*HEADER    DE NOVO PROTEIN                         04-AUG-04   1U7M              
*TITLE     SOLUTION STRUCTURE OF A DIIRON PROTEIN MODEL: DUE FERRI(II)           
*TITLE    2 TURN MUTANT                                                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: FOUR-HELIX BUNDLE MODEL;                                   
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3);                                
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET28A                                    
*KEYWDS    DIIRON PROTEINS, FOUR-HELIX BUNDLE, PROTEIN DESIGN, INTER-            
*KEYWDS   2 HELICAL LOOPS                                                        
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    O.MAGLIO, F.NASTRI, J.R.CALHOUN, S.LAHR, V.PAVONE,                    
*AUTHOR   2 W.F.DEGRADO, A.LOMBARDI                                              
*REVDAT   1   01-MAR-05 1U7M    0                                                

QCONVR conversion noe distance restraints from df2t.upl
count 1100 type diana
NOEUPP  TYR    3 HN    LEU    4 HN         3.080
NOEUPP  TYR    3 HA    LEU    4 HN         3.210
NOEUPP  TYR    3 HA    GLU-   6 QB         3.310
NOEUPP  LEU    4 HN    LEU    4 HA         2.900
NOEUPP  LEU    4 HN    LEU    4 HG         3.520
NOEUPP  LEU    4 HN    LEU    4 QQD        6.950
NOEUPP  LEU    4 HN    ARG+   5 HN         3.210
NOEUPP  LEU    4 HA    LEU    4 HG         3.580
NOEUPP  LEU    4 HA    LEU    7 HN         3.550
NOEUPP  LEU    4 HA    LEU    7 QB         3.770
NOEUPP  LEU    4 HA    LEU    7 QD1        5.010
NOEUPP  LEU    4 HA    LEU    7 QD2        5.010
NOEUPP  LEU    4 HA    LEU    7 QQD        4.380
NOEUPP  LEU    4 QB    ARG+   5 HN         3.930
NOEUPP  LEU    4 HG    ARG+   5 HN         3.480
NOEUPP  ARG+   5 HN    ARG+   5 QG         4.700
NOEUPP  ARG+   5 HN    GLU-   6 HN         3.210
NOEUPP  ARG+   5 HA    ARG+   5 QD         4.670
NOEUPP  ARG+   5 HA    TYR    8 HB2        3.140
NOEUPP  ARG+   5 HA    TYR    8 HB3        3.140
NOEUPP  ARG+   5 HA    TYR    8 QB         2.920
NOEUPP  ARG+   5 HA    TYR    8 QD         6.550
NOEUPP  ARG+   5 QB    ARG+   5 HE         6.250
NOEUPP  GLU-   6 HN    GLU-   6 HB2        3.480
NOEUPP  GLU-   6 HN    GLU-   6 HB3        3.480
NOEUPP  GLU-   6 HN    GLU-   6 QB         3.260
NOEUPP  GLU-   6 HN    GLU-   6 QG         5.850
NOEUPP  GLU-   6 HN    LEU    7 HN         3.420
NOEUPP  GLU-   6 HA    LEU    7 HN         3.520
NOEUPP  GLU-   6 HA    LYS+   9 QB         3.930
NOEUPP  GLU-   6 HB2   LEU    7 HN         3.790
NOEUPP  GLU-   6 HB3   LEU    7 HN         3.790
NOEUPP  GLU-   6 QG    LEU    7 HN         6.380
NOEUPP  LEU    7 HN    LEU    7 HG         3.520
NOEUPP  LEU    7 HN    LEU    7 QD1        5.690
NOEUPP  LEU    7 HN    LEU    7 QD2        5.690
NOEUPP  LEU    7 HN    LEU    7 QQD        5.390
NOEUPP  LEU    7 HN    TYR    8 HN         3.330
NOEUPP  LEU    7 HA    LEU    7 HG         3.520
NOEUPP  LEU    7 HA    LEU    7 QD1        5.260
NOEUPP  LEU    7 HA    LEU    7 QD2        5.260
NOEUPP  LEU    7 HA    LEU    7 QQD        4.420
NOEUPP  LEU    7 HA    LEU   10 QB         4.830
NOEUPP  LEU    7 QQD   TYR    8 HN         7.910
NOEUPP  TYR    8 HN    TYR    8 HB2        2.930
NOEUPP  TYR    8 HN    TYR    8 HB3        2.930
NOEUPP  TYR    8 HN    LYS+   9 HN         3.300
NOEUPP  TYR    8 HA    GLU-  11 HN         3.670
NOEUPP  TYR    8 HA    GLU-  11 HB2        2.830
NOEUPP  TYR    8 HA    GLU-  11 HB3        2.830
NOEUPP  TYR    8 HA    GLU-  11 QB         2.570
NOEUPP  TYR    8 HB2   LYS+   9 HN         3.300
NOEUPP  TYR    8 HB3   LYS+   9 HN         3.300
NOEUPP  TYR    8 QB    LYS+   9 HN         3.120
NOEUPP  TYR    8 QD    LYS+   9 HN         7.640
NOEUPP  TYR    8 QE    LYS+   9 HA         7.630
NOEUPP  LYS+   9 HN    LYS+   9 HA         2.830
NOEUPP  LYS+   9 HN    LYS+   9 QB         3.830
NOEUPP  LYS+   9 HN    LYS+   9 QG         4.830
NOEUPP  LYS+   9 HN    LYS+   9 QD         4.890
