ó
À™xTc           @   s�   d  d l  m Z d  d l Z d d g d d g d d g d d	 g d
 d g d d g d d g g Z d  d l m Z d „  Z d „  Z e d k r™ e ƒ  n  d S(   iÿÿÿÿ(   t   divisionNs4
  
ATOM      1  N   ALA A   1      -1.521   3.898   0.713  1.00 20.00      A    N+1
ATOM      2  H   ALA A   1      -1.675   4.606   1.277  1.00 20.00      A    H
ATOM      3  H2  ALA A   1      -2.026   3.996  -0.045  1.00 20.00      A    H
ATOM      4  H3  ALA A   1      -0.632   3.875   0.487  1.00 20.00      A    H
ATOM      5  CA  ALA A   1      -1.879   2.678   1.370  1.00 20.00      A    C
ATOM      6  HA  ALA A   1      -1.349   2.598   2.189  1.00 20.00      A    H
ATOM      7  CB  ALA A   1      -3.346   2.715   1.747  1.00 20.00      A    C
ATOM      8  HB1 ALA A   1      -3.507   3.466   2.360  1.00 20.00      A    H
ATOM      9  HB2 ALA A   1      -3.592   1.873   2.188  1.00 20.00      A    H
ATOM     10  HB3 ALA A   1      -3.886   2.831   0.942  1.00 20.00      A    H
ATOM     11  C   ALA A   1      -1.551   1.486   0.458  1.00 20.00      A    C
ATOM     12  O   ALA A   1      -2.007   1.439  -0.662  1.00 20.00      A    O
ATOM     13  N   ALA A   2      -0.744   0.404   0.952  1.00 20.00      A    N
ATOM     14  H   ALA A   2      -0.359   0.462   1.781  1.00 20.00      A    H
ATOM     15  CA  ALA A   2      -0.493  -0.749   0.119  1.00 20.00      A    C
ATOM     16  HA  ALA A   2      -0.668  -0.439  -0.791  1.00 20.00      A    H
ATOM     17  CB  ALA A   2      -1.476  -1.885   0.331  1.00 20.00      A    C
ATOM     18  HB1 ALA A   2      -1.345  -2.266   1.221  1.00 20.00      A    H
ATOM     19  HB2 ALA A   2      -1.326  -2.579  -0.349  1.00 20.00      A    H
ATOM     20  HB3 ALA A   2      -2.395  -1.542   0.252  1.00 20.00      A    H
ATOM     21  C   ALA A   2       0.972  -1.193   0.100  1.00 20.00      A    C
ATOM     22  O   ALA A   2       1.603  -1.231   1.129  1.00 20.00      A    O
ATOM     23  N   ALA A   3       1.569  -1.642  -1.120  1.00 20.00      A    N
ATOM     24  H   ALA A   3       1.050  -1.766  -1.865  1.00 20.00      A    H
ATOM     25  CA  ALA A   3       2.971  -1.947  -1.163  1.00 20.00      A    C
ATOM     26  HA  ALA A   3       3.432  -1.386  -0.509  1.00 20.00      A    H
ATOM     27  CB  ALA A   3       3.520  -1.630  -2.540  1.00 20.00      A    C
ATOM     28  HB1 ALA A   3       4.474  -1.845  -2.568  1.00 20.00      A    H
ATOM     29  HB2 ALA A   3       3.393  -0.674  -2.732  1.00 20.00      A    H
ATOM     30  HB3 ALA A   3       3.045  -2.163  -3.211  1.00 20.00      A    H
ATOM     31  C   ALA A   3       3.187  -3.395  -0.790  1.00 20.00      A    C
ATOM     32  O   ALA A   3       2.646  -4.306  -1.466  1.00 20.00      A    O
ATOM     33  OXT ALA A   3       3.917  -3.690   0.195  1.00 20.00      A    O-1
sõ  
ATOM      1  N   ALA A   1      -1.521   3.898   0.713  1.00 20.00      A    N+1
ATOM      5  CA  ALA A   1      -1.879   2.678   1.370  1.00 20.00      A    C
ATOM      7  CB  ALA A   1      -3.346   2.715   1.747  1.00 20.00      A    C
ATOM     11  C   ALA A   1      -1.551   1.486   0.458  1.00 20.00      A    C
ATOM     12  O   ALA A   1      -2.007   1.439  -0.662  1.00 20.00      A    O
ATOM     13  N   ALA A   2      -0.744   0.404   0.952  1.00 20.00      A    N
