50  5.04           N
ATOM    992  N  BTYR A  35      -1.945   8.636  -1.309  0.50  5.44           N
ATOM    993  CA ATYR A  35      -1.488   9.742  -2.184  0.50  5.03           C
ATOM    994  CA BTYR A  35      -1.562   9.579  -2.346  0.50  5.41           C
ATOM    995  C  ATYR A  35       0.009   9.589  -2.435  0.50  4.97           C
ATOM    996  C  BTYR A  35      -0.068   9.436  -2.587  0.50  5.32           C
ATOM    997  O  ATYR A  35       0.719   8.900  -1.696  0.50  4.88           O
ATOM    998  O  BTYR A  35       0.624   8.679  -1.901  0.50  5.19           O
ATOM    999  CB ATYR A  35      -1.818  11.151  -1.655  0.50  5.09           C
ATOM   1000  CB BTYR A  35      -1.955  11.014  -1.961  0.50  5.50           C
ATOM   1001  CG ATYR A  35      -0.888  11.612  -0.551  0.50  5.15           C
ATOM   1002  CG BTYR A  35      -1.115  11.580  -0.843  0.50  5.60           C
ATOM   1003  CD1ATYR A  35      -1.074  11.201   0.763  0.50  5.20           C
ATOM   1004  CD1BTYR A  35      -1.360  11.244   0.483  0.50  5.69           C
ATOM   1005  CD2ATYR A  35       0.189  12.444  -0.827  0.50  5.22           C
ATOM   1006  CD2BTYR A  35      -0.061  12.437  -1.117  0.50  5.70           C
ATOM   1007  CE1ATYR A  35      -0.215  11.605   1.767  0.50  5.25           C
ATOM   1008  CE1BTYR A  35      -0.582  11.754   1.502  0.50  5.76           C
ATOM   1009  CE2ATYR A  35       1.052  12.853   0.173  0.50  5.24           C
ATOM   1010  CE2BTYR A  35       0.723  12.950  -0.108  0.50  5.75           C
ATOM   1011  CZ ATYR A  35       0.844  12.429   1.466  0.50  5.27           C
ATOM   1012  CZ BTYR A  35       0.463  12.603   1.199  0.50  5.81           C
ATOM   1013  OH ATYR A  35       1.692  12.817   2.476  0.50  5.39           O
ATOM   1014  OH BTYR A  35       1.238  13.116   2.210  0.50  6.02           O
ATOM   1015  H  ATYR A  35      -1.323   8.514  -0.660  0.50  5.05           H
ATOM   1016  H  BTYR A  35      -1.294   8.343  -0.828  0.50  5.46           H
ATOM   1017  HA ATYR A  35      -1.946   9.626  -3.031  0.50  5.03           H
ATOM   1018  HA BTYR A  35      -2.016   9.365  -3.177  0.50  5.41           H
ATOM   1019  HB3ATYR A  35      -2.722  11.150  -1.301  0.50  5.09           H
ATOM   1020  HB3BTYR A  35      -2.880  11.019  -1.671  0.50  5.50           H
ATOM   1021  HB2ATYR A  35      -1.749  11.785  -2.386  0.50  5.09           H
ATOM   1022  HB2BTYR A  35      -1.846  11.588  -2.735  0.50  5.50           H
ATOM   1023  HD1ATYR A  35      -1.789  10.643   0.971  0.50  5.20           H
ATOM   1024  HD1BTYR A  35      -2.060  10.667   0.686  0.50  5.68           H
ATOM   1025  HD2ATYR A  35       0.332  12.732  -1.699  0.50  5.21           H
ATOM   1026  HD2BTYR A  35       0.120  12.670  -1.999  0.50  5.69           H
ATOM   1027  HE1ATYR A  35      -0.353  11.321   2.642  0.50  5.24           H
ATOM   1028  HE1BTYR A  35      -0.760  11.526   2.386  0.50  5.75           H
ATOM   1029  HE2ATYR A  35       1.769  13.411  -0.026  0.50  5.24           H
ATOM   1030  HE2BTYR A  35       1.423  13.528  -0.308  0.50  5.75           H
ATOM   1031  N  ACYS A  36       0.487  10.237  -3.499  0.50  5.03           N
ATOM   1032  N  BCYS A  36       0.414  10.148  -3.598  0.50  5.35           N
ATOM   1033  CA ACYS A  36       1.906  10.226  -3.845  0.50  5.12           C
ATOM   1034  CA BCYS A  36       1.818  10.126  -3.982  0.50  5.43           C
ATOM   1035  C  ACYS A  36       2.587  11.403  -3.161  0.50  5.32           C
ATOM   1036  C  BCYS A  36       2.513  11.318  -3.334  0.50  5.63           C
ATOM   1037  O  ACYS A  36       2.307  12.563  -3.479  0.50  5.40           O
ATOM   1038  O  BCYS A  36       2.288  12.467  -3.730  0.50  5.70           O
ATOM   1039  CB ACYS A  36       2.106  10.294  -5.357  0.50  5.07           C
ATOM   1040  CB BCYS A  36       1.942  10.157  -5.501  0.50  5.37           C
ATOM   1041  SG ACYS A  36       3.851  10.312  -5.888  0.50  4.96           S
ATOM   1042  SG BCYS A  36       3.623  10.076  -6.103  0.50  5.28           S
ATOM   1043  H  ACYS A  36       0.002  10.696  -4.041  0.50  5.03           H
ATOM   1044  H  BCYS A  36      -0.066  10.666  -4.089  0.50  5.36           H
ATOM   1045  HA ACYS A  36       2.301   9.401  -3.522  0.50  5.13           H
ATOM   1046  HA BCYS A  36       2.244   9.319  -3.654  0.50  5.44           H
ATOM   1047  HB3ACYS A  36       1.690  11.106  -5.687  0.50  5.06           H
ATOM   1048  HB3BCYS A  36       1.553  10.984  -5.827  0.50  5.37           H
ATOM   1049  HB2ACYS A  36       1.685   9.519  -5.760  0.50  5.06           H
ATOM   1050  HB2BCYS A  36       1.462   9.398  -5.867  0.50  5.37           H
ATOM   1051  N  AGLN A  37       3.474  11.110  -2.216  0.50  5.56           N
ATOM   1052  N  BGLN A  37       3.347  11.043  -2.329  0.50  5.87           N
ATOM   1053  CA AGLN A  37       4.295  12.146  -1.602  0.50  5.81           C
ATOM   1054  CA BGLN A  37       4.124  12.083  -1.663  0.50  6.13           C
ATOM   1055  C  AGLN A  37       5.473  12.419  -2.526  0.50  6.00           C
ATOM   1056  C  BGLN A  37       5.345  12.396  -2.513  0.50  6.24           C
ATOM   1057  O  AGLN A  37       6.491  11.722  -2.474  0.50  5.94           O
ATOM   1058  O  BGLN A  37       6.240  11.555  -2.668  0.50  6.20           O
ATOM   1059  CB AGLN A  37       4.770  11.718  -0.215  0.50  5.90           C
ATOM   1060  CB BGLN A  37       4.551  11.645  -0.265  0.50  6.28           C
ATOM   1061  CG AGLN A  37       5.577  12.787   0.539  0.50  6.01           C
ATOM   1062  CG BGLN A  37       5.443  12.657   0.463  0.50  6.44           C
ATOM   1063  CD AGLN A  37       4.752  14.010   0.846  0.50  6.10           C
ATOM   1064  CD BGLN A  37       4.732  13.969   0.740  0.50  6.58           C
ATOM   1065  OE1AGLN A  37       3.987  14.014   1.806  0.50  6.16           O
ATOM   1066  OE1BGLN A  37       3.652  13.982   1.329  0.50  6.69           O
ATOM   1067  NE2AGLN A  37       4.884  15.049   0.024  0.50  6.14           N
ATOM   1068  NE2BGLN A  37       5.331  15.077   0.312  0.50  6.65           N
ATOM   1069  H  AGLN A  37       3.618  10.318  -1.913  0.50  5.56           H
ATOM   1070  H  BGLN A  37       3.480  10.254  -2.014  0.50  5.87           H
ATOM   1071  HA AGLN A  37       3.772  12.957  -1.504  0.50  5.81           H
ATOM   1072  HA BGLN A  37       3.574  12.877  -1.577  0.50  6.12           H
ATOM   1073  HB3AGLN A  37       5.336  10.936  -0.310  0.50  5.90           H
ATOM   1074  HB3BGLN A  37       5.046  10.814  -0.337  0.50  6.28           H
ATOM   1075  HB2AGLN A  37       3.993  11.502   0.324  0.50  5.90           H
ATOM   1076  HB2BGLN A  37       3.756  11.511   0.275  0.50  6.28           H
ATOM   1077  HG3AGLN A  37       6.332  13.060  -0.007  0.50  6.01           H
ATOM   1078  HG3BGLN A  37       6.220  12.846  -0.086  0.50  6.44           H
ATOM   1079  HG2AGLN A  37       5.892  12.416   1.378  0.50  6.01           H
ATOM   1080  HG2BGLN A  37       5.721  12.281   1.313  0.50  6.44           H
ATOM   1081 HE21AGLN A  37       5.421  15.002  -0.646  0.50  6.13           H
ATOM   1082 HE21BGLN A  37       6.084  15.027  -0.099  0.50  6.63           H
ATOM   1083 HE22AGLN A  37       4.431  15.767   0.163  0.50  6.13           H
ATOM   1084 HE22BGLN A  37       4.964  15.843   0.447  0.50  6.63           H
ATOM   1085  N  ATRP A  38       5.341  13.433  -3.377  0.50  6.33           N
ATOM   1086  N  BTRP A  38       5.386  13.604  -3.061  0.50  6.48           N
ATOM   1087  CA ATRP A  38       6.478  13.843  -4.180  0.50  6.66           C
ATOM   1088  CA BTRP A  38       6.555  14.056  -3.792  0.50  6.73           C
ATOM   1089  C  ATRP A  38       7.556  14.367  -3.247  0.50  6.72           C
ATOM   1090  C  BTRP A  38       7.621  14.519  -2.811  0.50  6.77           C
ATOM   1091  O  ATRP A  38       7.279  15.069  -2.271  0.50  6.71           O
ATOM   1092  O  BTRP A  38       7.324  15.130  -1.782  0.50  6.68           O
ATOM   1093  CB ATRP A  38       6.083  14.918  -5.197  0.50  6.96           C
ATOM   1094  CB BTRP A  38       6.172  15.181  -4.757  0.50  6.99           C
ATOM   1095  CG ATRP A  38       5.457  14.358  -6.451  0.50  7.26           C
ATOM   1096  CG BTRP A  38       5.581  14.643  -6.031  0.50  7.27           C
ATOM   1097  CD1ATRP A  38       4.247  13.737  -6.552  0.50  7.43           C
ATOM   1098  CD1BTRP A  38       4.378  14.019  -6.173  0.50  7.44           C
ATOM   1099  CD2ATRP A  38       6.010  14.372  -7.776  0.50  7.45           C
ATOM   1100  CD2BTRP A  38       6.179  14.659  -7.335  0.50  7.49           C
ATOM   1101  NE1ATRP A  38       4.014  13.359  -7.853  0.50  7.54           N
ATOM   1102  NE1BTRP A  38       4.187  13.647  -7.483  0.50  7.55           N
ATOM   1103  CE2ATRP A  38       5.079  13.738  -8.624  0.50  7.54           C
ATOM   1104  CE2BTRP A  38       5.281  14.026  -8.215  0.50  7.58           C
ATOM   1105  CE3ATRP A  38       7.200  14.854  -8.326  0.50  7.54           C
ATOM   1106  CE3BTRP A  38       7.388  15.146  -7.841  0.50  7.61           C
ATOM   1107  CZ2ATRP A  38       5.300  13.573  -9.989  0.50  7.64           C
ATOM   1108  CZ2BTRP A  38       5.550  13.874  -9.574  0.50  7.66           C
ATOM   1109  CZ3ATRP A  38       7.416  14.688  -9.687  0.50  7.60           C
ATOM   1110  CZ3BTRP A  38       7.653  14.994  -9.191  0.50  7.68           C
ATOM   1111  CH2ATRP A  38       6.470  14.053 -10.500  0.50  7.65           C
ATOM   1112  CH2BTRP A  38       6.739  14.361 -10.041  0.50  7.70           C
ATOM   1113  H  ATRP A  38       4.620  13.886  -3.502  0.50  6.33           H
ATOM   1114  H  BTRP A  38       4.748  14.180  -3.022  0.50  6.48           H
ATOM   1115  HA ATRP A  38       6.815  13.091  -4.691  0.50  6.66           H
ATOM   1116  HA BTRP A  38       6.925  13.332  -4.322  0.50  6.73           H
ATOM   1117  HB3ATRP A  38       6.878  15.411  -5.456  0.50  6.96           H
ATOM   1118  HB3BTRP A  38       6.965  15.694  -4.981  0.50  6.99           H
ATOM   1119  HB2ATRP A  38       5.441  15.518  -4.786  0.50  6.96           H
ATOM   1120  HB2BTRP A  38       5.515  15.755  -4.334  0.50  6.99           H
ATOM   1121  HD1ATRP A  38       3.664  13.590  -5.843  0.50  7.42           H
ATOM   1122  HD1BTRP A  38       3.773  13.866  -5.483  0.50  7.43           H
ATOM   1123  HE1ATRP A  38       3.313  12.951  -8.136  0.50  7.51           H