NOEUPP  LYS+   9 HN    LEU   10 HN         3.050
NOEUPP  LYS+   9 HA    LYS+   9 QD         4.550
NOEUPP  LYS+   9 HA    LYS+   9 QE         6.380
NOEUPP  LYS+   9 HA    LEU   10 HN         3.520
NOEUPP  LYS+   9 HA    GLN   12 HN         3.020
NOEUPP  LYS+   9 HA    GLN   12 QB         3.990
NOEUPP  LYS+   9 QB    LYS+   9 QE         7.250
NOEUPP  LYS+   9 QB    LEU   10 HN         3.830
NOEUPP  LEU   10 HN    LEU   10 HA         2.680
NOEUPP  LEU   10 HN    LEU   10 QB         3.900
NOEUPP  LEU   10 HN    LEU   10 HG         2.900
NOEUPP  LEU   10 HN    LEU   10 QQD        6.210
NOEUPP  LEU   10 HN    GLU-  11 HN         3.270
NOEUPP  LEU   10 HA    LEU   10 HG         3.730
NOEUPP  LEU   10 HA    GLN   13 HN         3.240
NOEUPP  LEU   10 HA    GLN   13 QB         4.240
NOEUPP  LEU   10 QQD   GLU-  11 HN         7.630
NOEUPP  GLU-  11 HN    GLU-  11 HB2        3.390
NOEUPP  GLU-  11 HN    GLU-  11 HB3        3.390
NOEUPP  GLU-  11 HN    GLU-  11 QB         3.100
NOEUPP  GLU-  11 HN    GLU-  11 HG2        3.790
NOEUPP  GLU-  11 HN    GLU-  11 HG3        3.790
NOEUPP  GLU-  11 HN    GLU-  11 QG         3.580
NOEUPP  GLU-  11 HN    GLN   12 HN         3.210
NOEUPP  GLU-  11 HA    ALA   14 HN         3.890
NOEUPP  GLU-  11 HA    ALA   14 QB         5.010
NOEUPP  GLN   12 HN    GLN   12 HB2        3.480
NOEUPP  GLN   12 HN    GLN   12 HB3        3.480
NOEUPP  GLN   12 HN    GLN   12 QB         3.160
NOEUPP  GLN   12 HN    GLN   12 HG2        3.670
NOEUPP  GLN   12 HN    GLN   12 HG3        3.670
NOEUPP  GLN   12 HN    GLN   12 QG         3.230
NOEUPP  GLN   12 HN    GLN   13 HN         3.170
NOEUPP  GLN   12 HA    GLN   12 QB         2.600
NOEUPP  GLN   12 HA    GLN   12 HG2        2.800
NOEUPP  GLN   12 HA    GLN   12 HG3        2.800
NOEUPP  GLN   12 HA    GLN   13 HN         3.390
NOEUPP  GLN   12 HA    MET   15 HN         2.930
NOEUPP  GLN   12 QG    MET   15 HN         5.170
NOEUPP  GLN   13 HN    GLN   13 HG2        4.320
NOEUPP  GLN   13 HN    GLN   13 HG3        4.320
NOEUPP  GLN   13 HN    GLN   13 QG         4.120
NOEUPP  GLN   13 HN    ALA   14 HN         3.050
NOEUPP  GLN   13 HA    GLN   13 HG2        4.200
NOEUPP  GLN   13 HA    GLN   13 HG3        4.200
NOEUPP  GLN   13 HA    GLN   13 QG         3.390
NOEUPP  GLN   13 HA    LYS+  16 HN         3.240
NOEUPP  GLN   13 HA    LYS+  16 QB         5.540
NOEUPP  GLN   13 HA    LEU   17 HN         3.860
NOEUPP  GLN   13 QB    ALA   14 HN         4.110
NOEUPP  GLN   13 QG    ALA   14 HN         5.350
NOEUPP  ALA   14 HN    MET   15 HN         2.490
NOEUPP  ALA   14 HA    LEU   17 HB2        3.390
NOEUPP  ALA   14 HA    LEU   17 HB3        3.390
NOEUPP  ALA   14 HA    LEU   17 QB         3.030
NOEUPP  ALA   14 QB    TYR   18 QD         6.720
NOEUPP  ALA   14 QB    TYR   18 HH         6.530
NOEUPP  MET   15 HN    MET   15 HA         2.900
NOEUPP  MET   15 HN    MET   15 QG         5.690
NOEUPP  MET   15 HN    MET   15 QE         5.600
NOEUPP  MET   15 HN    LYS+  16 HN         3.330
NOEUPP  MET   15 HN    LEU   17 HN         4.230
NOEUPP  MET   15 HA    MET   15 QE         3.430
NOEUPP  MET   15 HA    TYR   18 HN         3.390
NOEUPP  MET   15 HA    TYR   18 HB2        3.420
NOEUPP  MET   15 HA    TYR   18 HB3        3.420
NOEUPP  MET   15 HA    TYR   18 QD         3.830
NOEUPP  MET   15 QB    MET   15 QE         4.520
NOEUPP  MET   15 QB    LYS+  16 HN         4.270
NOEUPP  LYS+  16 HN    LYS+  16 HA         2.870
NOEUPP  LYS+  16 HN    LYS+  16 QB         3.800
NOEUPP  LYS+  16 HN    LYS+  16 QG         5.350
NOEUPP  LYS+  16 HN    LYS+  16 QD         5.260
NOEUPP  LYS+  16 HN    LYS+  16 QE         6.380
NOEUPP  LYS+  16 HN    LEU   17 HN         2.990
NOEUPP  LYS+  16 HN    TYR   18 HN         5.500
NOEUPP  LYS+  16 HA    LYS+  16 QD         4.300
NOEUPP  LYS+  16 HA    LYS+  16 QE         4.760
NOEUPP  LYS+  16 HA    LEU   17 HN         3.580
NOEUPP  LYS+  16 HA    ARG+  19 HN         3.330
NOEUPP  LYS+  16 QB    LYS+  16 QE         6.790
NOEUPP  LYS+  16 QB    TYR   18 HN         5.260