ATOM     15  CA  ALA A   2      -0.493  -0.749   0.119  1.00 20.00      A    C
ATOM     17  CB  ALA A   2      -1.476  -1.885   0.331  1.00 20.00      A    C
ATOM     21  C   ALA A   2       0.972  -1.193   0.100  1.00 20.00      A    C
ATOM     22  O   ALA A   2       1.603  -1.231   1.129  1.00 20.00      A    O
ATOM     23  N   ALA A   3       1.569  -1.642  -1.120  1.00 20.00      A    N
ATOM     25  CA  ALA A   3       2.971  -1.947  -1.163  1.00 20.00      A    C
ATOM     27  CB  ALA A   3       3.520  -1.630  -2.540  1.00 20.00      A    C
ATOM     31  C   ALA A   3       3.187  -3.395  -0.790  1.00 20.00      A    C
ATOM     32  O   ALA A   3       2.646  -4.306  -1.466  1.00 20.00      A    O
ATOM     33  OXT ALA A   3       3.917  -3.690   0.195  1.00 20.00      A    O-1
sõ  
ATOM      1  N   ALA A   1      -1.521   3.898   0.713  1.00 20.00      A    N+1
ATOM      2  CA  ALA A   1      -1.879   2.678   1.370  1.00 20.00      A    C
ATOM      3  CB  ALA A   1      -3.346   2.715   1.747  1.00 20.00      A    C
ATOM      4  C   ALA A   1      -1.551   1.486   0.458  1.00 20.00      A    C
ATOM      5  O   ALA A   1      -2.007   1.439  -0.662  1.00 20.00      A    O
ATOM      6  N   ALA A   2      -0.744   0.404   0.952  1.00 20.00      A    N
ATOM      7  CA  ALA A   2      -0.493  -0.749   0.119  1.00 20.00      A    C
ATOM      8  CB  ALA A   2      -1.476  -1.885   0.331  1.00 20.00      A    C
ATOM      9  C   ALA A   2       0.972  -1.193   0.100  1.00 20.00      A    C
ATOM     10  O   ALA A   2       1.603  -1.231   1.129  1.00 20.00      A    O
ATOM     11  N   ALA A   3       1.569  -1.642  -1.120  1.00 20.00      A    N
ATOM     12  CA  ALA A   3       2.971  -1.947  -1.163  1.00 20.00      A    C
ATOM     13  CB  ALA A   3       3.520  -1.630  -2.540  1.00 20.00      A    C
ATOM     14  C   ALA A   3       3.187  -3.395  -0.790  1.00 20.00      A    C
ATOM     15  O   ALA A   3       2.646  -4.306  -1.466  1.00 20.00      A    O
ATOM     16  OXT ALA A   3       3.917  -3.690   0.195  1.00 20.00      A    O-1
sD  
ATOM      1  N   ALA A   1      -1.521   3.898   0.713  1.00 20.00      A    N+1
ATOM      5  CA  ALA A   1      -1.879   2.678   1.370  1.00 20.00      A    C
ATOM      7  CB  ALA A   1      -3.346   2.715   1.747  1.00 20.00      A    C
ATOM     11  C   ALA A   1      -1.551   1.486   0.458  1.00 20.00      A    C
ATOM     12  O   ALA A   1      -2.007   1.439  -0.662  1.00 20.00      A    O
ATOM     13  N   ALA A   2      -0.744   0.404   0.952  1.00 20.00      A    N
ATOM     15  CA  ALA A   2      -0.493  -0.749   0.119  1.00 20.00      A    C
ATOM     17  CB AALA A   2      -1.476  -1.885   0.331  1.00 20.00      A    C
ATOM     17  CB BALA A   2      -1.476  -1.885   0.331  1.00 20.00      A    C
ATOM     21  C   ALA A   2       0.972  -1.193   0.100  1.00 20.00      A    C
ATOM     22  O   ALA A   2       1.603  -1.231   1.129  1.00 20.00      A    O
ATOM     23  N   ALA A   3       1.569  -1.642  -1.120  1.00 20.00      A    N
ATOM     25  CA  ALA A   3       2.971  -1.947  -1.163  1.00 20.00      A    C
ATOM     27  CB  ALA A   3       3.520  -1.630  -2.540  1.00 20.00      A    C
ATOM     31  C   ALA A   3       3.187  -3.395  -0.790  1.00 20.00      A    C