ATOM   1124  HE1BTRP A  38       3.494  13.243  -7.792  0.50  7.53           H
ATOM   1125  HE3ATRP A  38       7.833  15.277  -7.792  0.50  7.53           H
ATOM   1126  HE3BTRP A  38       8.002  15.564  -7.281  0.50  7.60           H
ATOM   1127  HZ2ATRP A  38       4.673  13.152 -10.532  0.50  7.62           H
ATOM   1128  HZ2BTRP A  38       4.943  13.457 -10.143  0.50  7.65           H
ATOM   1129  HZ3ATRP A  38       8.205  15.005 -10.065  0.50  7.60           H
ATOM   1130  HZ3BTRP A  38       8.453  15.317  -9.539  0.50  7.67           H
ATOM   1131  HH2ATRP A  38       6.643  13.956 -11.409  0.50  7.64           H
ATOM   1132  HH2BTRP A  38       6.945  14.271 -10.943  0.50  7.68           H
ATOM   1133  N  AALA A  39       8.790  13.984  -3.525  0.50  6.80           N
ATOM   1134  N  BALA A  39       8.867  14.193  -3.117  0.50  6.89           N
ATOM   1135  CA AALA A  39       9.945  14.533  -2.823  0.50  6.91           C
ATOM   1136  CA BALA A  39       9.999  14.709  -2.358  0.50  7.04           C
ATOM   1137  C  AALA A  39       9.970  14.162  -1.336  0.50  6.98           C
ATOM   1138  C  BALA A  39       9.994  14.234  -0.904  0.50  7.14           C
ATOM   1139  O  AALA A  39      10.310  14.993  -0.492  0.50  7.13           O
ATOM   1140  O  BALA A  39      10.268  15.009   0.016  0.50  7.20           O
ATOM   1141  CB AALA A  39      10.053  16.051  -3.013  0.50  6.95           C
ATOM   1142  CB BALA A  39      10.078  16.239  -2.436  0.50  7.10           C
ATOM   1143  H  AALA A  39       8.991  13.400  -4.123  0.50  6.81           H
ATOM   1144  H  BALA A  39       9.086  13.670  -3.764  0.50  6.89           H
ATOM   1145  HA AALA A  39      10.734  14.125  -3.213  0.50  6.91           H
ATOM   1146  HA BALA A  39      10.804  14.348  -2.761  0.50  7.04           H
ATOM   1147  HB3AALA A  39       9.254  16.471  -2.659  0.50  6.94           H
ATOM   1148  HB3BALA A  39       9.250  16.615  -2.099  0.50  7.08           H
ATOM   1149  HB2AALA A  39      10.138  16.246  -3.959  0.50  6.94           H
ATOM   1150  HB2BALA A  39      10.209  16.501  -3.361  0.50  7.08           H
ATOM   1151  HB1AALA A  39      10.835  16.374  -2.537  0.50  6.94           H
ATOM   1152  HB1BALA A  39      10.824  16.544  -1.897  0.50  7.08           H
ATOM   1153  N  ASER A  40       9.560  12.935  -0.998  0.50  6.96           N
ATOM   1154  N  BSER A  40       9.620  12.967  -0.677  0.50  7.27           N
ATOM   1155  CA ASER A  40       9.726  12.488   0.369  0.50  6.90           C
ATOM   1156  CA BSER A  40       9.770  12.446   0.672  0.50  7.35           C
ATOM   1157  C  ASER A  40      11.213  12.252   0.606  0.50  6.91           C
ATOM   1158  C  BSER A  40      11.255  12.204   0.909  0.50  7.40           C
ATOM   1159  O  ASER A  40      12.004  12.301  -0.340  0.50  6.81           O
ATOM   1160  O  BSER A  40      12.043  12.410  -0.024  0.50  7.39           O
ATOM   1161  CB ASER A  40       8.984  11.178   0.632  0.50  6.84           C
ATOM   1162  CB BSER A  40       9.041  11.118   0.881  0.50  7.42           C
ATOM   1163  OG ASER A  40       9.785  10.040   0.315  0.50  6.71           O
ATOM   1164  OG BSER A  40       9.622  10.071   0.118  0.50  7.47           O
ATOM   1165  H  ASER A  40       9.196  12.367  -1.532  0.50  6.95           H
ATOM   1166  H  BSER A  40       9.296  12.425  -1.262  0.50  7.26           H
ATOM   1167  HA ASER A  40       9.369  13.162   0.968  0.50  6.90           H
ATOM   1168  HA BSER A  40       9.395  13.090   1.293  0.50  7.36           H
ATOM   1169  HB3ASER A  40       8.184  11.158   0.083  0.50  6.82           H
ATOM   1170  HB3BSER A  40       8.115  11.224   0.611  0.50  7.42           H
ATOM   1171  HB2ASER A  40       8.744  11.139   1.570  0.50  6.82           H
ATOM   1172  HB2BSER A  40       9.087  10.881   1.821  0.50  7.42           H
ATOM   1173  N  APRO A  41      11.636  11.982   1.843  0.50  7.08           N
ATOM   1174  N  BPRO A  41      11.700  11.750   2.083  0.50  7.52           N
ATOM   1175  CA APRO A  41      13.060  11.659   2.065  0.50  7.16           C
ATOM   1176  CA BPRO A  41      13.126  11.402   2.225  0.50  7.58           C
ATOM   1177  C  APRO A  41      13.522  10.448   1.271  0.50  7.20           C
ATOM   1178  C  BPRO A  41      13.576  10.289   1.286  0.50  7.57           C
ATOM   1179  O  APRO A  41      14.732  10.265   1.075  0.50  7.29           O
ATOM   1180  O  BPRO A  41      14.787  10.039   1.192  0.50  7.65           O
ATOM   1181  CB APRO A  41      13.132  11.405   3.577  0.50  7.19           C
ATOM   1182  CB BPRO A  41      13.244  10.967   3.692  0.50  7.63           C
ATOM   1183  CG APRO A  41      11.944  12.124   4.147  0.50  7.20           C
ATOM   1184  CG BPRO A  41      12.081  11.599   4.373  0.50  7.65           C
ATOM   1185  CD APRO A  41      10.873  12.017   3.101  0.50  7.17           C
ATOM   1186  CD BPRO A  41      10.979  11.632   3.361  0.50  7.61           C
ATOM   1187  HA APRO A  41      13.619  12.422   1.848  0.50  7.16           H
ATOM   1188  HA BPRO A  41      13.675  12.189   2.081  0.50  7.57           H
ATOM   1189  HB3APRO A  41      13.960  11.764   3.934  0.50  7.18           H
ATOM   1190  HB3BPRO A  41      14.080  11.287   4.066  0.50  7.62           H
ATOM   1191  HB2APRO A  41      13.080  10.452   3.755  0.50  7.18           H
ATOM   1192  HB2BPRO A  41      13.200  10.000   3.755  0.50  7.62           H
ATOM   1193  HG3APRO A  41      12.171  13.053   4.314  0.50  7.19           H
ATOM   1194  HG3BPRO A  41      12.316  12.497   4.654  0.50  7.64           H
ATOM   1195  HG2APRO A  41      11.665  11.697   4.972  0.50  7.19           H
ATOM   1196  HG2BPRO A  41      11.825  11.067   5.142  0.50  7.64           H
ATOM   1197  HD3APRO A  41      10.285  12.787   3.128  0.50  7.15           H
ATOM   1198  HD3BPRO A  41      10.401  12.398   3.504  0.50  7.60           H
ATOM   1199  HD2APRO A  41      10.358  11.202   3.216  0.50  7.15           H
ATOM   1200  HD2BPRO A  41      10.458  10.814   3.390  0.50  7.60           H
ATOM   1201  N  ATYR A  42      12.582   9.628   0.810  0.50  7.25           N
ATOM   1202  N  BTYR A  42      12.647   9.624   0.593  0.50  7.56           N
ATOM   1203  CA ATYR A  42      12.830   8.431   0.028  0.50  7.35           C
ATOM   1204  CA BTYR A  42      12.946   8.463  -0.236  0.50  7.64           C
ATOM   1205  C  ATYR A  42      12.592   8.685  -1.441  0.50  7.19           C
ATOM   1206  C  BTYR A  42      12.574   8.712  -1.692  0.50  7.36           C
ATOM   1207  O  ATYR A  42      12.671   7.760  -2.258  0.50  7.33           O
ATOM   1208  O  BTYR A  42      12.355   7.759  -2.447  0.50  7.46           O
ATOM   1209  CB ATYR A  42      11.894   7.320   0.505  0.50  7.59           C
ATOM   1210  CB BTYR A  42      12.177   7.258   0.309  0.50  7.96           C
ATOM   1211  CG ATYR A  42      11.767   7.247   1.994  0.50  7.86           C
ATOM   1212  CG BTYR A  42      12.149   7.253   1.821  0.50  8.34           C
ATOM   1213  CD1ATYR A  42      12.849   7.014   2.817  0.50  8.02           C
ATOM   1214  CD1BTYR A  42      13.318   7.121   2.553  0.50  8.58           C
ATOM   1215  CD2ATYR A  42      10.532   7.497   2.583  0.50  8.04           C
ATOM   1216  CD2BTYR A  42      10.959   7.428   2.517  0.50  8.56           C
ATOM   1217  CE1ATYR A  42      12.695   6.994   4.192  0.50  8.16           C
ATOM   1218  CE1BTYR A  42      13.303   7.142   3.936  0.50  8.72           C
ATOM   1219  CE2ATYR A  42      10.368   7.476   3.938  0.50  8.19           C
ATOM   1220  CE2BTYR A  42      10.935   7.449   3.903  0.50  8.72           C
ATOM   1221  CZ ATYR A  42      11.449   7.229   4.743  0.50  8.24           C
ATOM   1222  CZ BTYR A  42      12.110   7.304   4.605  0.50  8.82           C
ATOM   1223  OH ATYR A  42      11.271   7.208   6.105  0.50  8.52           O
ATOM   1224  OH BTYR A  42      12.091   7.324   5.981  0.50  9.06           O
ATOM   1225  H  ATYR A  42      11.743   9.755   0.948  0.50  7.26           H
ATOM   1226  H  BTYR A  42      11.813   9.836   0.590  0.50  7.58           H
ATOM   1227  HA ATYR A  42      13.747   8.140   0.153  0.50  7.35           H
ATOM   1228  HA BTYR A  42      13.896   8.270  -0.207  0.50  7.63           H
ATOM   1229  HB3ATYR A  42      12.235   6.467   0.193  0.50  7.60           H
ATOM   1230  HB3BTYR A  42      12.607   6.442   0.009  0.50  7.97           H
ATOM   1231  HB2ATYR A  42      11.009   7.477   0.138  0.50  7.60           H
ATOM   1232  HB2BTYR A  42      11.263   7.289  -0.013  0.50  7.97           H
ATOM   1233  HD1ATYR A  42      13.689   6.868   2.445  0.50  8.02           H
ATOM   1234  HD1BTYR A  42      14.127   7.016   2.107  0.50  8.56           H
ATOM   1235  HD2ATYR A  42       9.800   7.683   2.040  0.50  8.03           H
ATOM   1236  HD2BTYR A  42      10.165   7.533   2.044  0.50  8.55           H
ATOM   1237  HE1ATYR A  42      13.425   6.824   4.742  0.50  8.15           H
ATOM   1238  HE1BTYR A  42      14.096   7.046   4.413  0.50  8.71           H
ATOM   1239  HE2ATYR A  42       9.530   7.629   4.312  0.50  8.16           H
ATOM   1240  HE2BTYR A  42      10.130   7.560   4.355  0.50  8.70           H
ATOM   1241  N  AGLY A  43      12.366   9.936  -1.792  0.50  6.95           N
ATOM   1242  N  BGLY A  43      12.532   9.971  -2.111  0.50  7.01           N
ATOM   1243  CA AGLY A  43      11.974  10.268  -3.126  0.50  6.77           C
ATOM   1244  CA BGLY A  43      12.028  10.290  -3.426  0.50  6.80           C
ATOM   1245  C  AGLY A  43      10.467  10.212  -3.269  0.50  6.54           C
ATOM   1246  C  BGLY A  43      10.512  10.374  -3.395  0.50  6.55           C
ATOM   1247  O  AGLY A  43       9.746  10.053  -2.282  0.50  6.53           O
ATOM   1248  O  BGLY A  43       9.896  10.551  -2.336  0.50  6.62           O
ATOM   1249  H  AGLY A  43      12.437  10.612  -1.264  0.50  6.96           H
ATOM   1250  H  BGLY A  43      12.789  10.651  -1.651  0.50  7.04           H
ATOM   1251  HA3AGLY A  43      12.371   9.640  -3.750  0.50  6.76           H
ATOM   1252  HA3BGLY A  43      12.293   9.603  -4.057  0.50  6.79           H
ATOM   1253  HA2AGLY A  43      12.276  11.164  -3.344  0.50  6.76           H
ATOM   1254  HA2BGLY A  43      12.385  11.143  -3.719  0.50  6.79           H
ATOM   1255  N  AASN A  44       9.978  10.293  -4.495  0.50  6.29           N
ATOM   1256  N  BASN A  44       9.898  10.241  -4.564  0.50  6.26           N