NOEUPP  LEU   17 HN    LEU   17 HB2        3.330
NOEUPP  LEU   17 HN    LEU   17 HB3        3.330
NOEUPP  LEU   17 HN    LEU   17 QB         2.980
NOEUPP  LEU   17 HN    LEU   17 HG         3.450
NOEUPP  LEU   17 HN    LEU   17 QQD        7.040
NOEUPP  LEU   17 HN    TYR   18 HN         3.300
NOEUPP  LEU   17 HA    LEU   17 HG         3.790
NOEUPP  LEU   17 HA    GLU-  20 HN         3.790
NOEUPP  LEU   17 HA    GLU-  20 QB         4.360
NOEUPP  LEU   17 HA    ALA   21 HN         4.200
NOEUPP  LEU   17 HB2   TYR   18 HN         3.640
NOEUPP  LEU   17 HB3   TYR   18 HN         3.640
NOEUPP  LEU   17 QB    TYR   18 HN         3.450
NOEUPP  LEU   17 QB    TYR   18 QD         8.520
NOEUPP  LEU   17 QQD   TYR   18 HN         7.630
NOEUPP  TYR   18 HN    TYR   18 HB2        3.420
NOEUPP  TYR   18 HN    TYR   18 HB3        3.420
NOEUPP  TYR   18 HN    TYR   18 QB         3.180
NOEUPP  TYR   18 HN    TYR   18 QE         7.630
NOEUPP  TYR   18 HN    ARG+  19 HN         3.390
NOEUPP  TYR   18 HN    GLU-  20 HN         4.450
NOEUPP  TYR   18 HA    ALA   21 HN         3.760
NOEUPP  TYR   18 HA    ALA   21 QB         4.360
NOEUPP  TYR   18 HA    SER   22 HN         3.890
NOEUPP  TYR   18 HB2   ARG+  19 HN         3.890
NOEUPP  TYR   18 HB3   ARG+  19 HN         3.890
NOEUPP  TYR   18 QB    ARG+  19 HN         3.660
NOEUPP  TYR   18 QD    TYR   18 HH         7.640
NOEUPP  TYR   18 QD    ARG+  19 HN         7.640
NOEUPP  TYR   18 QE    TYR   18 HH         5.590
NOEUPP  TYR   18 QD    ALA   21 QB         6.800
NOEUPP  ARG+  19 HN    ARG+  19 HG2        4.970
NOEUPP  ARG+  19 HN    ARG+  19 HG3        4.970
NOEUPP  ARG+  19 HN    ARG+  19 QG         4.580
NOEUPP  ARG+  19 HN    ARG+  19 QD         6.380
NOEUPP  ARG+  19 HN    GLU-  20 HN         3.300
NOEUPP  ARG+  19 HA    ARG+  19 HG2        3.830
NOEUPP  ARG+  19 HA    ARG+  19 HG3        3.830
NOEUPP  ARG+  19 HA    ARG+  19 QG         3.460
NOEUPP  ARG+  19 HA    ARG+  19 QD         6.380
NOEUPP  ARG+  19 HA    GLU-  20 HN         3.610
NOEUPP  ARG+  19 HA    SER   22 QB         3.960
NOEUPP  ARG+  19 QB    GLU-  20 HN         4.140
NOEUPP  ARG+  19 QG    GLU-  20 HN         5.940
NOEUPP  GLU-  20 HN    GLU-  20 HB2        2.900
NOEUPP  GLU-  20 HN    GLU-  20 HB3        2.900
NOEUPP  GLU-  20 HN    GLU-  20 QG         5.660
NOEUPP  GLU-  20 HN    ALA   21 HN         3.270
NOEUPP  GLU-  20 HA    GLU-  20 QB         2.700
NOEUPP  GLU-  20 HA    ALA   21 HN         3.520
NOEUPP  GLU-  20 HA    GLU-  23 HN         3.110
NOEUPP  GLU-  20 HB2   ALA   21 HN         3.360
NOEUPP  GLU-  20 HB3   ALA   21 HN         3.360
NOEUPP  ALA   21 HN    SER   22 HN         3.330
NOEUPP  ALA   21 HA    LYS+  24 HN         3.860
NOEUPP  ALA   21 HA    LYS+  24 QB         4.490
NOEUPP  ALA   21 QB    GLU-  23 HN         6.530
NOEUPP  SER   22 HN    SER   22 HA         2.900
NOEUPP  SER   22 HN    GLU-  23 HN         3.270
NOEUPP  SER   22 HA    ALA   25 HN         3.610
NOEUPP  SER   22 HA    ALA   25 QB         3.800
NOEUPP  GLU-  23 HN    GLU-  23 HB2        2.900
NOEUPP  GLU-  23 HN    GLU-  23 HB3        2.900
NOEUPP  GLU-  23 HN    GLU-  23 QG         5.480
NOEUPP  GLU-  23 HN    LYS+  24 HN         3.080
NOEUPP  GLU-  23 HA    GLU-  23 HB2        2.990
NOEUPP  GLU-  23 HA    GLU-  23 HB3        2.990
NOEUPP  GLU-  23 HA    ARG+  26 QB         4.300
NOEUPP  GLU-  23 HB2   LYS+  24 HN         3.580
NOEUPP  GLU-  23 HB3   LYS+  24 HN         3.580
NOEUPP  LYS+  24 HN    LYS+  24 QG         4.760
NOEUPP  LYS+  24 HN    LYS+  24 QD         5.140
NOEUPP  LYS+  24 HA    LYS+  24 QD         4.390
NOEUPP  LYS+  24 QB    ALA   25 HN         4.700
NOEUPP  ALA   25 HN    ALA   25 QB         3.680
NOEUPP  ALA   25 HA    ARG+  26 HN         3.550
NOEUPP  ALA   25 HA    ASN   27 HN         3.790
NOEUPP  ALA   25 QB    ASN   27 HN         5.100
NOEUPP  ARG+  26 HN    ARG+  26 QG         5.420
NOEUPP  ARG+  26 HN    ARG+  26 HD2        3.980
NOEUPP  ARG+  26 HN    ARG+  26 HD3        3.980
NOEUPP  ARG+  26 HN    ARG+  26 QD         3.680