ATOM     32  O   ALA A   3       2.646  -4.306  -1.466  1.00 20.00      A    O
ATOM     33  OXT ALA A   3       3.917  -3.690   0.195  1.00 20.00      A    O-1
sD  
ATOM      1  N   ALA A   1      -1.521   3.898   0.713  1.00 20.00      A    N+1
ATOM      2  CA  ALA A   1      -1.879   2.678   1.370  1.00 20.00      A    C
ATOM      3  CB  ALA A   1      -3.346   2.715   1.747  1.00 20.00      A    C
ATOM      4  C   ALA A   1      -1.551   1.486   0.458  1.00 20.00      A    C
ATOM      5  O   ALA A   1      -2.007   1.439  -0.662  1.00 20.00      A    O
ATOM      6  N   ALA A   2      -0.744   0.404   0.952  1.00 20.00      A    N
ATOM      7  CA  ALA A   2      -0.493  -0.749   0.119  1.00 20.00      A    C
ATOM      8  C   ALA A   2       0.972  -1.193   0.100  1.00 20.00      A    C
ATOM      9  O   ALA A   2       1.603  -1.231   1.129  1.00 20.00      A    O
ATOM     10  CB AALA A   2      -1.476  -1.885   0.331  0.50 20.00      A    C
ATOM     11  CB BALA A   2      -1.476  -1.885   0.331  0.50 20.00      A    C
ATOM     12  N   ALA A   3       1.569  -1.642  -1.120  1.00 20.00      A    N
ATOM     13  CA  ALA A   3       2.971  -1.947  -1.163  1.00 20.00      A    C
ATOM     14  CB  ALA A   3       3.520  -1.630  -2.540  1.00 20.00      A    C
ATOM     15  C   ALA A   3       3.187  -3.395  -0.790  1.00 20.00      A    C
ATOM     16  O   ALA A   3       2.646  -4.306  -1.466  1.00 20.00      A    O
ATOM     17  OXT ALA A   3       3.917  -3.690   0.195  1.00 20.00      A    O-1
sD  
ATOM      1  N   ALA A   1      -1.521   3.898   0.713  1.00 20.00      A    N+1
ATOM      5  CA  ALA A   1      -1.879   2.678   1.370  1.00 20.00      A    C
ATOM      7  CB  ALA A   1      -3.346   2.715   1.747  1.00 20.00      A    C
ATOM     11  C   ALA A   1      -1.551   1.486   0.458  1.00 20.00      A    C
ATOM     12  O   ALA A   1      -2.007   1.439  -0.662  1.00 20.00      A    O
ATOM     13  N   ALA A   2      -0.744   0.404   0.952  1.00 20.00      A    N
ATOM     15  CA  ALA A   2      -0.493  -0.749   0.119  1.00 20.00      A    C
ATOM     17  CB AALA A   2      -1.976  -1.885   0.331  1.00 20.00      A    C
ATOM     17  CB BALA A   2      -1.476  -1.885   0.331  1.00 20.00      A    C
ATOM     21  C   ALA A   2       0.972  -1.193   0.100  1.00 20.00      A    C
ATOM     22  O   ALA A   2       1.603  -1.231   1.129  1.00 20.00      A    O
ATOM     23  N   ALA A   3       1.569  -1.642  -1.120  1.00 20.00      A    N
ATOM     25  CA  ALA A   3       2.971  -1.947  -1.163  1.00 20.00      A    C
ATOM     27  CB  ALA A   3       3.520  -1.630  -2.540  1.00 20.00      A    C
ATOM     31  C   ALA A   3       3.187  -3.395  -0.790  1.00 20.00      A    C
ATOM     32  O   ALA A   3       2.646  -4.306  -1.466  1.00 20.00      A    O
ATOM     33  OXT ALA A   3       3.917  -3.690   0.195  1.00 20.00      A    O-1
sm  
ATOM      1  N   ALA A   1      -1.521   3.898   0.713  1.00 20.00      A    N+1
ATOM      2  CA  ALA A   1      -1.879   2.678   1.370  1.00 20.00      A    C
ATOM      3  CB  ALA A   1      -3.346   2.715   1.747  1.00 20.00      A    C
ATOM      4  C  AALA A   1      -1.551   1.486   0.458  0.50 20.00      A    C
ATOM      5  O  AALA A   1      -2.007   1.439  -0.662  0.50 20.00      A    O