ATOM   1257  CA AASN A  44       8.550  10.076  -4.705  0.50  6.11           C
ATOM   1258  CA BASN A  44       8.446  10.153  -4.606  0.50  6.03           C
ATOM   1259  C  AASN A  44       8.160   8.741  -4.077  0.50  5.82           C
ATOM   1260  C  BASN A  44       8.016   8.790  -4.081  0.50  5.72           C
ATOM   1261  O  AASN A  44       8.832   7.731  -4.300  0.50  5.81           O
ATOM   1262  O  BASN A  44       8.470   7.756  -4.586  0.50  5.70           O
ATOM   1263  CB AASN A  44       8.209  10.066  -6.192  0.50  6.22           C
ATOM   1264  CB BASN A  44       7.934  10.331  -6.031  0.50  6.13           C
ATOM   1265  CG AASN A  44       8.221  11.452  -6.814  0.50  6.30           C
ATOM   1266  CG BASN A  44       8.292  11.684  -6.630  0.50  6.27           C
ATOM   1267  OD1AASN A  44       8.753  12.407  -6.245  0.50  6.39           O
ATOM   1268  OD1BASN A  44       8.695  12.616  -5.929  0.50  6.35           O
ATOM   1269  ND2AASN A  44       7.640  11.562  -8.002  0.50  6.34           N
ATOM   1270  ND2BASN A  44       8.142  11.792  -7.945  0.50  6.35           N
ATOM   1271  H  AASN A  44      10.435  10.467  -5.203  0.50  6.30           H
ATOM   1272  H  BASN A  44      10.290  10.201  -5.328  0.50  6.27           H
ATOM   1273  HA AASN A  44       8.047  10.800  -4.301  0.50  6.11           H
ATOM   1274  HA BASN A  44       8.062  10.855  -4.057  0.50  6.03           H
ATOM   1275  HB3AASN A  44       7.321   9.694  -6.309  0.50  6.21           H
ATOM   1276  HB3BASN A  44       6.967  10.252  -6.031  0.50  6.14           H
ATOM   1277  HB2AASN A  44       8.861   9.522  -6.661  0.50  6.21           H
ATOM   1278  HB2BASN A  44       8.323   9.644  -6.594  0.50  6.14           H
ATOM   1279 HD21AASN A  44       7.286  10.872  -8.374  0.50  6.33           H
ATOM   1280 HD21BASN A  44       7.857  11.122  -8.402  0.50  6.33           H
ATOM   1281 HD22AASN A  44       7.618  12.324  -8.401  0.50  6.33           H
ATOM   1282 HD22BASN A  44       8.329  12.534  -8.340  0.50  6.33           H
ATOM   1283  N  AALA A  45       7.081   8.726  -3.287  0.50  5.50           N
ATOM   1284  N  BALA A  45       7.132   8.783  -3.079  0.50  5.38           N
ATOM   1285  CA AALA A  45       6.673   7.485  -2.636  0.50  5.31           C
ATOM   1286  CA BALA A  45       6.752   7.554  -2.398  0.50  5.19           C
ATOM   1287  C  AALA A  45       5.214   7.557  -2.210  0.50  5.11           C
ATOM   1288  C  BALA A  45       5.279   7.588  -2.022  0.50  5.00           C
ATOM   1289  O  AALA A  45       4.736   8.613  -1.784  0.50  5.10           O
ATOM   1290  O  BALA A  45       4.775   8.613  -1.551  0.50  4.95           O
ATOM   1291  CB AALA A  45       7.548   7.182  -1.416  0.50  5.33           C
ATOM   1292  CB BALA A  45       7.578   7.350  -1.126  0.50  5.19           C
ATOM   1293  H  AALA A  45       6.584   9.407  -3.118  0.50  5.53           H
ATOM   1294  H  BALA A  45       6.739   9.486  -2.777  0.50  5.41           H
ATOM   1295  HA AALA A  45       6.757   6.766  -3.282  0.50  5.31           H
ATOM   1296  HA BALA A  45       6.893   6.809  -3.003  0.50  5.19           H
ATOM   1297  HB3AALA A  45       7.463   7.908  -0.778  0.50  5.32           H
ATOM   1298  HB3BALA A  45       7.415   8.090  -0.522  0.50  5.19           H
ATOM   1299  HB2AALA A  45       8.472   7.100  -1.702  0.50  5.32           H
ATOM   1300  HB2BALA A  45       8.518   7.316  -1.362  0.50  5.19           H
ATOM   1301  HB1AALA A  45       7.252   6.351  -1.013  0.50  5.32           H
ATOM   1302  HB1BALA A  45       7.312   6.516  -0.707  0.50  5.19           H
ATOM   1303  N  ACYS A  46       4.518   6.422  -2.303  0.50  4.94           N
ATOM   1304  N  BCYS A  46       4.602   6.452  -2.186  0.50  4.86           N
ATOM   1305  CA ACYS A  46       3.143   6.365  -1.822  0.50  4.86           C
ATOM   1306  CA BCYS A  46       3.193   6.366  -1.819  0.50  4.79           C
ATOM   1307  C  ACYS A  46       3.087   6.423  -0.296  0.50  4.85           C
ATOM   1308  C  BCYS A  46       3.017   6.336  -0.304  0.50  4.76           C
ATOM   1309  O  ACYS A  46       3.892   5.798   0.407  0.50  4.82           O
ATOM   1310  O  BCYS A  46       3.663   5.551   0.402  0.50  4.67           O
ATOM   1311  CB ACYS A  46       2.427   5.088  -2.275  0.50  4.81           C
ATOM   1312  CB BCYS A  46       2.550   5.116  -2.415  0.50  4.79           C
ATOM   1313  SG ACYS A  46       2.160   4.847  -4.054  0.50  4.71           S
ATOM   1314  SG BCYS A  46       2.344   5.120  -4.210  0.50  4.73           S
ATOM   1315  H  ACYS A  46       4.815   5.687  -2.635  0.50  4.96           H
ATOM   1316  H  BCYS A  46       4.934   5.725  -2.503  0.50  4.88           H
ATOM   1317  HA ACYS A  46       2.679   7.130  -2.197  0.50  4.87           H
ATOM   1318  HA BCYS A  46       2.747   7.152  -2.172  0.50  4.80           H
ATOM   1319  HB3ACYS A  46       1.551   5.077  -1.858  0.50  4.81           H
ATOM   1320  HB3BCYS A  46       1.669   5.012  -2.024  0.50  4.78           H
ATOM   1321  HB2ACYS A  46       2.950   4.331  -1.967  0.50  4.81           H
ATOM   1322  HB2BCYS A  46       3.105   4.353  -2.191  0.50  4.78           H
ATOM   1323  N  ATYR A  47       2.093   7.155   0.206  0.50  4.93           N
ATOM   1324  N  BTYR A  47       2.104   7.172   0.182  0.50  4.85           N
ATOM   1325  CA ATYR A  47       1.779   7.253   1.625  0.50  5.03           C
ATOM   1326  CA BTYR A  47       1.710   7.238   1.580  0.50  4.94           C
ATOM   1327  C  ATYR A  47       0.313   6.898   1.791  0.50  4.99           C
ATOM   1328  C  BTYR A  47       0.269   6.761   1.698  0.50  4.92           C
ATOM   1329  O  ATYR A  47      -0.544   7.470   1.109  0.50  4.98           O
ATOM   1330  O  BTYR A  47      -0.577   7.131   0.878  0.50  4.89           O
ATOM   1331  CB ATYR A  47       2.023   8.667   2.147  0.50  5.18           C
ATOM   1332  CB BTYR A  47       1.824   8.680   2.076  0.50  5.09           C
ATOM   1333  CG ATYR A  47       1.937   8.808   3.653  0.50  5.34           C
ATOM   1334  CG BTYR A  47       1.674   8.862   3.569  0.50  5.24           C
ATOM   1335  CD1ATYR A  47       0.724   9.057   4.288  0.50  5.43           C
ATOM   1336  CD1BTYR A  47       0.418   8.942   4.159  0.50  5.32           C
ATOM   1337  CD2ATYR A  47       3.073   8.696   4.441  0.50  5.46           C
ATOM   1338  CD2BTYR A  47       2.788   8.974   4.387  0.50  5.35           C
ATOM   1339  CE1ATYR A  47       0.651   9.191   5.670  0.50  5.50           C
ATOM   1340  CE1BTYR A  47       0.275   9.115   5.526  0.50  5.39           C
ATOM   1341  CE2ATYR A  47       3.009   8.829   5.817  0.50  5.53           C
ATOM   1342  CE2BTYR A  47       2.656   9.149   5.759  0.50  5.41           C
ATOM   1343  CZ ATYR A  47       1.800   9.077   6.429  0.50  5.56           C
ATOM   1344  CZ BTYR A  47       1.395   9.218   6.324  0.50  5.44           C
ATOM   1345  OH ATYR A  47       1.754   9.209   7.803  0.50  5.77           O
ATOM   1346  OH BTYR A  47       1.251   9.394   7.687  0.50  5.64           O
ATOM   1347  H  ATYR A  47       1.563   7.626  -0.281  0.50  4.94           H
ATOM   1348  H  BTYR A  47       1.678   7.738  -0.306  0.50  4.85           H
ATOM   1349  HA ATYR A  47       2.330   6.640   2.136  0.50  5.03           H
ATOM   1350  HA BTYR A  47       2.272   6.673   2.132  0.50  4.95           H
ATOM   1351  HB3ATYR A  47       1.357   9.258   1.760  0.50  5.18           H
ATOM   1352  HB3BTYR A  47       1.130   9.206   1.649  0.50  5.09           H
ATOM   1353  HB2ATYR A  47       2.911   8.947   1.877  0.50  5.18           H
ATOM   1354  HB2BTYR A  47       2.698   9.021   1.829  0.50  5.09           H
ATOM   1355  HD1ATYR A  47      -0.051   9.136   3.779  0.50  5.42           H
ATOM   1356  HD1BTYR A  47      -0.341   8.877   3.626  0.50  5.32           H
ATOM   1357  HD2ATYR A  47       3.893   8.528   4.037  0.50  5.45           H
ATOM   1358  HD2BTYR A  47       3.638   8.931   4.012  0.50  5.34           H
ATOM   1359  HE1ATYR A  47      -0.167   9.357   6.082  0.50  5.50           H
ATOM   1360  HE1BTYR A  47      -0.573   9.162   5.904  0.50  5.38           H
ATOM   1361  HE2ATYR A  47       3.782   8.752   6.328  0.50  5.52           H
ATOM   1362  HE2BTYR A  47       3.412   9.220   6.295  0.50  5.40           H
ATOM   1363  N  ACYS A  48       0.024   5.959   2.685  0.50  5.04           N
ATOM   1364  N  BCYS A  48      -0.010   5.928   2.706  0.50  5.00           N
ATOM   1365  CA ACYS A  48      -1.324   5.440   2.833  0.50  5.13           C
ATOM   1366  CA BCYS A  48      -1.340   5.364   2.908  0.50  5.12           C
ATOM   1367  C  ACYS A  48      -1.898   5.775   4.202  0.50  5.21           C
ATOM   1368  C  BCYS A  48      -1.868   5.688   4.297  0.50  5.21           C
ATOM   1369  O  ACYS A  48      -1.175   6.004   5.177  0.50  5.26           O
ATOM   1370  O  BCYS A  48      -1.127   5.672   5.286  0.50  5.18           O
ATOM   1371  CB ACYS A  48      -1.355   3.923   2.659  0.50  5.20           C
ATOM   1372  CB BCYS A  48      -1.371   3.837   2.767  0.50  5.20           C
ATOM   1373  SG ACYS A  48      -0.495   3.268   1.209  0.50  5.28           S
ATOM   1374  SG BCYS A  48      -0.765   3.135   1.241  0.50  5.30           S
ATOM   1375  H  ACYS A  48       0.597   5.607   3.220  0.50  5.05           H
ATOM   1376  H  BCYS A  48       0.566   5.674   3.292  0.50  5.01           H
ATOM   1377  HA ACYS A  48      -1.880   5.859   2.157  0.50  5.14           H
ATOM   1378  HA BCYS A  48      -1.912   5.763   2.234  0.50  5.13           H
ATOM   1379  HB3ACYS A  48      -2.282   3.646   2.591  0.50  5.20           H
ATOM   1380  HB3BCYS A  48      -2.293   3.549   2.860  0.50  5.20           H
ATOM   1381  HB2ACYS A  48      -0.945   3.521   3.440  0.50  5.20           H
ATOM   1382  HB2BCYS A  48      -0.832   3.462   3.481  0.50  5.20           H
ATOM   1383  N  ATYR A  49      -3.226   5.784   4.251  0.50  5.33           N
ATOM   1384  N  BTYR A  49      -3.181   5.884   4.368  0.50  5.39           N
ATOM   1385  CA ATYR A  49      -3.981   5.981   5.474  0.50  5.48           C
ATOM   1386  CA BTYR A  49      -3.885   6.078   5.622  0.50  5.62           C
ATOM   1387  C  ATYR A  49      -4.766   4.730   5.851  0.50  5.63           C
ATOM   1388  C  BTYR A  49      -4.665   4.840   6.045  0.50  5.84           C