NOEUPP  ARG+  26 HN    ASN   27 HN         3.520
NOEUPP  ARG+  26 HA    ARG+  26 QD         4.760
NOEUPP  ARG+  26 QG    ASN   27 HN         6.070
NOEUPP  ASN   27 HN    ASN   27 HB2        3.170
NOEUPP  ASN   27 HN    ASN   27 HB3        3.170
NOEUPP  ASN   27 HA    PRO   28 HD2        2.960
NOEUPP  ASN   27 HA    PRO   28 HD3        2.960
NOEUPP  ASN   27 HA    GLU-  29 HN         4.350
NOEUPP  ASN   27 QB    LYS+  31 HN         6.380
NOEUPP  PRO   28 HA    LYS+  31 HN         3.390
NOEUPP  PRO   28 HA    LYS+  31 HB2        3.330
NOEUPP  PRO   28 HA    LYS+  31 HB3        3.330
NOEUPP  PRO   28 QG    GLU-  29 HN         3.580
NOEUPP  PRO   28 QD    GLU-  29 HN         3.430
NOEUPP  GLU-  29 HN    PRO   28 HA         3.580
NOEUPP  GLU-  29 HN    GLU-  29 HB2        3.330
NOEUPP  GLU-  29 HN    GLU-  29 HB3        2.930
NOEUPP  GLU-  29 HN    GLU-  29 QG         5.420
NOEUPP  GLU-  29 HN    LYS+  30 HN         2.830
NOEUPP  GLU-  29 HA    LYS+  30 HN         3.420
NOEUPP  GLU-  29 HB2   LYS+  30 HN         3.520
NOEUPP  GLU-  29 HB3   LYS+  30 HN         3.520
NOEUPP  GLU-  29 QB    LYS+  30 HN         3.220
NOEUPP  GLU-  29 QG    LYS+  30 HN         6.380
NOEUPP  LYS+  30 HN    LYS+  30 HA         2.870
NOEUPP  LYS+  30 HN    LYS+  30 QG         4.830
NOEUPP  LYS+  30 HN    LYS+  30 QE         6.380
NOEUPP  LYS+  30 HN    LYS+  31 HN         2.830
NOEUPP  LYS+  30 HA    LYS+  30 QE         6.380
NOEUPP  LYS+  30 HA    VAL   33 HN         3.890
NOEUPP  LYS+  30 HA    VAL   33 HB         2.770
NOEUPP  LYS+  30 HA    LEU   34 HN         3.700
NOEUPP  LYS+  30 QB    LYS+  31 HN         4.210
NOEUPP  LYS+  31 HN    LYS+  31 HB2        3.270
NOEUPP  LYS+  31 HN    LYS+  31 HB3        3.270
NOEUPP  LYS+  31 HN    LYS+  31 QB         2.980
NOEUPP  LYS+  31 HN    LYS+  31 QG         5.510
NOEUPP  LYS+  31 HN    LYS+  31 QD         4.830
NOEUPP  LYS+  31 HN    SER   32 HN         3.330
NOEUPP  LYS+  31 HA    LYS+  31 QD         6.070
NOEUPP  LYS+  31 HA    SER   32 HN         3.420
NOEUPP  LYS+  31 HA    LEU   34 HN         3.860
NOEUPP  SER   32 HN    VAL   33 HN         2.990
NOEUPP  SER   32 HA    VAL   33 HN         3.170
NOEUPP  SER   32 HA    GLN   35 HN         3.520
NOEUPP  VAL   33 HN    VAL   33 HB         2.900
NOEUPP  VAL   33 HN    VAL   33 QQG        4.260
NOEUPP  VAL   33 HN    LEU   34 HN         3.050
NOEUPP  VAL   33 HA    LYS+  36 HN         3.730
NOEUPP  VAL   33 HA    LYS+  36 QB         5.350
NOEUPP  VAL   33 HB    LEU   34 HN         2.930
NOEUPP  VAL   33 QQG   LEU   34 HN         6.450
NOEUPP  LEU   34 HN    LEU   34 HA         2.900
NOEUPP  LEU   34 HN    LEU   34 HG         3.640
NOEUPP  LEU   34 HN    LEU   34 QQD        6.800
NOEUPP  LEU   34 HN    GLN   35 HN         3.450
NOEUPP  LEU   34 HA    LEU   34 HG         3.330
NOEUPP  LEU   34 HA    ILE   37 HN         3.330
NOEUPP  LEU   34 HA    ILE   37 HB         3.050
NOEUPP  LEU   34 HG    GLN   35 HN         4.170
NOEUPP  LEU   34 HG    GLN   35 HA         3.670
NOEUPP  LEU   34 QQD   GLN   35 HN         7.630
NOEUPP  LEU   34 QQD   GLN   35 HA         7.350
NOEUPP  GLN   35 HN    GLN   35 HB2        3.140
NOEUPP  GLN   35 HN    GLN   35 HB3        3.140
NOEUPP  GLN   35 HN    GLN   35 QG         5.660
NOEUPP  GLN   35 HN    LYS+  36 HN         3.330
NOEUPP  GLN   35 HA    GLN   35 HB2        3.050
NOEUPP  GLN   35 HA    GLN   35 HB3        3.050
NOEUPP  GLN   35 HA    LEU   38 HN         3.670
NOEUPP  GLN   35 HA    LEU   38 QB         4.180
NOEUPP  LYS+  36 HN    LYS+  36 QG         4.610
NOEUPP  LYS+  36 HN    LYS+  36 QD         5.320
NOEUPP  LYS+  36 HN    ILE   37 HN         3.140
NOEUPP  LYS+  36 HA    LYS+  36 QD         5.760
NOEUPP  LYS+  36 HA    GLU-  39 HN         3.240
NOEUPP  LYS+  36 HA    GLU-  39 QB         4.520
NOEUPP  LYS+  36 QB    ILE   37 HN         4.140
NOEUPP  LYS+  36 QG    ILE   37 HN         5.260
NOEUPP  LYS+  36 QD    ILE   37 HN         6.380
NOEUPP  ILE   37 HN    ILE   37 HB         3.110
NOEUPP  ILE   37 HN    ILE   37 QG1        5.380