ATOM      6  C  BALA A   1      -1.551   1.486   0.458  0.50 20.00      A    C
ATOM      7  O  BALA A   1      -2.007   1.439  -0.662  0.50 20.00      A    O
ATOM      8  CB AALA A   2      -1.976  -1.885   0.331  0.50 20.00      A    C
ATOM      9  N  AALA A   2      -0.744   0.404   0.952  0.50 20.00      A    N
ATOM     10  CA AALA A   2      -0.493  -0.749   0.119  0.50 20.00      A    C
ATOM     11  C  AALA A   2       0.972  -1.193   0.100  0.50 20.00      A    C
ATOM     12  O  AALA A   2       1.603  -1.231   1.129  0.50 20.00      A    O
ATOM     13  CB BALA A   2      -1.476  -1.885   0.331  0.50 20.00      A    C
ATOM     14  N  BALA A   2      -0.744   0.404   0.952  0.50 20.00      A    N
ATOM     15  CA BALA A   2      -0.493  -0.749   0.119  0.50 20.00      A    C
ATOM     16  C  BALA A   2       0.972  -1.193   0.100  0.50 20.00      A    C
ATOM     17  O  BALA A   2       1.603  -1.231   1.129  0.50 20.00      A    O
ATOM     18  CA  ALA A   3       2.971  -1.947  -1.163  1.00 20.00      A    C
ATOM     19  CB  ALA A   3       3.520  -1.630  -2.540  1.00 20.00      A    C
ATOM     20  C   ALA A   3       3.187  -3.395  -0.790  1.00 20.00      A    C
ATOM     21  O   ALA A   3       2.646  -4.306  -1.466  1.00 20.00      A    O
ATOM     22  OXT ALA A   3       3.917  -3.690   0.195  1.00 20.00      A    O-1
ATOM     23  N  AALA A   3       1.569  -1.642  -1.120  0.50 20.00      A    N
ATOM     24  N  BALA A   3       1.569  -1.642  -1.120  0.50 20.00      A    N
s€  
ATOM      1  N   ALA A   1      -1.521   3.898   0.713  1.00 20.00      A    N+1
ATOM      5  CA  ALA A   1      -1.879   2.678   1.370  1.00 20.00      A    C
ATOM      7  CB  ALA A   1      -3.346   2.715   1.747  1.00 20.00      A    C
ATOM     11  C   ALA A   1      -1.551   1.486   0.458  1.00 20.00      A    C
ATOM     12  O   ALA A   1      -2.007   1.439  -0.662  1.00 20.00      A    O
ATOM     13  N  AALA A   2      -0.744   0.404   0.952  1.00 20.00      A    N
ATOM     15  CA AALA A   2      -0.493  -0.749   0.119  1.00 20.00      A    C
ATOM     17  CB AALA A   2      -1.976  -1.885   0.331  1.00 20.00      A    C
ATOM     21  C  AALA A   2       0.972  -1.193   0.100  1.00 20.00      A    C
ATOM     22  O  AALA A   2       1.603  -1.231   1.129  1.00 20.00      A    O
ATOM     13  N  BALA A   2      -0.744   0.404   0.952  1.00 20.00      A    N
ATOM     15  CA BALA A   2      -0.493  -0.749   0.119  1.00 20.00      A    C
ATOM     17  CB BALA A   2      -1.976  -1.885   0.331  1.00 20.00      A    C
ATOM     21  C  BALA A   2       0.972  -1.193   0.100  1.00 20.00      A    C
ATOM     22  O  BALA A   2       1.603  -1.231   1.129  1.00 20.00      A    O
ATOM     23  N   ALA A   3       1.569  -1.642  -1.120  1.00 20.00      A    N
ATOM     25  CA  ALA A   3       2.971  -1.947  -1.163  1.00 20.00      A    C
ATOM     27  CB  ALA A   3       3.520  -1.630  -2.540  1.00 20.00      A    C
ATOM     31  C   ALA A   3       3.187  -3.395  -0.790  1.00 20.00      A    C
ATOM     32  O   ALA A   3       2.646  -4.306  -1.466  1.00 20.00      A    O
ATOM     33  OXT ALA A   3       3.917  -3.690   0.195  1.00 20.00      A    O-1
sm  
ATOM      1  N   ALA A   1      -1.521   3.898   0.713  1.00 20.00      A    N+1
ATOM      2  CA  ALA A   1      -1.879   2.678   1.370  1.00 20.00      A    C