ATOM   1389  O  ATYR A  49      -5.324   4.046   4.988  0.50  5.62           O
ATOM   1390  O  BTYR A  49      -5.286   4.166   5.219  0.50  5.83           O
ATOM   1391  CB ATYR A  49      -4.990   7.122   5.311  0.50  5.53           C
ATOM   1392  CB BTYR A  49      -4.889   7.223   5.500  0.50  5.69           C
ATOM   1393  CG ATYR A  49      -4.398   8.500   5.141  0.50  5.61           C
ATOM   1394  CG BTYR A  49      -4.247   8.550   5.244  0.50  5.78           C
ATOM   1395  CD1ATYR A  49      -3.902   9.207   6.230  0.50  5.68           C
ATOM   1396  CD1BTYR A  49      -3.668   9.266   6.281  0.50  5.86           C
ATOM   1397  CD2ATYR A  49      -4.372   9.114   3.897  0.50  5.68           C
ATOM   1398  CD2BTYR A  49      -4.211   9.092   3.969  0.50  5.85           C
ATOM   1399  CE1ATYR A  49      -3.374  10.483   6.076  0.50  5.73           C
ATOM   1400  CE1BTYR A  49      -3.076  10.490   6.057  0.50  5.90           C
ATOM   1401  CE2ATYR A  49      -3.848  10.385   3.733  0.50  5.73           C
ATOM   1402  CE2BTYR A  49      -3.618  10.317   3.733  0.50  5.90           C
ATOM   1403  CZ ATYR A  49      -3.351  11.066   4.823  0.50  5.73           C
ATOM   1404  CZ BTYR A  49      -3.056  11.013   4.785  0.50  5.92           C
ATOM   1405  OH ATYR A  49      -2.838  12.333   4.643  0.50  5.84           O
ATOM   1406  OH BTYR A  49      -2.466  12.232   4.560  0.50  6.07           O
ATOM   1407  H  ATYR A  49      -3.727   5.673   3.561  0.50  5.34           H
ATOM   1408  H  BTYR A  49      -3.697   5.909   3.680  0.50  5.40           H
ATOM   1409  HA ATYR A  49      -3.349   6.182   6.183  0.50  5.49           H
ATOM   1410  HA BTYR A  49      -3.218   6.268   6.300  0.50  5.63           H
ATOM   1411  HB3ATYR A  49      -5.553   7.145   6.100  0.50  5.54           H
ATOM   1412  HB3BTYR A  49      -5.391   7.289   6.327  0.50  5.69           H
ATOM   1413  HB2ATYR A  49      -5.529   6.941   4.525  0.50  5.54           H
ATOM   1414  HB2BTYR A  49      -5.489   7.035   4.761  0.50  5.69           H
ATOM   1415  HD1ATYR A  49      -3.924   8.820   7.075  0.50  5.68           H
ATOM   1416  HD1BTYR A  49      -3.680   8.915   7.142  0.50  5.85           H
ATOM   1417  HD2ATYR A  49      -4.713   8.663   3.159  0.50  5.68           H
ATOM   1418  HD2BTYR A  49      -4.591   8.623   3.261  0.50  5.84           H
ATOM   1419  HE1ATYR A  49      -3.039  10.942   6.812  0.50  5.72           H
ATOM   1420  HE1BTYR A  49      -2.693  10.960   6.762  0.50  5.90           H
ATOM   1421  HE2ATYR A  49      -3.832  10.777   2.890  0.50  5.72           H
ATOM   1422  HE2BTYR A  49      -3.598  10.670   2.873  0.50  5.89           H
ATOM   1423  N  ALYS A  50      -4.781   4.439   7.151  0.50  5.88           N
ATOM   1424  N  BLYS A  50      -4.606   4.554   7.346  0.50  6.19           N
ATOM   1425  CA ALYS A  50      -5.578   3.365   7.760  0.50  6.16           C
ATOM   1426  CA BLYS A  50      -5.389   3.500   8.005  0.50  6.56           C
ATOM   1427  C  ALYS A  50      -5.264   1.984   7.182  0.50  6.16           C
ATOM   1428  C  BLYS A  50      -5.175   2.116   7.383  0.50  6.67           C
ATOM   1429  O  ALYS A  50      -6.160   1.211   6.830  0.50  6.28           O
ATOM   1430  O  BLYS A  50      -6.122   1.393   7.057  0.50  6.83           O
ATOM   1431  CB ALYS A  50      -7.076   3.668   7.653  0.50  6.44           C
ATOM   1432  CB BLYS A  50      -6.872   3.883   8.024  0.50  6.82           C
ATOM   1433  CG ALYS A  50      -7.467   4.975   8.323  0.50  6.72           C
ATOM   1434  CG BLYS A  50      -7.103   5.202   8.753  0.50  7.10           C
ATOM   1435  CD ALYS A  50      -8.974   5.115   8.460  0.50  6.95           C
ATOM   1436  CD BLYS A  50      -8.567   5.485   9.013  0.50  7.35           C
ATOM   1437  CE ALYS A  50      -9.350   6.381   9.214  0.50  7.14           C
ATOM   1438  CE BLYS A  50      -8.745   6.870   9.616  0.50  7.55           C
ATOM   1439  NZ ALYS A  50     -10.790   6.399   9.592  0.50  7.29           N
ATOM   1440  NZ BLYS A  50      -8.676   7.932   8.577  0.50  7.72           N
ATOM   1441  H  ALYS A  50      -4.316   4.869   7.733  0.50  5.88           H
ATOM   1442  H  BLYS A  50      -4.096   4.974   7.897  0.50  6.19           H
ATOM   1443  HA ALYS A  50      -5.330   3.328   8.697  0.50  6.15           H
ATOM   1444  HA BLYS A  50      -5.071   3.422   8.918  0.50  6.55           H
ATOM   1445  HB3ALYS A  50      -7.572   2.952   8.080  0.50  6.44           H
ATOM   1446  HB3BLYS A  50      -7.375   3.190   8.479  0.50  6.82           H
ATOM   1447  HB2ALYS A  50      -7.319   3.727   6.716  0.50  6.44           H
ATOM   1448  HB2BLYS A  50      -7.189   3.978   7.112  0.50  6.82           H
ATOM   1449  HG3ALYS A  50      -7.141   5.717   7.791  0.50  6.70           H
ATOM   1450  HG3BLYS A  50      -6.750   5.927   8.214  0.50  7.09           H
ATOM   1451  HG2ALYS A  50      -7.078   5.008   9.211  0.50  6.70           H
ATOM   1452  HG2BLYS A  50      -6.648   5.173   9.609  0.50  7.09           H
ATOM   1453  HD3ALYS A  50      -9.325   4.354   8.948  0.50  6.94           H
ATOM   1454  HD3BLYS A  50      -8.919   4.830   9.635  0.50  7.34           H
ATOM   1455  HD2ALYS A  50      -9.375   5.156   7.577  0.50  6.94           H
ATOM   1456  HD2BLYS A  50      -9.058   5.447   8.178  0.50  7.34           H
ATOM   1457  HE3ALYS A  50      -9.175   7.152   8.652  0.50  7.13           H
ATOM   1458  HE3BLYS A  50      -8.040   7.031  10.264  0.50  7.54           H
ATOM   1459  HE2ALYS A  50      -8.823   6.437  10.027  0.50  7.13           H
ATOM   1460  HE2BLYS A  50      -9.611   6.923  10.049  0.50  7.54           H
ATOM   1461  HZ1ALYS A  50     -10.970   5.719  10.138  0.50  7.24           H
ATOM   1462  HZ1BLYS A  50      -9.279   7.775   7.942  0.50  7.67           H
ATOM   1463  HZ2ALYS A  50     -11.297   6.326   8.864  0.50  7.24           H
ATOM   1464  HZ2BLYS A  50      -7.866   7.945   8.209  0.50  7.67           H
ATOM   1465  HZ3ALYS A  50     -10.988   7.162  10.006  0.50  7.24           H
ATOM   1466  HZ3BLYS A  50      -8.840   8.727   8.942  0.50  7.67           H
ATOM   1467  N  ALEU A  51      -3.991   1.669   7.120  0.50  6.17           N
ATOM   1468  N  BLEU A  51      -3.911   1.732   7.281  0.50  6.74           N
ATOM   1469  CA ALEU A  51      -3.595   0.328   6.746  0.50  6.26           C
ATOM   1470  CA BLEU A  51      -3.519   0.410   6.832  0.50  6.82           C
ATOM   1471  C  ALEU A  51      -3.796  -0.592   7.944  0.50  6.36           C
ATOM   1472  C  BLEU A  51      -3.789  -0.620   7.920  0.50  6.99           C
ATOM   1473  O  ALEU A  51      -3.604  -0.171   9.089  0.50  6.33           O
ATOM   1474  O  BLEU A  51      -3.896  -0.272   9.097  0.50  6.99           O
ATOM   1475  CB ALEU A  51      -2.131   0.281   6.364  0.50  6.26           C
ATOM   1476  CB BLEU A  51      -2.032   0.388   6.510  0.50  6.75           C
ATOM   1477  CG ALEU A  51      -1.654   0.984   5.108  0.50  6.28           C
ATOM   1478  CG BLEU A  51      -1.514   1.251   5.378  0.50  6.73           C
ATOM   1479  CD1ALEU A  51      -0.156   1.187   5.192  0.50  6.33           C
ATOM   1480  CD1BLEU A  51      -0.022   1.498   5.542  0.50  6.74           C
ATOM   1481  CD2ALEU A  51      -2.023   0.183   3.872  0.50  6.29           C
ATOM   1482  CD2BLEU A  51      -1.796   0.593   4.043  0.50  6.72           C
ATOM   1483  H  ALEU A  51      -3.340   2.206   7.287  0.50  6.19           H
ATOM   1484  H  BLEU A  51      -3.241   2.236   7.472  0.50  6.74           H
ATOM   1485  HA ALEU A  51      -4.121   0.031   5.987  0.50  6.26           H
ATOM   1486  HA BLEU A  51      -4.026   0.179   6.038  0.50  6.82           H
ATOM   1487  HB3ALEU A  51      -1.893  -0.654   6.257  0.50  6.26           H
ATOM   1488  HB3BLEU A  51      -1.797  -0.527   6.288  0.50  6.76           H
ATOM   1489  HB2ALEU A  51      -1.630   0.669   7.098  0.50  6.26           H
ATOM   1490  HB2BLEU A  51      -1.558   0.668   7.309  0.50  6.76           H
ATOM   1491  HG ALEU A  51      -2.084   1.849   5.030  0.50  6.29           H
ATOM   1492  HG BLEU A  51      -1.968   2.108   5.397  0.50  6.73           H
ATOM   1493 HD11ALEU A  51       0.120   1.796   4.490  0.50  6.31           H
ATOM   1494 HD11BLEU A  51       0.270   2.130   4.866  0.50  6.74           H
ATOM   1495 HD12ALEU A  51       0.286   0.331   5.080  0.50  6.31           H
ATOM   1496 HD12BLEU A  51       0.451   0.658   5.436  0.50  6.74           H
ATOM   1497 HD13ALEU A  51       0.064   1.561   6.060  0.50  6.31           H
ATOM   1498 HD13BLEU A  51       0.143   1.861   6.427  0.50  6.74           H
ATOM   1499 HD21ALEU A  51      -2.987   0.072   3.843  0.50  6.29           H
ATOM   1500 HD21BLEU A  51      -2.755   0.495   3.936  0.50  6.72           H
ATOM   1501 HD22ALEU A  51      -1.592  -0.685   3.917  0.50  6.29           H
ATOM   1502 HD22BLEU A  51      -1.370  -0.278   4.024  0.50  6.72           H
ATOM   1503 HD23ALEU A  51      -1.722   0.661   3.084  0.50  6.29           H
ATOM   1504 HD23BLEU A  51      -1.440   1.152   3.334  0.50  6.72           H
ATOM   1505  N  APRO A  52      -4.154  -1.853   7.721  0.50  6.50           N
ATOM   1506  N  BPRO A  52      -3.895  -1.900   7.561  0.50  7.20           N
ATOM   1507  CA APRO A  52      -4.187  -2.797   8.842  0.50  6.60           C
ATOM   1508  CA BPRO A  52      -4.008  -2.924   8.602  0.50  7.31           C
ATOM   1509  C  APRO A  52      -2.806  -2.914   9.471  0.50  6.68           C
ATOM   1510  C  BPRO A  52      -2.719  -2.942   9.410  0.50  7.43           C
ATOM   1511  O  APRO A  52      -1.779  -2.732   8.811  0.50  6.67           O
ATOM   1512  O  BPRO A  52      -1.638  -2.629   8.902  0.50  7.40           O
ATOM   1513  CB APRO A  52      -4.611  -4.116   8.191  0.50  6.64           C
ATOM   1514  CB BPRO A  52      -4.180  -4.227   7.813  0.50  7.31           C
ATOM   1515  CG APRO A  52      -5.242  -3.740   6.903  0.50  6.63           C
ATOM   1516  CG BPRO A  52      -4.728  -3.818   6.506  0.50  7.28           C
ATOM   1517  CD APRO A  52      -4.597  -2.468   6.458  0.50  6.57           C
ATOM   1518  CD BPRO A  52      -4.177  -2.444   6.221  0.50  7.24           C
ATOM   1519  HA APRO A  52      -4.846  -2.537   9.506  0.50  6.60           H
ATOM   1520  HA BPRO A  52      -4.784  -2.792   9.168  0.50  7.31           H