NOEUPP  ILE   37 HN    LEU   38 HN         3.390
NOEUPP  ILE   37 HA    ASP-  40 HN         3.730
NOEUPP  ILE   37 HA    ASP-  40 HB2        3.520
NOEUPP  ILE   37 HA    ASP-  40 HB3        3.520
NOEUPP  ILE   37 HB    LEU   38 HN         3.240
NOEUPP  ILE   37 QG2   LEU   38 HN         5.750
NOEUPP  ILE   37 QG2   GLU-  41 QG         6.660
NOEUPP  LEU   38 HN    LEU   38 QB         3.900
NOEUPP  LEU   38 HN    LEU   38 HG         3.330
NOEUPP  LEU   38 HN    LEU   38 QQD        6.360
NOEUPP  LEU   38 HN    GLU-  39 HN         3.300
NOEUPP  LEU   38 HA    LEU   38 HG         3.450
NOEUPP  LEU   38 HA    GLU-  41 HN         3.730
NOEUPP  LEU   38 HA    GLU-  41 QB         5.040
NOEUPP  GLU-  39 HN    GLU-  39 HB2        3.580
NOEUPP  GLU-  39 HN    GLU-  39 HB3        3.580
NOEUPP  GLU-  39 HN    GLU-  39 QB         3.270
NOEUPP  GLU-  39 HN    GLU-  39 QG         5.170
NOEUPP  GLU-  39 HA    GLU-  41 HN         4.070
NOEUPP  GLU-  39 HA    GLU-  42 QB         3.490
NOEUPP  GLU-  39 QB    ASP-  40 HN         3.990
NOEUPP  ASP-  40 HN    ASP-  40 HB2        3.240
NOEUPP  ASP-  40 HN    ASP-  40 HB3        3.240
NOEUPP  ASP-  40 HN    ASP-  40 QB         2.910
NOEUPP  ASP-  40 HN    GLU-  41 HN         3.330
NOEUPP  ASP-  40 HA    ASP-  40 QB         2.720
NOEUPP  ASP-  40 HA    LYS+  43 HB2        3.300
NOEUPP  ASP-  40 HA    LYS+  43 HB3        3.300
NOEUPP  ASP-  40 HB2   GLU-  41 HN         3.640
NOEUPP  ASP-  40 HB3   GLU-  41 HN         3.640
NOEUPP  GLU-  41 HN    GLU-  41 QG         5.200
NOEUPP  GLU-  41 HN    GLU-  42 HN         3.050
NOEUPP  GLU-  41 HN    LYS+  43 HN         4.510
NOEUPP  GLU-  41 HA    GLU-  42 HN         3.550
NOEUPP  GLU-  41 HA    HIS   44 HN         3.640
NOEUPP  GLU-  41 HA    HIS   44 QB         4.700
NOEUPP  GLU-  42 HN    GLU-  42 HB2        3.020
NOEUPP  GLU-  42 HN    GLU-  42 HB3        3.020
NOEUPP  GLU-  42 HN    GLU-  42 QB         2.730
NOEUPP  GLU-  42 HN    GLU-  42 QG         5.110
NOEUPP  GLU-  42 HN    LYS+  43 HN         2.900
NOEUPP  GLU-  42 HA    LYS+  43 HN         3.550
NOEUPP  GLU-  42 HA    ILE   45 HB         3.390
NOEUPP  GLU-  42 QB    LYS+  43 HN         4.300
NOEUPP  LYS+  43 HN    LYS+  43 HB2        3.170
NOEUPP  LYS+  43 HN    LYS+  43 HB3        3.170
NOEUPP  LYS+  43 HN    LYS+  43 QG         4.920
NOEUPP  LYS+  43 HN    LYS+  43 QD         5.970
NOEUPP  LYS+  43 HN    HIS   44 HN         3.210
NOEUPP  LYS+  43 HN    HIS   44 HD2        5.000
NOEUPP  LYS+  43 HA    GLU-  46 HN         3.640
NOEUPP  LYS+  43 HA    GLU-  46 QB         3.960
NOEUPP  LYS+  43 HA    GLU-  46 QG         4.860
NOEUPP  LYS+  43 HB2   HIS   44 HN         3.670
NOEUPP  LYS+  43 HB2   HIS   44 HD2        4.760
NOEUPP  LYS+  43 HB2   TRP   47 HE1        5.500
NOEUPP  LYS+  43 HB3   HIS   44 HN         3.670
NOEUPP  LYS+  43 HB3   HIS   44 HD2        4.760
NOEUPP  LYS+  43 HB3   TRP   47 HE1        5.500
NOEUPP  LYS+  43 QB    TRP   47 HE1        5.050
NOEUPP  LYS+  43 QG    HIS   44 HD2        6.070
NOEUPP  HIS   44 HN    HIS   44 HB2        3.620
NOEUPP  HIS   44 HN    HIS   44 HB3        3.120
NOEUPP  HIS   44 HN    HIS   44 HD2        3.760
NOEUPP  HIS   44 HN    ILE   45 HN         3.360
NOEUPP  HIS   44 HA    HIS   44 HD2        2.960
NOEUPP  HIS   44 HA    ILE   45 HN         3.580
NOEUPP  HIS   44 HA    TRP   47 QB         4.490
NOEUPP  HIS   44 HA    TRP   47 HE3        3.890
NOEUPP  HIS   44 QB    ILE   45 HN         4.950
NOEUPP  HIS   44 HD2   TRP   47 QB         6.310
NOEUPP  HIS   44 HD2   TRP   47 HE3        3.480
NOEUPP  HIS   44 HD2   TRP   47 HZ3        3.950
NOEUPP  ILE   45 HN    ILE   45 HB         3.050
NOEUPP  ILE   45 HN    ILE   45 QG2        4.230
NOEUPP  ILE   45 HN    ILE   45 QG1        6.380
NOEUPP  ILE   45 HN    ILE   45 QD1        4.330
NOEUPP  ILE   45 HN    GLU-  46 HN         3.520
NOEUPP  ILE   45 HA    ILE   45 QD1        4.020
NOEUPP  ILE   45 HA    TRP   47 HN         4.380
NOEUPP  ILE   45 HA    LEU   48 HN         3.520
NOEUPP  ILE   45 HA    LEU   48 HB2        3.420