ATOM      3  CB  ALA A   1      -3.346   2.715   1.747  1.00 20.00      A    C
ATOM      4  C  AALA A   1      -1.551   1.486   0.458  0.50 20.00      A    C
ATOM      5  O  AALA A   1      -2.007   1.439  -0.662  0.50 20.00      A    O
ATOM      6  C  BALA A   1      -1.551   1.486   0.458  0.50 20.00      A    C
ATOM      7  O  BALA A   1      -2.007   1.439  -0.662  0.50 20.00      A    O
ATOM      8  N  AALA A   2      -0.744   0.404   0.952  0.50 20.00      A    N
ATOM      9  CA AALA A   2      -0.493  -0.749   0.119  0.50 20.00      A    C
ATOM     10  CB AALA A   2      -1.976  -1.885   0.331  0.50 20.00      A    C
ATOM     11  C  AALA A   2       0.972  -1.193   0.100  0.50 20.00      A    C
ATOM     12  O  AALA A   2       1.603  -1.231   1.129  0.50 20.00      A    O
ATOM     13  N  BALA A   2      -0.744   0.404   0.952  0.50 20.00      A    N
ATOM     14  CA BALA A   2      -0.493  -0.749   0.119  0.50 20.00      A    C
ATOM     15  CB BALA A   2      -1.976  -1.885   0.331  0.50 20.00      A    C
ATOM     16  C  BALA A   2       0.972  -1.193   0.100  0.50 20.00      A    C
ATOM     17  O  BALA A   2       1.603  -1.231   1.129  0.50 20.00      A    O
ATOM     18  CA  ALA A   3       2.971  -1.947  -1.163  1.00 20.00      A    C
ATOM     19  CB  ALA A   3       3.520  -1.630  -2.540  1.00 20.00      A    C
ATOM     20  C   ALA A   3       3.187  -3.395  -0.790  1.00 20.00      A    C
ATOM     21  O   ALA A   3       2.646  -4.306  -1.466  1.00 20.00      A    O
ATOM     22  OXT ALA A   3       3.917  -3.690   0.195  1.00 20.00      A    O-1
ATOM     23  N  AALA A   3       1.569  -1.642  -1.120  0.50 20.00      A    N
ATOM     24  N  BALA A   3       1.569  -1.642  -1.120  0.50 20.00      A    N
s€  
ATOM      1  N   ALA A   1      -1.521   3.898   0.713  1.00 20.00      A    N+1
ATOM      5  CA  ALA A   1      -1.879   2.678   1.370  1.00 20.00      A    C
ATOM      7  CB  ALA A   1      -3.346   2.715   1.747  1.00 20.00      A    C
ATOM     11  C   ALA A   1      -1.551   1.486   0.458  1.00 20.00      A    C
ATOM     12  O   ALA A   1      -2.007   1.439  -0.662  1.00 20.00      A    O
ATOM     13  N  AALA A   2      -0.744   0.404   0.952  1.00 20.00      A    N
ATOM     13  N  BALA A   2      -0.744   0.404   0.952  1.00 20.00      A    N
ATOM     15  CA AALA A   2      -0.493  -0.749   0.119  1.00 20.00      A    C
ATOM     15  CA BALA A   2      -0.493  -0.749   0.119  1.00 20.00      A    C
ATOM     17  CB AALA A   2      -1.976  -1.885   0.331  1.00 20.00      A    C
ATOM     17  CB BALA A   2      -1.976  -1.885   0.331  1.00 20.00      A    C
ATOM     21  C  AALA A   2       0.972  -1.193   0.100  1.00 20.00      A    C
ATOM     21  C  BALA A   2       0.972  -1.193   0.100  1.00 20.00      A    C
ATOM     22  O  AALA A   2       1.603  -1.231   1.129  1.00 20.00      A    O
ATOM     22  O  BALA A   2       1.603  -1.231   1.129  1.00 20.00      A    O
ATOM     23  N   ALA A   3       1.569  -1.642  -1.120  1.00 20.00      A    N
ATOM     25  CA  ALA A   3       2.971  -1.947  -1.163  1.00 20.00      A    C
ATOM     27  CB  ALA A   3       3.520  -1.630  -2.540  1.00 20.00      A    C
ATOM     31  C   ALA A   3       3.187  -3.395  -0.790  1.00 20.00      A    C