ATOM   1521  HB3APRO A  52      -5.245  -4.576   8.764  0.50  6.63           H
ATOM   1522  HB3BPRO A  52      -4.796  -4.814   8.278  0.50  7.30           H
ATOM   1523  HB2APRO A  52      -3.832  -4.674   8.043  0.50  6.63           H
ATOM   1524  HB2BPRO A  52      -3.321  -4.663   7.707  0.50  7.30           H
ATOM   1525  HG3APRO A  52      -6.194  -3.609   7.036  0.50  6.62           H
ATOM   1526  HG3BPRO A  52      -5.697  -3.795   6.553  0.50  7.28           H
ATOM   1527  HG2APRO A  52      -5.092  -4.443   6.252  0.50  6.62           H
ATOM   1528  HG2BPRO A  52      -4.445  -4.448   5.824  0.50  7.28           H
ATOM   1529  HD3APRO A  52      -5.235  -1.897   6.002  0.50  6.57           H
ATOM   1530  HD3BPRO A  52      -4.834  -1.899   5.759  0.50  7.24           H
ATOM   1531  HD2APRO A  52      -3.840  -2.649   5.879  0.50  6.57           H
ATOM   1532  HD2BPRO A  52      -3.365  -2.501   5.694  0.50  7.24           H
ATOM   1533  N  AASP A  53      -2.791  -3.249  10.767  0.50  6.81           N
ATOM   1534  N  BASP A  53      -2.836  -3.324  10.683  0.50  7.65           N
ATOM   1535  CA AASP A  53      -1.544  -3.297  11.525  0.50  6.93           C
ATOM   1536  CA BASP A  53      -1.668  -3.320  11.558  0.50  7.84           C
ATOM   1537  C  AASP A  53      -0.557  -4.325  10.981  0.50  6.91           C
ATOM   1538  C  BASP A  53      -0.605  -4.320  11.121  0.50  7.93           C
ATOM   1539  O  AASP A  53       0.646  -4.200  11.230  0.50  7.03           O
ATOM   1540  O  BASP A  53       0.541  -4.220  11.569  0.50  8.03           O
ATOM   1541  CB AASP A  53      -1.829  -3.628  12.993  0.50  7.09           C
ATOM   1542  CB BASP A  53      -2.081  -3.632  12.997  0.50  7.98           C
ATOM   1543  CG AASP A  53      -2.667  -2.569  13.695  0.50  7.25           C
ATOM   1544  CG BASP A  53      -2.809  -2.481  13.662  0.50  8.13           C
ATOM   1545  OD1AASP A  53      -2.823  -1.449  13.156  0.50  7.42           O
ATOM   1546  OD1BASP A  53      -2.394  -1.317  13.474  0.50  8.18           O
ATOM   1547  OD2AASP A  53      -3.175  -2.869  14.801  0.50  7.42           O
ATOM   1548  OD2BASP A  53      -3.795  -2.746  14.383  0.50  8.41           O
ATOM   1549  H  AASP A  53      -3.489  -3.451  11.227  0.50  6.81           H
ATOM   1550  H  BASP A  53      -3.566  -3.585  11.056  0.50  7.64           H
ATOM   1551  HA AASP A  53      -1.135  -2.420  11.469  0.50  6.93           H
ATOM   1552  HA BASP A  53      -1.280  -2.431  11.531  0.50  7.84           H
ATOM   1553  HB3AASP A  53      -0.986  -3.704  13.467  0.50  7.09           H
ATOM   1554  HB3BASP A  53      -1.287  -3.825  13.518  0.50  7.98           H
ATOM   1555  HB2AASP A  53      -2.311  -4.469  13.038  0.50  7.09           H
ATOM   1556  HB2BASP A  53      -2.673  -4.400  12.996  0.50  7.98           H
ATOM   1557  N  AHIS A  54      -1.028  -5.345  10.261  0.50  6.84           N
ATOM   1558  N  BHIS A  54      -0.952  -5.287  10.272  0.50  7.99           N
ATOM   1559  CA AHIS A  54      -0.109  -6.373   9.778  0.50  6.88           C
ATOM   1560  CA BHIS A  54       0.011  -6.298   9.848  0.50  8.16           C
ATOM   1561  C  AHIS A  54       0.749  -5.899   8.606  0.50  6.74           C
ATOM   1562  C  BHIS A  54       0.796  -5.903   8.599  0.50  8.01           C
ATOM   1563  O  AHIS A  54       1.742  -6.561   8.286  0.50  6.86           O
ATOM   1564  O  BHIS A  54       1.786  -6.569   8.279  0.50  8.14           O
ATOM   1565  CB AHIS A  54      -0.864  -7.660   9.405  0.50  7.04           C
ATOM   1566  CB BHIS A  54      -0.680  -7.656   9.623  0.50  8.44           C
ATOM   1567  CG AHIS A  54      -1.819  -7.509   8.262  0.50  7.24           C
ATOM   1568  CG BHIS A  54      -1.877  -7.599   8.725  0.50  8.76           C
ATOM   1569  ND1AHIS A  54      -3.186  -7.506   8.435  0.50  7.38           N
ATOM   1570  ND1BHIS A  54      -3.167  -7.702   9.199  0.50  9.00           N
ATOM   1571  CD2AHIS A  54      -1.608  -7.388   6.930  0.50  7.38           C
ATOM   1572  CD2BHIS A  54      -1.980  -7.472   7.381  0.50  8.95           C
ATOM   1573  CE1AHIS A  54      -3.777  -7.373   7.262  0.50  7.42           C
ATOM   1574  CE1BHIS A  54      -4.013  -7.630   8.187  0.50  9.01           C
ATOM   1575  NE2AHIS A  54      -2.842  -7.302   6.331  0.50  7.42           N
ATOM   1576  NE2BHIS A  54      -3.318  -7.494   7.072  0.50  9.05           N
ATOM   1577  H  AHIS A  54      -1.852  -5.461  10.044  0.50  6.87           H
ATOM   1578  H  BHIS A  54      -1.736  -5.377   9.930  0.50  8.02           H
ATOM   1579  HA AHIS A  54       0.491  -6.605  10.504  0.50  6.88           H
ATOM   1580  HA BHIS A  54       0.650  -6.421  10.567  0.50  8.15           H
ATOM   1581  HB3AHIS A  54      -1.374  -7.954  10.176  0.50  7.05           H
ATOM   1582  HB3BHIS A  54      -0.972  -8.001  10.481  0.50  8.45           H
ATOM   1583  HB2AHIS A  54      -0.217  -8.339   9.158  0.50  7.05           H
ATOM   1584  HB2BHIS A  54      -0.040  -8.265   9.221  0.50  8.45           H
ATOM   1585  HD2AHIS A  54      -0.783  -7.367   6.501  0.50  7.35           H
ATOM   1586  HD2BHIS A  54      -1.276  -7.386   6.779  0.50  8.93           H
ATOM   1587  HE1AHIS A  54      -4.695  -7.335   7.116  0.50  7.41           H
ATOM   1588  HE1BHIS A  54      -4.940  -7.669   8.249  0.50  9.01           H
ATOM   1589  N  AVAL A  55       0.413  -4.766   7.984  0.50  6.54           N
ATOM   1590  N  BVAL A  55       0.401  -4.839   7.902  0.50  7.80           N
ATOM   1591  CA AVAL A  55       1.147  -4.288   6.818  0.50  6.47           C
ATOM   1592  CA BVAL A  55       1.111  -4.396   6.705  0.50  7.73           C
ATOM   1593  C  AVAL A  55       2.495  -3.723   7.241  0.50  6.41           C
ATOM   1594  C  BVAL A  55       2.366  -3.642   7.121  0.50  7.69           C
ATOM   1595  O  AVAL A  55       2.613  -3.074   8.288  0.50  6.52           O
ATOM   1596  O  BVAL A  55       2.316  -2.744   7.970  0.50  7.61           O
ATOM   1597  CB AVAL A  55       0.313  -3.235   6.068  0.50  6.47           C
ATOM   1598  CB BVAL A  55       0.197  -3.537   5.815  0.50  7.72           C
ATOM   1599  CG1AVAL A  55       1.135  -2.564   4.969  0.50  6.48           C
ATOM   1600  CG1BVAL A  55       0.958  -2.947   4.631  0.50  7.72           C
ATOM   1601  CG2AVAL A  55      -0.943  -3.866   5.487  0.50  6.48           C
ATOM   1602  CG2BVAL A  55      -0.970  -4.362   5.309  0.50  7.75           C
ATOM   1603  H  AVAL A  55      -0.237  -4.256   8.221  0.50  6.57           H
ATOM   1604  H  BVAL A  55      -0.281  -4.354   8.103  0.50  7.83           H
ATOM   1605  HA AVAL A  55       1.312  -5.035   6.222  0.50  6.48           H
ATOM   1606  HA BVAL A  55       1.386  -5.171   6.190  0.50  7.73           H
ATOM   1607  HB AVAL A  55       0.045  -2.549   6.699  0.50  6.48           H
ATOM   1608  HB BVAL A  55      -0.137  -2.803   6.353  0.50  7.73           H
ATOM   1609 HG11AVAL A  55       1.578  -3.249   4.444  0.50  6.48           H
ATOM   1610 HG11BVAL A  55       1.224  -3.666   4.036  0.50  7.72           H
ATOM   1611 HG12AVAL A  55       1.794  -1.983   5.379  0.50  6.48           H
ATOM   1612 HG12BVAL A  55       1.744  -2.483   4.960  0.50  7.72           H
ATOM   1613 HG13AVAL A  55       0.542  -2.045   4.404  0.50  6.48           H
ATOM   1614 HG13BVAL A  55       0.379  -2.326   4.162  0.50  7.72           H
ATOM   1615 HG21AVAL A  55      -1.506  -3.168   5.118  0.50  6.48           H
ATOM   1616 HG21BVAL A  55      -1.582  -3.782   4.830  0.50  7.74           H
ATOM   1617 HG22AVAL A  55      -1.417  -4.334   6.193  0.50  6.48           H
ATOM   1618 HG22BVAL A  55      -1.422  -4.768   6.065  0.50  7.74           H
ATOM   1619 HG23AVAL A  55      -0.690  -4.490   4.789  0.50  6.48           H
ATOM   1620 HG23BVAL A  55      -0.635  -5.052   4.715  0.50  7.74           H
ATOM   1621  N  AARG A  56       3.521  -3.954   6.421  0.50  6.32           N
ATOM   1622  N  BARG A  56       3.496  -3.993   6.515  0.50  7.71           N
ATOM   1623  CA AARG A  56       4.829  -3.369   6.676  0.50  6.24           C
ATOM   1624  CA BARG A  56       4.757  -3.373   6.889  0.50  7.74           C
ATOM   1625  C  AARG A  56       4.884  -1.950   6.127  0.50  6.11           C
ATOM   1626  C  BARG A  56       4.910  -2.012   6.221  0.50  7.37           C
ATOM   1627  O  AARG A  56       4.452  -1.689   4.996  0.50  6.14           O
ATOM   1628  O  BARG A  56       4.697  -1.867   5.010  0.50  7.47           O
ATOM   1629  CB AARG A  56       5.947  -4.204   6.043  0.50  6.29           C
ATOM   1630  CB BARG A  56       5.936  -4.273   6.519  0.50  8.07           C
ATOM   1631  CG AARG A  56       7.352  -3.785   6.507  0.50  6.35           C
ATOM   1632  CG BARG A  56       7.237  -3.794   7.129  0.50  8.36           C
ATOM   1633  CD AARG A  56       8.487  -4.503   5.775  0.50  6.42           C
ATOM   1634  CD BARG A  56       8.357  -4.815   7.061  0.50  8.63           C
ATOM   1635  NE AARG A  56       8.724  -5.854   6.273  0.50  6.50           N
ATOM   1636  NE BARG A  56       9.482  -4.357   7.865  0.50  8.89           N
ATOM   1637  CZ AARG A  56       9.492  -6.156   7.312  0.50  6.61           C
ATOM   1638  CZ BARG A  56      10.327  -3.404   7.495  0.50  9.12           C
ATOM   1639  NH1AARG A  56      10.101  -5.220   8.020  0.50  6.65           N
ATOM   1640  NH1BARG A  56      10.272  -2.861   6.290  0.50  9.23           N
ATOM   1641  NH2AARG A  56       9.653  -7.432   7.650  0.50  6.69           N
ATOM   1642  NH2BARG A  56      11.242  -2.976   8.360  0.50  9.26           N
ATOM   1643  H  AARG A  56       3.481  -4.444   5.715  0.50  6.33           H
ATOM   1644  H  BARG A  56       3.556  -4.581   5.891  0.50  7.72           H
ATOM   1645  HA AARG A  56       4.973  -3.347   7.635  0.50  6.24           H
ATOM   1646  HA BARG A  56       4.762  -3.241   7.850  0.50  7.73           H
ATOM   1647  HB3AARG A  56       5.907  -4.102   5.079  0.50  6.29           H
ATOM   1648  HB3BARG A  56       6.039  -4.281   5.554  0.50  8.06           H
ATOM   1649  HB2AARG A  56       5.818  -5.135   6.283  0.50  6.29           H
ATOM   1650  HB2BARG A  56       5.763  -5.171   6.841  0.50  8.06           H
ATOM   1651  HG3AARG A  56       7.440  -3.982   7.452  0.50  6.35           H
ATOM   1652  HG3BARG A  56       7.085  -3.584   8.064  0.50  8.35           H
ATOM   1653  HG2AARG A  56       7.460  -2.833   6.355  0.50  6.35           H