NOEUPP  ILE   45 HA    LEU   48 HB3        3.420
NOEUPP  ILE   45 HA    LEU   48 QB         3.170
NOEUPP  ILE   45 HA    LEU   48 HG         4.040
NOEUPP  ILE   45 HB    ILE   45 QD1        3.770
NOEUPP  ILE   45 QG2   GLU-  46 HN         5.440
NOEUPP  ILE   45 QG1   GLU-  46 HN         6.380
NOEUPP  GLU-  46 HN    GLU-  46 HB2        3.480
NOEUPP  GLU-  46 HN    GLU-  46 HB3        3.480
NOEUPP  GLU-  46 HN    GLU-  46 QB         3.290
NOEUPP  GLU-  46 HN    GLU-  46 QG         4.760
NOEUPP  GLU-  46 HN    TRP   47 HN         3.270
NOEUPP  GLU-  46 HN    LEU   48 HN         4.510
NOEUPP  GLU-  46 HA    GLU-  46 QG         3.870
NOEUPP  GLU-  46 HA    TRP   47 HN         3.550
NOEUPP  GLU-  46 HB2   TRP   47 HN         4.040
NOEUPP  GLU-  46 HB3   TRP   47 HN         4.040
NOEUPP  GLU-  46 QB    TRP   47 HN         3.500
NOEUPP  GLU-  46 QG    TRP   47 HD1        5.450
NOEUPP  TRP   47 HN    TRP   47 HB2        3.450
NOEUPP  TRP   47 HN    TRP   47 HB3        3.450
NOEUPP  TRP   47 HN    TRP   47 QB         3.230
NOEUPP  TRP   47 HN    TRP   47 HD1        3.640
NOEUPP  TRP   47 HN    LEU   48 HN         3.050
NOEUPP  TRP   47 HN    GLU-  49 HN         4.230
NOEUPP  TRP   47 HA    TRP   47 HD1        2.590
NOEUPP  TRP   47 HA    TRP   47 HE1        5.100
NOEUPP  TRP   47 HA    THR   50 HN         3.170
NOEUPP  TRP   47 HA    THR   50 HB         3.450
NOEUPP  TRP   47 HB2   LEU   48 HN         3.700
NOEUPP  TRP   47 HB3   LEU   48 HN         3.700
NOEUPP  TRP   47 QB    TRP   47 HE3        3.490
NOEUPP  LEU   48 HN    LEU   48 HB2        3.070
NOEUPP  LEU   48 HN    LEU   48 HB3        3.470
NOEUPP  LEU   48 HN    LEU   48 QB         2.990
NOEUPP  LEU   48 HN    LEU   48 HG         4.240
NOEUPP  LEU   48 HN    LEU   48 QD1        5.500
NOEUPP  LEU   48 HN    LEU   48 QD2        5.500
NOEUPP  LEU   48 HN    LEU   48 QQD        4.890
NOEUPP  LEU   48 HN    GLU-  49 HN         3.390
NOEUPP  LEU   48 HA    LEU   48 HG         3.890
NOEUPP  LEU   48 HA    LEU   48 QD1        4.700
NOEUPP  LEU   48 HA    LEU   48 QD2        4.700
NOEUPP  LEU   48 HA    LEU   48 QQD        4.240
NOEUPP  LEU   48 HA    GLU-  49 HN         3.550
NOEUPP  LEU   48 HA    ILE   51 HN         3.610
NOEUPP  LEU   48 HA    ILE   51 HB         2.710
NOEUPP  LEU   48 HG    GLU-  49 HN         4.650
NOEUPP  LEU   48 QD1   GLU-  49 HN         5.910
NOEUPP  LEU   48 QD2   GLU-  49 HN         5.910
NOEUPP  LEU   48 QQD   GLU-  49 HN         5.430
NOEUPP  GLU-  49 HN    GLU-  49 HB2        3.140
NOEUPP  GLU-  49 HN    GLU-  49 HB3        3.140
NOEUPP  GLU-  49 HN    GLU-  49 QB         2.860
NOEUPP  GLU-  49 HN    GLU-  49 QG         5.140
NOEUPP  GLU-  49 HN    THR   50 HN         3.330
NOEUPP  GLU-  49 HA    ASN   52 HN         3.270
NOEUPP  GLU-  49 HA    ASN   52 HB2        4.290
NOEUPP  GLU-  49 HA    ASN   52 HB3        4.290
NOEUPP  GLU-  49 HA    ASN   52 QB         3.840
NOEUPP  GLU-  49 HB2   THR   50 HN         3.520
NOEUPP  GLU-  49 HB3   THR   50 HN         3.520
NOEUPP  THR   50 HN    THR   50 HB         3.360
NOEUPP  THR   50 HN    THR   50 QG2        4.200
NOEUPP  THR   50 HN    ILE   51 HN         2.770
NOEUPP  THR   50 HA    ILE   51 HN         3.420
NOEUPP  THR   50 HB    ILE   51 HN         3.890
NOEUPP  THR   50 QG2   ILE   51 HN         4.480
NOEUPP  ILE   51 HN    ILE   51 HB         3.390
NOEUPP  ILE   51 HN    ILE   51 QG2        4.640
NOEUPP  ILE   51 HN    ILE   51 QG1        5.850
NOEUPP  ILE   51 HN    ILE   51 QD1        5.010
NOEUPP  ILE   51 HN    ASN   52 HN         2.770
NOEUPP  ILE   51 HA    ASN   52 HN         3.210
NOEUPP  ILE   51 HB    ASN   52 HN         3.520
NOEUPP  ILE   51 QG2   ILE   51 QD1        4.460
NOEUPP  ILE   51 QG2   ASN   52 HN         4.670
NOEUPP  ASN   52 HN    ASN   52 HB2        3.210
NOEUPP  ASN   52 HN    ASN   52 HB3        3.210
NOEUPP  ASN   52 HN    ASN   52 QB         3.020
NOEUPP  ASN   52 HA    GLY   53 HN         3.360
NOEUPP  TYR  103 HN    LEU  104 HN         3.080
NOEUPP  TYR  103 HA    LEU  104 HN         3.210