ATOM     32  O   ALA A   3       2.646  -4.306  -1.466  1.00 20.00      A    O
ATOM     33  OXT ALA A   3       3.917  -3.690   0.195  1.00 20.00      A    O-1
s  
ATOM    757  N   GLY A 103      21.999  10.712   0.961  1.00  4.33           N
ATOM    758  CA  GLY A 103      21.040  11.791   1.055  1.00  4.23           C
ATOM    759  C   GLY A 103      19.704  11.419   0.439  1.00  3.85           C
ATOM    760  O   GLY A 103      19.580  10.539  -0.422  1.00  4.32           O
ATOM    761  N   GLU A 104      18.680  12.148   0.879  1.00  3.87           N
ATOM    762  CA  GLU A 104      17.299  11.909   0.484  1.00  3.91           C
ATOM    763  O   GLU A 104      17.826  13.338  -1.410  1.00  4.76           O
ATOM    764  CB  GLU A 104      16.372  12.308   1.645  1.00  4.08           C
ATOM    765  CG  GLU A 104      16.686  11.548   2.930  1.00  4.59           C
ATOM    766  CD  GLU A 104      17.829  12.093   3.786  1.00  5.00           C
ATOM    767  OE1 GLU A 104      18.152  11.408   4.823  1.00  6.45           O
ATOM    768  OE2 GLU A 104      18.390  13.159   3.470  1.00  5.26           O
ATOM    769  C  AGLU A 104      16.973  12.646  -0.808  0.50  3.96           C
ATOM    770  C  BGLU A 104      16.975  12.684  -0.800  0.50  3.89           C
ATOM    771  N  ALEU A 105      15.717  12.499  -1.259  0.50  4.06           N
ATOM    772  CA ALEU A 105      15.284  13.059  -2.541  0.50  4.88           C
ATOM    773  C  ALEU A 105      15.637  14.444  -2.871  0.50  4.43           C
ATOM    774  O  ALEU A 105      15.735  14.769  -4.050  0.50  6.07           O
ATOM    775  CB ALEU A 105      13.730  13.346  -2.655  0.50  3.54           C
ATOM    776  CG ALEU A 105      13.190  11.968  -3.122  0.50  3.81           C
ATOM    777  CD1ALEU A 105      11.685  12.054  -3.263  0.50  4.54           C
ATOM    778  CD2ALEU A 105      13.804  11.453  -4.425  0.50  4.05           C
ATOM    779  N  BLEU A 105      15.711  12.640  -1.220  0.50  3.57           N
ATOM    780  CA BLEU A 105      15.237  13.396  -2.364  0.50  4.37           C
ATOM    781  C  BLEU A 105      15.537  14.890  -2.046  0.50  3.47           C
ATOM    782  O  BLEU A 105      15.411  15.372  -0.929  0.50  3.89           O
ATOM    783  CB BLEU A 105      13.764  12.747  -2.519  0.50  4.65           C
ATOM    784  CG BLEU A 105      13.014  12.862  -3.842  0.50  6.20           C
ATOM    785  CD1BLEU A 105      13.508  11.889  -4.865  0.50  7.64           C
ATOM    786  CD2BLEU A 105      11.548  12.657  -3.620  0.50  5.53           C
ATOM    787  N  AGLY A 106      15.734  15.299  -1.857  0.50  4.10           N
ATOM    788  CA AGLY A 106      16.043  16.715  -2.048  0.50  5.76           C
ATOM    789  C  AGLY A 106      17.449  17.119  -1.650  0.50  4.81           C
ATOM    790  O  AGLY A 106      17.778  18.310  -1.696  0.50  5.91           O
ATOM    791  N  BGLY A 106      15.975  15.616  -3.081  0.50  3.71           N
ATOM    792  CA BGLY A 106      16.294  17.031  -2.939  0.50  4.59           C
ATOM    793  C  BGLY A 106      17.649  17.368  -2.295  0.50  4.30           C
ATOM    794  O  BGLY A 106      18.056  18.524  -2.339  0.50  4.74           O
ATOM    795  CA  SER A 107      19.612  16.580  -0.930  1.00  4.51           C