ATOM   1654  HG2BARG A  56       7.531  -3.000   6.655  0.50  8.35           H
ATOM   1655  HD3AARG A  56       9.306  -3.996   5.889  0.50  6.42           H
ATOM   1656  HD3BARG A  56       8.650  -4.919   6.142  0.50  8.63           H
ATOM   1657  HD2AARG A  56       8.265  -4.567   4.833  0.50  6.42           H
ATOM   1658  HD2BARG A  56       8.048  -5.665   7.409  0.50  8.63           H
ATOM   1659  HE AARG A  56       8.337  -6.503   5.862  0.50  6.50           H
ATOM   1660  HE BARG A  56       9.606  -4.729   8.631  0.50  8.88           H
ATOM   1661 HH11AARG A  56      10.004  -4.391   7.810  0.50  6.64           H
ATOM   1662 HH11BARG A  56       9.677  -3.123   5.727  0.50  9.19           H
ATOM   1663 HH12AARG A  56      10.594  -5.439   8.689  0.50  6.64           H
ATOM   1664 HH12BARG A  56      10.830  -2.244   6.071  0.50  9.19           H
ATOM   1665 HH21AARG A  56      10.148  -7.640   8.322  0.50  6.66           H
ATOM   1666 HH21BARG A  56      11.795  -2.359   8.130  0.50  9.22           H
ATOM   1667 HH22AARG A  56       9.262  -8.050   7.197  0.50  6.66           H
ATOM   1668 HH22BARG A  56      11.280  -3.316   9.149  0.50  9.22           H
ATOM   1669  N  ATHR A  57       5.387  -1.029   6.938  0.50  5.98           N
ATOM   1670  N  BTHR A  57       5.260  -1.017   7.026  0.50  6.98           N
ATOM   1671  CA ATHR A  57       5.659   0.326   6.486  0.50  5.94           C
ATOM   1672  CA BTHR A  57       5.585   0.320   6.561  0.50  6.74           C
ATOM   1673  C  ATHR A  57       7.147   0.602   6.707  0.50  5.91           C
ATOM   1674  C  BTHR A  57       7.079   0.555   6.770  0.50  6.52           C
ATOM   1675  O  ATHR A  57       7.865  -0.179   7.340  0.50  5.88           O
ATOM   1676  O  BTHR A  57       7.757  -0.175   7.500  0.50  6.43           O
ATOM   1677  CB ATHR A  57       4.746   1.365   7.162  0.50  5.96           C
ATOM   1678  CB BTHR A  57       4.733   1.386   7.266  0.50  6.76           C
ATOM   1679  OG1ATHR A  57       4.827   1.262   8.589  0.50  6.00           O
ATOM   1680  OG1BTHR A  57       4.602   1.068   8.656  0.50  6.78           O
ATOM   1681  CG2ATHR A  57       3.293   1.163   6.708  0.50  5.97           C
ATOM   1682  CG2BTHR A  57       3.346   1.468   6.635  0.50  6.80           C
ATOM   1683  H  ATHR A  57       5.580  -1.168   7.764  0.50  6.00           H
ATOM   1684  H  BTHR A  57       5.318  -1.098   7.880  0.50  7.01           H
ATOM   1685  HA ATHR A  57       5.471   0.416   5.539  0.50  5.95           H
ATOM   1686  HA BTHR A  57       5.393   0.411   5.615  0.50  6.75           H
ATOM   1687  HB ATHR A  57       5.033   2.256   6.907  0.50  5.96           H
ATOM   1688  HB BTHR A  57       5.164   2.250   7.175  0.50  6.77           H
ATOM   1689 HG21ATHR A  57       2.725   1.845   7.100  0.50  5.97           H
ATOM   1690 HG21BTHR A  57       2.808   2.127   7.100  0.50  6.79           H
ATOM   1691 HG22ATHR A  57       2.977   0.290   6.988  0.50  5.97           H
ATOM   1692 HG22BTHR A  57       2.905   0.606   6.690  0.50  6.79           H
ATOM   1693 HG23ATHR A  57       3.236   1.224   5.742  0.50  5.97           H
ATOM   1694 HG23BTHR A  57       3.421   1.724   5.702  0.50  6.79           H
ATOM   1695  N  ALYS A  58       7.590   1.741   6.185  0.50  5.98           N
ATOM   1696  N  BLYS A  58       7.581   1.590   6.109  0.50  6.40           N
ATOM   1697  CA ALYS A  58       9.010   2.079   6.146  0.50  6.08           C
ATOM   1698  CA BLYS A  58       9.011   1.866   6.088  0.50  6.33           C
ATOM   1699  C  ALYS A  58       9.643   2.079   7.532  0.50  6.10           C
ATOM   1700  C  BLYS A  58       9.608   1.967   7.490  0.50  6.26           C
ATOM   1701  O  ALYS A  58       9.203   2.782   8.447  0.50  6.24           O
ATOM   1702  O  BLYS A  58       9.026   2.559   8.402  0.50  6.46           O
ATOM   1703  CB ALYS A  58       9.194   3.447   5.493  0.50  6.16           C
ATOM   1704  CB BLYS A  58       9.244   3.165   5.313  0.50  6.35           C
ATOM   1705  CG ALYS A  58      10.645   3.834   5.253  0.50  6.25           C
ATOM   1706  CG BLYS A  58      10.697   3.583   5.149  0.50  6.38           C
ATOM   1707  CD ALYS A  58      11.338   2.940   4.231  0.50  6.31           C
ATOM   1708  CD BLYS A  58      11.478   2.641   4.249  0.50  6.38           C
ATOM   1709  CE ALYS A  58      12.682   3.525   3.832  0.50  6.39           C
ATOM   1710  CE BLYS A  58      12.917   3.104   4.111  0.50  6.41           C
ATOM   1711  NZ ALYS A  58      13.454   2.654   2.908  0.50  6.43           N
ATOM   1712  NZ BLYS A  58      13.687   2.281   3.139  0.50  6.44           N
ATOM   1713  H  ALYS A  58       7.083   2.345   5.842  0.50  5.99           H
ATOM   1714  H  BLYS A  58       7.111   2.154   5.661  0.50  6.41           H
ATOM   1715  HA ALYS A  58       9.467   1.404   5.621  0.50  6.08           H
ATOM   1716  HA BLYS A  58       9.472   1.133   5.649  0.50  6.33           H
ATOM   1717  HB3ALYS A  58       8.801   4.121   6.069  0.50  6.16           H
ATOM   1718  HB3BLYS A  58       8.789   3.884   5.780  0.50  6.35           H
ATOM   1719  HB2ALYS A  58       8.744   3.442   4.633  0.50  6.16           H
ATOM   1720  HB2BLYS A  58       8.872   3.060   4.423  0.50  6.35           H
ATOM   1721  HG3ALYS A  58      11.133   3.766   6.089  0.50  6.24           H
ATOM   1722  HG3BLYS A  58      11.125   3.590   6.020  0.50  6.37           H
ATOM   1723  HG2ALYS A  58      10.678   4.746   4.923  0.50  6.24           H
ATOM   1724  HG2BLYS A  58      10.730   4.469   4.756  0.50  6.37           H
ATOM   1725  HD3ALYS A  58      10.786   2.865   3.437  0.50  6.31           H
ATOM   1726  HD3BLYS A  58      11.073   2.624   3.368  0.50  6.39           H
ATOM   1727  HD2ALYS A  58      11.486   2.062   4.616  0.50  6.31           H
ATOM   1728  HD2BLYS A  58      11.476   1.750   4.632  0.50  6.39           H
ATOM   1729  HE3ALYS A  58      13.216   3.658   4.631  0.50  6.38           H
ATOM   1730  HE3BLYS A  58      13.356   3.039   4.974  0.50  6.41           H
ATOM   1731  HE2ALYS A  58      12.534   4.374   3.386  0.50  6.38           H
ATOM   1732  HE2BLYS A  58      12.927   4.023   3.802  0.50  6.41           H
ATOM   1733  HZ1ALYS A  58      12.971   2.478   2.181  0.50  6.42           H
ATOM   1734  HZ1BLYS A  58      13.329   2.353   2.327  0.50  6.43           H
ATOM   1735  HZ2ALYS A  58      13.658   1.888   3.312  0.50  6.42           H
ATOM   1736  HZ2BLYS A  58      13.674   1.426   3.385  0.50  6.43           H
ATOM   1737  HZ3ALYS A  58      14.206   3.061   2.664  0.50  6.42           H
ATOM   1738  HZ3BLYS A  58      14.532   2.558   3.107  0.50  6.43           H
ATOM   1739  N  AGLY A  59      10.736   1.326   7.641  0.50  6.12           N
ATOM   1740  N  BGLY A  59      10.798   1.392   7.642  0.50  6.15           N
ATOM   1741  CA AGLY A  59      11.560   1.258   8.820  0.50  6.16           C
ATOM   1742  CA BGLY A  59      11.584   1.529   8.844  0.50  6.08           C
ATOM   1743  C  AGLY A  59      12.965   1.718   8.480  0.50  6.20           C
ATOM   1744  C  BGLY A  59      13.009   1.900   8.489  0.50  6.01           C
ATOM   1745  O  AGLY A  59      13.275   1.974   7.309  0.50  6.19           O
ATOM   1746  O  BGLY A  59      13.310   2.258   7.344  0.50  6.00           O
ATOM   1747  H  AGLY A  59      11.027   0.823   7.007  0.50  6.12           H
ATOM   1748  H  BGLY A  59      11.175   0.905   7.042  0.50  6.16           H
ATOM   1749  HA3AGLY A  59      11.595   0.347   9.150  0.50  6.16           H
ATOM   1750  HA3BGLY A  59      11.588   0.691   9.333  0.50  6.08           H
ATOM   1751  HA2AGLY A  59      11.197   1.831   9.514  0.50  6.16           H
ATOM   1752  HA2BGLY A  59      11.207   2.222   9.407  0.50  6.08           H
ATOM   1753  N  APRO A  60      13.842   1.839   9.474  0.50  6.36           N
ATOM   1754  N  BPRO A  60      13.916   1.814   9.461  0.50  6.02           N
ATOM   1755  CA APRO A  60      15.202   2.318   9.196  0.50  6.59           C
ATOM   1756  CA BPRO A  60      15.304   2.209   9.201  0.50  6.15           C
ATOM   1757  C  APRO A  60      15.958   1.378   8.266  0.50  6.91           C
ATOM   1758  C  BPRO A  60      15.978   1.277   8.206  0.50  6.32           C
ATOM   1759  O  APRO A  60      15.672   0.183   8.166  0.50  6.95           O
ATOM   1760  O  BPRO A  60      15.720   0.073   8.166  0.50  6.35           O
ATOM   1761  CB APRO A  60      15.858   2.381  10.584  0.50  6.52           C
ATOM   1762  CB BPRO A  60      15.966   2.118  10.584  0.50  6.10           C
ATOM   1763  CG APRO A  60      15.008   1.514  11.462  0.50  6.46           C
ATOM   1764  CG BPRO A  60      15.102   1.183  11.371  0.50  6.07           C
ATOM   1765  CD APRO A  60      13.618   1.602  10.911  0.50  6.40           C
ATOM   1766  CD BPRO A  60      13.708   1.389  10.858  0.50  6.04           C
ATOM   1767  HA APRO A  60      15.176   3.206   8.806  0.50  6.59           H
ATOM   1768  HA BPRO A  60      15.348   3.121   8.875  0.50  6.15           H
ATOM   1769  HB3APRO A  60      15.864   3.297  10.903  0.50  6.52           H
ATOM   1770  HB3BPRO A  60      15.991   2.996  10.995  0.50  6.11           H
ATOM   1771  HB2APRO A  60      16.765   2.040  10.535  0.50  6.52           H
ATOM   1772  HB2BPRO A  60      16.866   1.767  10.496  0.50  6.11           H
ATOM   1773  HG3APRO A  60      15.037   1.844  12.373  0.50  6.46           H
ATOM   1774  HG3BPRO A  60      15.158   1.402  12.314  0.50  6.07           H
ATOM   1775  HG2APRO A  60      15.332   0.600  11.430  0.50  6.46           H
ATOM   1776  HG2BPRO A  60      15.391   0.269  11.225  0.50  6.07           H
ATOM   1777  HD3APRO A  60      13.133   2.340  11.312  0.50  6.40           H
ATOM   1778  HD3BPRO A  60      13.253   2.081  11.364  0.50  6.04           H
ATOM   1779  HD2APRO A  60      13.136   0.772  11.053  0.50  6.40           H
ATOM   1780  HD2BPRO A  60      13.201   0.563  10.895  0.50  6.04           H
ATOM   1781  N  AGLY A  61      16.949   1.940   7.595  0.50  7.38           N
ATOM   1782  N  BGLY A  61      16.866   1.858   7.403  0.50  6.62           N
ATOM   1783  CA AGLY A  61      17.670   1.260   6.540  0.50  7.71           C
ATOM   1784  CA BGLY A  61      17.572   1.118   6.378  0.50  6.83           C
ATOM   1785  C  AGLY A  61      17.307   1.840   5.186  0.50  8.02           C