NOEUPP  TYR  103 HA    GLU- 106 QB         3.310
NOEUPP  LEU  104 HN    LEU  104 HA         2.900
NOEUPP  LEU  104 HN    LEU  104 HG         3.520
NOEUPP  LEU  104 HN    LEU  104 QQD        6.950
NOEUPP  LEU  104 HN    ARG+ 105 HN         3.210
NOEUPP  LEU  104 HA    LEU  104 HG         3.580
NOEUPP  LEU  104 HA    LEU  107 HN         3.550
NOEUPP  LEU  104 HA    LEU  107 QB         3.770
NOEUPP  LEU  104 HA    LEU  107 QD1        5.010
NOEUPP  LEU  104 HA    LEU  107 QD2        5.010
NOEUPP  LEU  104 HA    LEU  107 QQD        4.380
NOEUPP  LEU  104 QB    ARG+ 105 HN         3.930
NOEUPP  LEU  104 HG    ARG+ 105 HN         3.480
NOEUPP  ARG+ 105 HN    ARG+ 105 QG         4.700
NOEUPP  ARG+ 105 HN    GLU- 106 HN         3.210
NOEUPP  ARG+ 105 HA    ARG+ 105 QD         4.670
NOEUPP  ARG+ 105 HA    TYR  108 HB2        3.140
NOEUPP  ARG+ 105 HA    TYR  108 HB3        3.140
NOEUPP  ARG+ 105 HA    TYR  108 QB         2.920
NOEUPP  ARG+ 105 HA    TYR  108 QD         6.550
NOEUPP  ARG+ 105 QB    ARG+ 105 HE         6.250
NOEUPP  GLU- 106 HN    GLU- 106 HB2        3.480
NOEUPP  GLU- 106 HN    GLU- 106 HB3        3.480
NOEUPP  GLU- 106 HN    GLU- 106 QB         3.260
NOEUPP  GLU- 106 HN    GLU- 106 QG         5.850
NOEUPP  GLU- 106 HN    LEU  107 HN         3.420
NOEUPP  GLU- 106 HA    LEU  107 HN         3.520
NOEUPP  GLU- 106 HA    LYS+ 109 QB         3.930
NOEUPP  GLU- 106 HB2   LEU  107 HN         3.790
NOEUPP  GLU- 106 HB3   LEU  107 HN         3.790
NOEUPP  GLU- 106 QG    LEU  107 HN         6.380
NOEUPP  LEU  107 HN    LEU  107 HG         3.520
NOEUPP  LEU  107 HN    LEU  107 QD1        5.690
NOEUPP  LEU  107 HN    LEU  107 QD2        5.690
NOEUPP  LEU  107 HN    LEU  107 QQD        5.390
NOEUPP  LEU  107 HN    TYR  108 HN         3.330
NOEUPP  LEU  107 HA    LEU  107 HG         3.520
NOEUPP  LEU  107 HA    LEU  107 QD1        5.260
NOEUPP  LEU  107 HA    LEU  107 QD2        5.260
NOEUPP  LEU  107 HA    LEU  107 QQD        4.420
NOEUPP  LEU  107 HA    LEU  110 QB         4.830
NOEUPP  LEU  107 QQD   TYR  108 HN         7.910
NOEUPP  TYR  108 HN    TYR  108 HB2        2.930
NOEUPP  TYR  108 HN    TYR  108 HB3        2.930
NOEUPP  TYR  108 HN    LYS+ 109 HN         3.300
NOEUPP  TYR  108 HA    GLU- 111 HN         3.670
NOEUPP  TYR  108 HA    GLU- 111 HB2        2.830
NOEUPP  TYR  108 HA    GLU- 111 HB3        2.830
NOEUPP  TYR  108 HA    GLU- 111 QB         2.570
NOEUPP  TYR  108 HB2   LYS+ 109 HN         3.300
NOEUPP  TYR  108 HB3   LYS+ 109 HN         3.300
NOEUPP  TYR  108 QB    LYS+ 109 HN         3.120
NOEUPP  TYR  108 QD    LYS+ 109 HN         7.640
NOEUPP  TYR  108 QE    LYS+ 109 HA         7.630
NOEUPP  LYS+ 109 HN    LYS+ 109 HA         2.830
NOEUPP  LYS+ 109 HN    LYS+ 109 QB         3.830
NOEUPP  LYS+ 109 HN    LYS+ 109 QG         4.830
NOEUPP  LYS+ 109 HN    LYS+ 109 QD         4.890
NOEUPP  LYS+ 109 HN    LEU  110 HN         3.050
NOEUPP  LYS+ 109 HA    LYS+ 109 QD         4.550
NOEUPP  LYS+ 109 HA    LYS+ 109 QE         6.380
NOEUPP  LYS+ 109 HA    LEU  110 HN         3.520
NOEUPP  LYS+ 109 HA    GLN  112 HN         3.020
NOEUPP  LYS+ 109 HA    GLN  112 QB         3.990
NOEUPP  LYS+ 109 QB    LYS+ 109 QE         7.250
NOEUPP  LYS+ 109 QB    LEU  110 HN         3.830
NOEUPP  LEU  110 HN    LEU  110 HA         2.680
NOEUPP  LEU  110 HN    LEU  110 QB         3.900
NOEUPP  LEU  110 HN    LEU  110 HG         2.900
NOEUPP  LEU  110 HN    LEU  110 QQD        6.210
NOEUPP  LEU  110 HN    GLU- 111 HN         3.270
NOEUPP  LEU  110 HA    LEU  110 HG         3.730
NOEUPP  LEU  110 HA    GLN  113 HN         3.240
NOEUPP  LEU  110 HA    GLN  113 QB         4.240
NOEUPP  LEU  110 QQD   GLU- 111 HN         7.630
NOEUPP  GLU- 111 HN    GLU- 111 HB2        3.390
NOEUPP  GLU- 111 HN    GLU- 111 HB3        3.390
NOEUPP  GLU- 111 HN    GLU- 111 QB         3.100
NOEUPP  GLU- 111 HN    GLU- 111 HG2        3.790
NOEUPP  GLU- 111 HN    GLU- 111 HG3        3.790
NOEUPP  GLU- 111 HN    GLU- 111 QG         3.580
NOEUPP  GLU- 111 HN    GLN  112 HN         3.210