ATOM    796  C   SER A 107      20.554  17.027  -2.048  1.00  4.08           C
ATOM    797  O   SER A 107      20.441  16.592  -3.191  1.00  4.85           O
ATOM    798  CB  SER A 107      20.205  15.355  -0.212  1.00  4.55           C
ATOM    799  OG  SER A 107      20.403  14.244  -1.072  1.00  4.35           O
ATOM    800  N  ASER A 107      18.312  16.190  -1.350  0.50  5.31           N
ATOM    801  N  BSER A 107      18.278  16.387  -1.593  0.50  5.42           N
ATOM    802  N   PRO A 108      21.538  17.876  -1.717  1.00  4.04           N
ATOM    803  CA  PRO A 108      22.472  18.325  -2.750  1.00  4.37           C
ATOM    804  C   PRO A 108      23.241  17.187  -3.437  1.00  4.03           C
ATOM    805  O   PRO A 108      23.746  16.255  -2.804  1.00  4.51           O
ATOM    806  CB  PRO A 108      23.413  19.264  -1.990  1.00  4.85           C
ATOM    807  CG  PRO A 108      22.520  19.852  -0.907  1.00  5.00           C
ATOM    808  CD  PRO A 108      21.676  18.668  -0.477  1.00  4.48           C
s\  
ATOM      1  N   GLY A 103      21.999  10.712   0.961  1.00  4.33           N
ATOM      2  CA  GLY A 103      21.040  11.791   1.055  1.00  4.23           C
ATOM      3  C   GLY A 103      19.704  11.419   0.439  1.00  3.85           C
ATOM      4  O   GLY A 103      19.580  10.539  -0.422  1.00  4.32           O
ATOM      5  N   GLU A 104      18.680  12.148   0.879  1.00  3.87           N
ATOM      6  CA  GLU A 104      17.299  11.909   0.484  1.00  3.91           C
ATOM      7  CB  GLU A 104      16.372  12.308   1.645  1.00  4.08           C
ATOM      8  CG  GLU A 104      16.686  11.548   2.930  1.00  4.59           C
ATOM      9  CD  GLU A 104      17.829  12.093   3.786  1.00  5.00           C
ATOM     10  OE1 GLU A 104      18.152  11.408   4.823  1.00  6.45           O
ATOM     11  OE2 GLU A 104      18.390  13.159   3.470  1.00  5.26           O
ATOM     12  C  AGLU A 104      16.973  12.646  -0.808  0.50  3.96           C
ATOM     13  O  AGLU A 104      17.826  13.338  -1.410  0.50  4.76           O
ATOM     14  C  BGLU A 104      16.975  12.684  -0.800  0.50  3.89           C
ATOM     15  O  BGLU A 104      17.826  13.338  -1.410  0.50  4.76           O
ATOM     16  N  ALEU A 105      15.717  12.499  -1.259  0.50  4.06           N
ATOM     17  CA ALEU A 105      15.284  13.059  -2.541  0.50  4.88           C
ATOM     18  C  ALEU A 105      15.637  14.444  -2.871  0.50  4.43           C
ATOM     19  O  ALEU A 105      15.735  14.769  -4.050  0.50  6.07           O
ATOM     20  CB ALEU A 105      13.730  13.346  -2.655  0.50  3.54           C
ATOM     21  CG ALEU A 105      13.190  11.968  -3.122  0.50  3.81           C
ATOM     22  CD1ALEU A 105      11.685  12.054  -3.263  0.50  4.54           C
ATOM     23  CD2ALEU A 105      13.804  11.453  -4.425  0.50  4.05           C
ATOM     24  N  BLEU A 105      15.711  12.640  -1.220  0.50  3.57           N
ATOM     25  CA BLEU A 105      15.237  13.396  -2.364  0.50  4.37           C
ATOM     26  C  BLEU A 105      15.537  14.890  -2.046  0.50  3.47           C
ATOM     27  O  BLEU A 105      15.411  15.372  -0.929  0.50  3.89           O
ATOM     28  CB BLEU A 105      13.764  12.747  -2.519  0.50  4.65           C
ATOM     29  CG BLEU A 105      13.014  12.862  -3.842  0.50  6.20           C