ATOM   1786  C  BGLY A  61      17.257   1.667   5.005  0.50  6.99           C
ATOM   1787  O  AGLY A  61      16.159   2.234   4.934  0.50  8.12           O
ATOM   1788  O  BGLY A  61      16.097   1.657   4.586  0.50  7.11           O
ATOM   1789  H  AGLY A  61      17.230   2.740   7.737  0.50  7.34           H
ATOM   1790  H  BGLY A  61      17.076   2.691   7.437  0.50  6.60           H
ATOM   1791  HA3AGLY A  61      17.447   0.316   6.546  0.50  7.70           H
ATOM   1792  HA3BGLY A  61      17.310   0.185   6.409  0.50  6.81           H
ATOM   1793  HA2AGLY A  61      18.625   1.360   6.678  0.50  7.70           H
ATOM   1794  HA2BGLY A  61      18.528   1.183   6.528  0.50  6.81           H
ATOM   1795  N  AARG A  62      18.281   1.857   4.286  0.50  8.32           N
ATOM   1796  N  BARG A  62      18.267   2.162   4.299  0.50  7.07           N
ATOM   1797  CA AARG A  62      18.094   2.512   3.003  0.50  8.55           C
ATOM   1798  CA BARG A  62      18.028   2.769   3.000  0.50  7.16           C
ATOM   1799  C  AARG A  62      17.829   1.520   1.874  0.50  8.55           C
ATOM   1800  C  BARG A  62      17.873   1.691   1.932  0.50  7.04           C
ATOM   1801  O  AARG A  62      18.393   0.422   1.838  0.50  8.57           O
ATOM   1802  O  BARG A  62      18.730   0.816   1.780  0.50  7.31           O
ATOM   1803  CB AARG A  62      19.315   3.379   2.668  0.50  8.77           C
ATOM   1804  CB BARG A  62      19.152   3.742   2.640  0.50  7.31           C
ATOM   1805  CG AARG A  62      19.195   4.083   1.335  0.50  8.97           C
ATOM   1806  CG BARG A  62      18.875   4.498   1.360  0.50  7.41           C
ATOM   1807  CD AARG A  62      20.181   5.224   1.176  0.50  9.15           C
ATOM   1808  CD BARG A  62      19.671   5.777   1.237  0.50  7.51           C
ATOM   1809  NE AARG A  62      20.008   5.851  -0.129  0.50  9.36           N
ATOM   1810  NE BARG A  62      19.357   6.432  -0.025  0.50  7.58           N
ATOM   1811  CZ AARG A  62      20.573   5.407  -1.242  0.50  9.50           C
ATOM   1812  CZ BARG A  62      19.990   6.198  -1.166  0.50  7.64           C
ATOM   1813  NH1AARG A  62      21.407   4.380  -1.229  0.50  9.62           N
ATOM   1814  NH1BARG A  62      21.045   5.400  -1.223  0.50  7.76           N
ATOM   1815  NH2AARG A  62      20.288   6.000  -2.398  0.50  9.47           N
ATOM   1816  NH2BARG A  62      19.556   6.785  -2.277  0.50  7.72           N
ATOM   1817  H  AARG A  62      19.054   1.497   4.397  0.50  8.30           H
ATOM   1818  H  BARG A  62      19.090   2.158   4.549  0.50  7.07           H
ATOM   1819  HA AARG A  62      17.306   3.074   3.060  0.50  8.55           H
ATOM   1820  HA BARG A  62      17.202   3.277   3.031  0.50  7.15           H
ATOM   1821  HB3AARG A  62      20.103   2.814   2.638  0.50  8.77           H
ATOM   1822  HB3BARG A  62      19.976   3.244   2.524  0.50  7.30           H
ATOM   1823  HB2AARG A  62      19.418   4.056   3.355  0.50  8.77           H
ATOM   1824  HB2BARG A  62      19.253   4.388   3.357  0.50  7.30           H
ATOM   1825  HG3AARG A  62      18.300   4.448   1.250  0.50  8.97           H
ATOM   1826  HG3BARG A  62      17.933   4.730   1.329  0.50  7.41           H
ATOM   1827  HG2AARG A  62      19.361   3.444   0.624  0.50  8.97           H
ATOM   1828  HG2BARG A  62      19.101   3.932   0.605  0.50  7.41           H
ATOM   1829  HD3AARG A  62      21.087   4.885   1.241  0.50  9.16           H
ATOM   1830  HD3BARG A  62      20.620   5.575   1.256  0.50  7.50           H
ATOM   1831  HD2AARG A  62      20.025   5.890   1.864  0.50  9.16           H
ATOM   1832  HD2BARG A  62      19.444   6.376   1.965  0.50  7.50           H
ATOM   1833  HE AARG A  62      19.511   6.551  -0.179  0.50  9.34           H
ATOM   1834  HE BARG A  62      18.720   7.009  -0.030  0.50  7.58           H
ATOM   1835 HH11AARG A  62      21.593   3.987  -0.487  0.50  9.59           H
ATOM   1836 HH11BARG A  62      21.336   5.019  -0.508  0.50  7.72           H
ATOM   1837 HH12AARG A  62      21.763   4.107  -1.962  0.50  9.59           H
ATOM   1838 HH12BARG A  62      21.441   5.263  -1.974  0.50  7.72           H
ATOM   1839 HH21AARG A  62      20.649   5.719  -3.126  0.50  9.48           H
ATOM   1840 HH21BARG A  62      19.958   6.642  -3.024  0.50  7.70           H
ATOM   1841 HH22AARG A  62      19.743   6.665  -2.417  0.50  9.48           H
ATOM   1842 HH22BARG A  62      18.874   7.308  -2.249  0.50  7.70           H
ATOM   1843  N  ACYS A  63      16.901   1.910   0.995  0.50  8.57           N
ATOM   1844  N  BCYS A  63      16.759   1.752   1.209  0.50  6.77           N
ATOM   1845  CA ACYS A  63      16.580   1.212  -0.244  0.50  8.60           C
ATOM   1846  CA BCYS A  63      16.490   0.913   0.053  0.50  6.54           C
ATOM   1847  C  ACYS A  63      16.164   2.272  -1.246  0.50  8.56           C
ATOM   1848  C  BCYS A  63      15.985   1.834  -1.039  0.50  6.58           C
ATOM   1849  O  ACYS A  63      15.338   3.134  -0.929  0.50  8.63           O
ATOM   1850  O  BCYS A  63      15.032   2.588  -0.814  0.50  6.66           O
ATOM   1851  CB ACYS A  63      15.442   0.203  -0.090  0.50  8.68           C
ATOM   1852  CB BCYS A  63      15.426  -0.135   0.372  0.50  6.31           C
ATOM   1853  SG ACYS A  63      14.987  -0.519  -1.720  0.50  8.90           S
ATOM   1854  SG BCYS A  63      15.155  -1.360  -0.930  0.50  5.99           S
ATOM   1855  H  ACYS A  63      16.419   2.614   1.103  0.50  8.57           H
ATOM   1856  H  BCYS A  63      16.117   2.298   1.378  0.50  6.78           H
ATOM   1857  HA ACYS A  63      17.362   0.723  -0.545  0.50  8.60           H
ATOM   1858  HA BCYS A  63      17.291   0.449  -0.236  0.50  6.55           H
ATOM   1859  HB3ACYS A  63      14.663   0.648   0.280  0.50  8.70           H
ATOM   1860  HB3BCYS A  63      14.583   0.319   0.525  0.50  6.30           H
ATOM   1861  HB2ACYS A  63      15.723  -0.515   0.499  0.50  8.70           H
ATOM   1862  HB2BCYS A  63      15.695  -0.614   1.171  0.50  6.30           H
ATOM   1863  N  AHIS A  64      16.743   2.212  -2.437  0.50  8.55           N
ATOM   1864  N  BHIS A  64      16.619   1.797  -2.207  0.50  6.68           N
ATOM   1865  CA AHIS A  64      16.449   3.181  -3.477  0.50  8.63           C
ATOM   1866  CA BHIS A  64      16.256   2.732  -3.265  0.50  6.81           C
ATOM   1867  C  AHIS A  64      16.353   2.492  -4.830  0.50  8.57           C
ATOM   1868  C  BHIS A  64      16.178   2.023  -4.609  0.50  6.74           C
ATOM   1869  O  AHIS A  64      15.269   2.395  -5.412  0.50  8.94           O
ATOM   1870  O  BHIS A  64      15.074   1.819  -5.135  0.50  6.71           O
ATOM   1871  CB AHIS A  64      17.542   4.250  -3.503  0.50  8.79           C
ATOM   1872  CB BHIS A  64      17.291   3.864  -3.297  0.50  7.01           C
ATOM   1873  CG AHIS A  64      17.365   5.275  -4.577  0.50  9.00           C
ATOM   1874  CG BHIS A  64      16.966   4.980  -4.241  0.50  7.24           C
ATOM   1875  ND1AHIS A  64      16.314   6.166  -4.592  0.50  9.16           N
ATOM   1876  ND1BHIS A  64      15.765   5.657  -4.218  0.50  7.38           N
ATOM   1877  CD2AHIS A  64      18.112   5.555  -5.672  0.50  9.14           C
ATOM   1878  CD2BHIS A  64      17.703   5.556  -5.221  0.50  7.40           C
ATOM   1879  CE1AHIS A  64      16.419   6.950  -5.651  0.50  9.21           C
ATOM   1880  CE1BHIS A  64      15.772   6.592  -5.152  0.50  7.46           C
ATOM   1881  NE2AHIS A  64      17.501   6.600  -6.322  0.50  9.22           N
ATOM   1882  NE2BHIS A  64      16.937   6.554  -5.772  0.50  7.50           N
ATOM   1883  OXTAHIS A  64      17.357   1.996  -5.343  0.50  8.25           O
ATOM   1884  OXTBHIS A  64      17.183   1.543  -5.137  0.50  6.81           O
ATOM   1885  H  AHIS A  64      17.316   1.614  -2.669  0.50  8.57           H
ATOM   1886  H  BHIS A  64      17.252   1.250  -2.407  0.50  6.69           H
ATOM   1887  HA AHIS A  64      15.599   3.615  -3.299  0.50  8.63           H
ATOM   1888  HA BHIS A  64      15.381   3.118  -3.098  0.50  6.81           H
ATOM   1889  HB3AHIS A  64      18.398   3.816  -3.647  0.50  8.80           H
ATOM   1890  HB3BHIS A  64      18.146   3.492  -3.566  0.50  7.02           H
ATOM   1891  HB2AHIS A  64      17.545   4.713  -2.651  0.50  8.80           H
ATOM   1892  HB2BHIS A  64      17.360   4.244  -2.407  0.50  7.02           H
ATOM   1893  HD2AHIS A  64      18.892   5.122  -5.934  0.50  9.12           H
ATOM   1894  HD2BHIS A  64      18.566   5.320  -5.473  0.50  7.38           H
ATOM   1895  HE1AHIS A  64      15.831   7.632  -5.883  0.50  9.20           H
ATOM   1896  HE1BHIS A  64      15.074   7.177  -5.340  0.50  7.44           H
ATOM   1897  O  AHOH S   1       6.003   4.057  -0.363  0.50  4.89           O
ATOM   1898  O  BHOH S   1       5.706   3.826  -0.598  0.50  5.75           O
ATOM   1899  O  AHOH S   2       9.297   1.441  -6.047  0.50  6.78           O
ATOM   1900  O  BHOH S   2       9.438   1.582  -6.293  0.50  6.41           O
ATOM   1901  O  AHOH S   3      12.696   2.959   0.294  0.50  6.84           O
ATOM   1902  O  BHOH S   3      12.691   3.403   0.120  0.50  7.62           O
ATOM   1903  O  AHOH S   4      15.563   4.290   2.044  0.50  9.36           O
ATOM   1904  O  BHOH S   4      15.308   4.497   1.822  0.50 11.09           O
ATOM   1905  O  AHOH S   5     -10.017   5.407  -1.446  0.45  9.63           O
ATOM   1906  O  BHOH S   5     -10.178   4.920  -1.387  0.45  9.26           O
ATOM   1907  O  AHOH S   6      -6.139   9.878  -3.206  0.49  8.37           O
ATOM   1908  O  BHOH S   6      -5.964  10.350  -2.674  0.49  9.31           O
ATOM   1909  O  AHOH S   7       5.501   1.942  -7.741  0.50 11.38           O
ATOM   1910  O  BHOH S   7       5.174   1.839  -7.040  0.50  7.19           O
ATOM   1911  O  AHOH S   8      11.418   7.244  -5.055  0.48  7.21           O
ATOM   1912  O  BHOH S   8      12.376   6.335  -5.068  0.48 15.75           O
ATOM   1913  O  AHOH S   9      11.666  10.837  -6.747  0.41  8.05           O
ATOM   1914  O  BHOH S   9      11.937  10.341  -6.667  0.41 10.00           O
ATOM   1915  O  AHOH S  10      14.973   5.951  -0.556  0.47 15.90           O
ATOM   1916  O  BHOH S  10      15.490   5.890  -0.201  0.47  9.98           O
ATOM   1917  O  AHOH S  11       9.682   5.068  -3.572  0.47  7.62           O
ATOM   1918  O  BHOH S  11      10.057   5.749  -3.511  0.47 15.86           O
ATOM   1919  O  AHOH S  12      -4.087  11.456  -9.398  0.50 10.42           O
ATOM   1920  O  BHOH S  12      -3.878  10.989  -9.941  0.50 13.08           O
ATOM   1921  O  AHOH S  13       5.878   5.538   7.438  0.46  9.31           O
ATOM   1922  O  BHOH S  13       6.096   4.881   7.283  0.46  8.45           O
ATOM   1923  O  AHOH S  14      12.416   2.754  -3.685  0.50  8.77           O
ATOM   1924  O  BHOH S  14      12.073   1.718  -3.996  0.50 26.22           O
ATOM   1925  O  AHOH S  15       0.222  -2.472  -3.378  0.50 10.64           O
ATOM   1926  O  BHOH S  15      -0.558  -2.668  -3.428  0.50 14.77           O
ATOM   1927  O  AHOH S  16      13.565   5.152  -2.408  0.47  9.93           O
ATOM   1928  O  BHOH S  16      13.671   5.402  -3.069  0.47 15.05           O
ATOM   1929  O  AHOH S  17       2.526   6.697 -10.726  0.50 18.44           O
ATOM   1930  O  BHOH S  17       2.161   7.170 -10.555  0.50 13.62           O
ATOM   1931  O  AHOH S  18      10.813  14.082  -7.275  0.40  9.07           O
ATOM   1932  O  BHOH S  18      10.609  14.483  -6.702  0.40  8.91           O
ATOM   1933  O  AHOH S  19       6.573   3.133   9.196  0.50  8.86           O
ATOM   1934  O  BHOH S  19       6.847   1.906  10.162  0.50 17.04           O
ATOM   1935  O  AHOH S  20      -6.271  10.219   0.989  0.49 11.59           O
ATOM   1936  O  BHOH S  20      -6.945  10.418   1.403  0.49 10.65           O
ATOM   1937  O  AHOH S  21      -4.545   5.280  11.100  0.49 13.19           O
ATOM   1938  O  BHOH S  21      -3.914   5.340  11.566  0.49 20.52           O
ATOM   1939  O  AHOH S  22      17.086   7.642  -1.348  0.50 21.61           O
ATOM   1940  O  BHOH S  22      16.790   7.595  -2.132  0.50 12.09           O
ATOM   1941  O  AHOH S  23      -5.520  -4.002  11.664  0.46 13.88           O
ATOM   1942  O  BHOH S  23      -5.551  -3.223  11.956  0.46 12.48           O
ATOM   1943  O  AHOH S  24      -0.382   9.980   9.368  0.47 13.61           O
ATOM   1944  O  BHOH S  24      -0.949  10.391   8.821  0.47 11.33           O
ATOM   1945  O  AHOH S  25      21.099   1.327   5.082  0.50 13.49           O
ATOM   1946  O  BHOH S  25      20.945   1.665   5.746  0.50 20.08           O
ATOM   1947  O  AHOH S  26       5.428  -5.706   2.418  0.41 15.63           O
ATOM   1948  O  BHOH S  26       5.930  -5.737   2.770  0.41 15.33           O
ATOM   1949  O  AHOH S  27      13.421  -3.932  -3.827  0.34  9.10           O
ATOM   1950  O  BHOH S  27      12.971  -4.521  -3.955  0.34 14.31           O
ATOM   1951  O  AHOH S  28      -1.983  13.082  -9.019  0.42 15.02           O
ATOM   1952  O  BHOH S  28      -1.149  13.453  -8.653  0.42 11.02           O
ATOM   1953  O  AHOH S  29       3.551  -2.811   2.448  0.28  7.67           O
ATOM   1954  O  BHOH S  29       3.441  -2.124   2.609  0.28 10.88           O
ATOM   1955  O  AHOH S  30      -2.864  -6.240   3.396  0.50 16.20           O
ATOM   1956  O  BHOH S  30      -3.691  -6.317   3.764  0.50 14.64           O
ATOM   1957  O  AHOH S  31      13.296   4.986  10.014  0.50 15.01           O
ATOM   1958  O  BHOH S  31      13.670   5.591  10.435  0.50 20.09           O
ATOM   1959  O  AHOH S  32      17.687   6.243   6.008  0.50 12.21           O
ATOM   1960  O  BHOH S  32      16.823   5.736   4.019  0.50 18.23           O
ATOM   1961  O  AHOH S  33      19.210   0.693  -2.406  0.50 10.77           O
ATOM   1962  O  BHOH S  33      18.492  -0.207  -2.852  0.50 13.81           O
ATOM   1963  O  AHOH S  34      -7.077  -2.093  13.572  0.43 16.57           O
ATOM   1964  O  BHOH S  34      -6.558  -1.898  14.158  0.43 23.14           O
ATOM   1965  O  AHOH S  35      -0.639   5.918  12.406  0.50 16.36           O
ATOM   1966  O  BHOH S  35       0.130   5.429  12.370  0.50 17.17           O
ATOM   1967  O  AHOH S  36      10.429  -2.123   7.604  0.50 13.36           O
ATOM   1968  O  BHOH S  36       7.083  -7.472   4.590  0.50 12.60           O
ATOM   1969  O  AHOH S  37      -6.580   9.714  -5.826  0.47 12.84           O
ATOM   1970  O  BHOH S  37      -6.251  10.813  -5.643  0.47 21.52           O
ATOM   1971  O  AHOH S  38      20.414   2.392  -2.696  0.41 11.01           O
ATOM   1972  O  BHOH S  38      21.140   2.152  -1.945  0.41 19.57           O
ATOM   1973  O  AHOH S  39      15.973  -4.107  -3.317  0.50 14.97           O
ATOM   1974  O  BHOH S  39      16.764  -3.816  -2.603  0.50 29.61           O
ATOM   1975  O  AHOH S  40       3.233  15.438  -3.473  0.50 17.10           O
ATOM   1976  O  BHOH S  40       3.332  15.774  -2.422  0.50 14.17           O
ATOM   1977  O  AHOH S  41      16.261  -1.814   4.744  0.39 13.61           O
ATOM   1978  O  BHOH S  41      16.577  -1.124   4.166  0.39 12.66           O
ATOM   1979  O  AHOH S  42      -7.558   9.948   5.753  0.50 19.01           O
ATOM   1980  O  BHOH S  42      -7.705  10.183   4.968  0.50 19.00           O
ATOM   1981  O  AHOH S  43      16.535  -3.721   0.980  0.50 19.54           O
ATOM   1982  O  BHOH S  43      16.763  -3.939   1.965  0.50 15.66           O
ATOM   1983  O  AHOH S  44       3.477  -6.394   4.829  0.40 18.24           O
ATOM   1984  O  BHOH S  44       3.435  -5.764   4.058  0.40 11.39           O
ATOM   1985  O  AHOH S  45      22.334   4.204   4.310  0.42 20.48           O
ATOM   1986  O  BHOH S  45      22.057   4.073   5.301  0.42 13.70           O
ATOM   1987  O  AHOH S  46      -5.756   7.883   9.279  0.35 10.81           O
ATOM   1988  O  BHOH S  46      -5.430   8.824   9.597  0.35 17.16           O
ATOM   1989  O  AHOH S  47      -2.091   0.391  -9.787  0.50 14.83           O
ATOM   1990  O  BHOH S  47      -2.847  -0.156  -9.011  0.50 33.29           O
ATOM   1991  O  AHOH S  48       5.306  -8.064   6.561  0.50 14.27           O
ATOM   1992  O  BHOH S  48       4.044  -7.592   6.381  0.50 19.22           O
ATOM   1993  O  AHOH S  49       0.897  14.960  -3.509  0.50 13.66           O
ATOM   1994  O  BHOH S  49       1.122  14.799  -4.841  0.50 21.59           O
ATOM   1995  O  AHOH S  50       1.026  14.277  -5.848  0.39 20.23           O
ATOM   1996  O  BHOH S  50       1.041  13.962  -7.000  0.39 11.91           O
ATOM   1997  O  AHOH S  51      10.572  17.028  -7.324  0.38 15.01           O
ATOM   1998  O  BHOH S  51      10.278  17.082  -6.361  0.38 15.33           O
ATOM   1999  O  AHOH S  52       3.645   9.474   9.288  0.49 19.01           O
ATOM   2000  O  BHOH S  52       3.055   8.502   9.470  0.49 28.26           O
ATOM   2001  O  AHOH S  53       7.369  17.742  -1.079  0.37 16.87           O
ATOM   2002  O  BHOH S  53       6.602  17.779  -1.720  0.37 15.85           O
ATOM   2003  O  AHOH S  54      -7.674   5.264  -7.049  0.41 17.72           O
ATOM   2004  O  BHOH S  54      -7.334   5.795  -7.686  0.41 16.71           O
ATOM   2005  O  AHOH S  55      -6.290  11.911  -7.374  0.34 14.57           O
ATOM   2006  O  BHOH S  55      -5.956  12.452  -8.218  0.34 20.85           O
ATOM   2007  O  AHOH S  56      -6.114   1.830  15.363  0.37 15.05           O
ATOM   2008  O  BHOH S  56      -5.175   1.751  15.789  0.37 18.27           O
ATOM   2009  O  AHOH S  57       8.273  11.902   5.506  0.41 16.79           O
ATOM   2010  O  BHOH S  57       6.899  12.472   5.543  0.41 14.98           O
ATOM   2011  O  AHOH S  58      -8.769   0.611   6.876  0.50 20.17           O
ATOM   2012  O  BHOH S  58      -7.639  -1.051   7.389  0.50 20.02           O
ATOM   2013  O  AHOH S  59      -0.270  -0.259  14.331  0.32 12.96           O
ATOM   2014  O  BHOH S  59      -0.973   0.357  14.771  0.32 13.71           O
ATOM   2015  O  AHOH S  60       8.483   5.606   8.061  0.50 25.95           O
ATOM   2016  O  BHOH S  60       8.773   6.628   7.449  0.50 18.08           O
ATOM   2017  O  AHOH S  61      14.631   4.597   6.561  0.33 14.37           O
ATOM   2018  O  BHOH S  61      15.560   4.896   5.932  0.33 13.29           O
ATOM   2019  O  AHOH S  62      17.509   4.734   7.848  0.50 18.65           O
ATOM   2020  O  BHOH S  62      18.511   4.207   8.119  0.50 20.93           O
ATOM   2021  O  AHOH S  63       1.856  -3.681  -7.106  0.27 11.52           O
ATOM   2022  O  BHOH S  63       1.107  -3.352  -7.529  0.27 16.11           O
ATOM   2023  O  AHOH S  64      18.063   7.448   2.418  0.50 21.18           O
ATOM   2024  O  BHOH S  64      17.362   7.782   1.647  0.50 27.40           O
ATOM   2025  O  AHOH S  65       6.744  -6.221  -4.184  0.45 25.35           O
ATOM   2026  O  BHOH S  65       6.720  -5.765  -4.929  0.45 17.84           O
ATOM   2027  O  AHOH S  66       1.579  16.575  -1.621  0.50 25.33           O
ATOM   2028  O  BHOH S  66      -0.058  16.281  -1.107  0.50 19.90           O
ATOM   2029  O  AHOH S  67     -11.183   2.430   0.733  0.32 18.90           O
ATOM   2030  O  BHOH S  67     -11.716   2.662  -0.309  0.32 16.81           O
ATOM   2031  O  AHOH S  69      -9.175  -3.745  -2.401  0.50 21.35           O
ATOM   2032  O  BHOH S  69      -8.563  -4.581  -1.612  0.50 25.12           O
ATOM   2033  O  AHOH S  70      -4.771   9.685   9.799  0.24 10.01           O
ATOM   2034  O  BHOH S  70      -4.192  10.488   9.943  0.24  9.21           O
ATOM   2035  O  AHOH S  71      -4.455  -1.434  16.667  0.30 14.14           O
ATOM   2036  O  BHOH S  71      -3.356  -0.774  16.638  0.30 20.54           O
ATOM   2037  O  AHOH S  72      12.863   5.489   7.809  0.34 18.03           O
ATOM   2038  O  BHOH S  72      13.700   5.285   7.092  0.34 15.70           O
ATOM   2039  O  AHOH S  74       4.278   4.743   9.893  0.30 26.04           O
ATOM   2040  O  BHOH S  74       3.789   3.648   9.882  0.30 14.75           O
ATOM   2041  O  AHOH S  75     -11.171   1.685   4.781  0.35 20.05           O
ATOM   2042  O  BHOH S  75     -10.647   2.053   5.658  0.35 14.41           O
ATOM   2043  O  AHOH S  76      -5.125  -5.750  10.936  0.23 14.35           O
ATOM   2044  O  BHOH S  76      -4.267  -6.423  10.891  0.23 12.46           O
ATOM   2045  O  AHOH S  77      11.668  15.494   3.569  0.50 31.32           O
ATOM   2046  O  BHOH S  77      12.063  16.822   3.470  0.50 20.80           O
ATOM   2047  O  AHOH S  78       5.167   3.518 -10.275  0.50 24.30           O
ATOM   2048  O  BHOH S  78       4.293   4.258 -10.444  0.50 21.17           O
ATOM   2049  O  AHOH S  79      -9.861  -2.369   0.293  0.50 24.72           O
ATOM   2050  O  BHOH S  79      -9.861  -0.815   1.474  0.50 21.74           O
END