ATOM     30  CD1BLEU A 105      13.508  11.889  -4.865  0.50  7.64           C
ATOM     31  CD2BLEU A 105      11.548  12.657  -3.620  0.50  5.53           C
ATOM     32  N  AGLY A 106      15.734  15.299  -1.857  0.50  4.10           N
ATOM     33  CA AGLY A 106      16.043  16.715  -2.048  0.50  5.76           C
ATOM     34  C  AGLY A 106      17.449  17.119  -1.650  0.50  4.81           C
ATOM     35  O  AGLY A 106      17.778  18.310  -1.696  0.50  5.91           O
ATOM     36  N  BGLY A 106      15.975  15.616  -3.081  0.50  3.71           N
ATOM     37  CA BGLY A 106      16.294  17.031  -2.939  0.50  4.59           C
ATOM     38  C  BGLY A 106      17.649  17.368  -2.295  0.50  4.30           C
ATOM     39  O  BGLY A 106      18.056  18.524  -2.339  0.50  4.74           O
ATOM     40  CA  SER A 107      19.612  16.580  -0.930  1.00  4.51           C
ATOM     41  C   SER A 107      20.554  17.027  -2.048  1.00  4.08           C
ATOM     42  O   SER A 107      20.441  16.592  -3.191  1.00  4.85           O
ATOM     43  CB  SER A 107      20.205  15.355  -0.212  1.00  4.55           C
ATOM     44  OG  SER A 107      20.403  14.244  -1.072  1.00  4.35           O
ATOM     45  N  ASER A 107      18.312  16.190  -1.350  0.50  5.31           N
ATOM     46  N  BSER A 107      18.278  16.387  -1.593  0.50  5.42           N
ATOM     47  N   PRO A 108      21.538  17.876  -1.717  1.00  4.04           N
ATOM     48  CA  PRO A 108      22.472  18.325  -2.750  1.00  4.37           C
ATOM     49  C   PRO A 108      23.241  17.187  -3.437  1.00  4.03           C
ATOM     50  O   PRO A 108      23.746  16.255  -2.804  1.00  4.51           O
ATOM     51  CB  PRO A 108      23.413  19.264  -1.990  1.00  4.85           C
ATOM     52  CG  PRO A 108      22.520  19.852  -0.907  1.00  5.00           C
ATOM     53  CD  PRO A 108      21.676  18.668  -0.477  1.00  4.48           C
(   t   easy_runc         C   sa   d „  } xQ | |  ƒ D]C } x: | | ƒ D] } | | k r) Pq) q) W| GH| GHd s t  ‚ q Wd  S(   Nc         s   sV   xO |  j  d ƒ D]> } | j d ƒ d k r1 q n  | j ƒ  sC q n  | j ƒ  Vq Wd  S(   Ns   
t   TERiÿÿÿÿ(   t   splitt   findt   strip(   t   stringt   line(    (    sS   /public2/ftp/pub/ccp4/6.5/ccp4-6.5/lib/py2/mmtbx/regression/tst_altloc_remediate.pyt   generate_lines–  s      i    (   t   AssertionError(   t   s1t   s2R   t   l1t   l2(    (    sS   /public2/ftp/pub/ccp4/6.5/ccp4-6.5/lib/py2/mmtbx/regression/tst_altloc_remediate.pyt   assert_lines•  s    	 c          C   så   xÙ t  t ƒ D]Ë \ }  \ } } d |  } d d GH| GHd d GH| GHd d GHt d | d ƒ } | j | ƒ | j ƒ  d d | } | GHt j | ƒ t d | d ƒ } | j ƒ  } | j ƒ  | GH| GHt | | ƒ q Wd	 GHd  S(
   Ns   tst_altloc_remediate_%02dt   -iP   s   %s.pdbt   wbs   mmtbx.altloc_remediate %ss   %s_correct.pdbt   rbt   OK(	   t	   enumeratet   pdbst   filet   writet   closeR   t   callt   readR   (   t   it	   input_strt
   output_strt   preamblet   ft   cmdt   lines(    (    sS   /public2/ftp/pub/ccp4/6.5/ccp4-6.5/lib/py2/mmtbx/regression/tst_altloc_remediate.pyt   run¤  s(    
			

t   __main__(	   t
   __future__R    t   sysR   t   libtbxR   R   R!   t   __name__(    (    (    sS   /public2/ftp/pub/ccp4/6.5/ccp4-6.5/lib/py2/mmtbx/regression/tst_altloc_remediate.pyt   <module>   s(   &"76		