NOEUPP  GLU- 111 HA    ALA  114 HN         3.890
NOEUPP  GLU- 111 HA    ALA  114 QB         5.010
NOEUPP  GLN  112 HN    GLN  112 HB2        3.480
NOEUPP  GLN  112 HN    GLN  112 HB3        3.480
NOEUPP  GLN  112 HN    GLN  112 QB         3.160
NOEUPP  GLN  112 HN    GLN  112 HG2        3.670
NOEUPP  GLN  112 HN    GLN  112 HG3        3.670
NOEUPP  GLN  112 HN    GLN  112 QG         3.230
NOEUPP  GLN  112 HN    GLN  113 HN         3.170
NOEUPP  GLN  112 HA    GLN  112 QB         2.600
NOEUPP  GLN  112 HA    GLN  112 HG2        2.800
NOEUPP  GLN  112 HA    GLN  112 HG3        2.800
NOEUPP  GLN  112 HA    GLN  113 HN         3.390
NOEUPP  GLN  112 HA    MET  115 HN         2.930
NOEUPP  GLN  112 QG    MET  115 HN         5.170
NOEUPP  GLN  113 HN    GLN  113 HG2        4.320
NOEUPP  GLN  113 HN    GLN  113 HG3        4.320
NOEUPP  GLN  113 HN    GLN  113 QG         4.120
NOEUPP  GLN  113 HN    ALA  114 HN         3.050
NOEUPP  GLN  113 HA    GLN  113 HG2        4.200
NOEUPP  GLN  113 HA    GLN  113 HG3        4.200
NOEUPP  GLN  113 HA    GLN  113 QG         3.390
NOEUPP  GLN  113 HA    LYS+ 116 HN         3.240
NOEUPP  GLN  113 HA    LYS+ 116 QB         5.540
NOEUPP  GLN  113 HA    LEU  117 HN         3.860
NOEUPP  GLN  113 QB    ALA  114 HN         4.110
NOEUPP  GLN  113 QG    ALA  114 HN         5.350
NOEUPP  ALA  114 HN    MET  115 HN         2.490
NOEUPP  ALA  114 HA    LEU  117 HB2        3.390
NOEUPP  ALA  114 HA    LEU  117 HB3        3.390
NOEUPP  ALA  114 HA    LEU  117 QB         3.030
NOEUPP  ALA  114 QB    TYR  118 QD         6.720
NOEUPP  ALA  114 QB    TYR  118 HH         6.530
NOEUPP  MET  115 HN    MET  115 HA         2.900
NOEUPP  MET  115 HN    MET  115 QG         5.690
NOEUPP  MET  115 HN    MET  115 QE         5.600
NOEUPP  MET  115 HN    LYS+ 116 HN         3.330
NOEUPP  MET  115 HN    LEU  117 HN         4.230
NOEUPP  MET  115 HA    MET  115 QE         3.430
NOEUPP  MET  115 HA    TYR  118 HN         3.390
NOEUPP  MET  115 HA    TYR  118 HB2        3.420
NOEUPP  MET  115 HA    TYR  118 HB3        3.420
NOEUPP  MET  115 HA    TYR  118 QD         3.830
NOEUPP  MET  115 QB    MET  115 QE         4.520
NOEUPP  MET  115 QB    LYS+ 116 HN         4.270
NOEUPP  LYS+ 116 HN    LYS+ 116 HA         2.870
NOEUPP  LYS+ 116 HN    LYS+ 116 QB         3.800
NOEUPP  LYS+ 116 HN    LYS+ 116 QG         5.350
NOEUPP  LYS+ 116 HN    LYS+ 116 QD         5.260
NOEUPP  LYS+ 116 HN    LYS+ 116 QE         6.380
NOEUPP  LYS+ 116 HN    LEU  117 HN         2.990
NOEUPP  LYS+ 116 HN    TYR  118 HN         5.500
NOEUPP  LYS+ 116 HA    LYS+ 116 QD         4.300
NOEUPP  LYS+ 116 HA    LYS+ 116 QE         4.760
NOEUPP  LYS+ 116 HA    LEU  117 HN         3.580
NOEUPP  LYS+ 116 HA    ARG+ 119 HN         3.330
NOEUPP  LYS+ 116 QB    LYS+ 116 QE         6.790
NOEUPP  LYS+ 116 QB    TYR  118 HN         5.260
NOEUPP  LEU  117 HN    LEU  117 HB2        3.330
NOEUPP  LEU  117 HN    LEU  117 HB3        3.330
NOEUPP  LEU  117 HN    LEU  117 QB         2.980
NOEUPP  LEU  117 HN    LEU  117 HG         3.450
NOEUPP  LEU  117 HN    LEU  117 QQD        7.040
NOEUPP  LEU  117 HN    TYR  118 HN         3.300
NOEUPP  LEU  117 HA    LEU  117 HG         3.790
NOEUPP  LEU  117 HA    GLU- 120 HN         3.790
NOEUPP  LEU  117 HA    GLU- 120 QB         4.360
NOEUPP  LEU  117 HA    ALA  121 HN         4.200
NOEUPP  LEU  117 HB2   TYR  118 HN         3.640
NOEUPP  LEU  117 HB3   TYR  118 HN         3.640
NOEUPP  LEU  117 QB    TYR  118 HN         3.450
NOEUPP  LEU  117 QB    TYR  118 QD         8.520
NOEUPP  LEU  117 QQD   TYR  118 HN         7.630
NOEUPP  TYR  118 HN    TYR  118 HB2        3.420
NOEUPP  TYR  118 HN    TYR  118 HB3        3.420
NOEUPP  TYR  118 HN    TYR  118 QB         3.180
NOEUPP  TYR  118 HN    TYR  118 QE         7.630
NOEUPP  TYR  118 HN    ARG+ 119 HN         3.390
NOEUPP  TYR  118 HN    GLU- 120 HN         4.450
NOEUPP  TYR  118 HA    ALA  121 HN         3.760
NOEUPP  TYR  118 HA    ALA  121 QB         4.360
NOEUPP  TYR  118 HA    SER  122 HN         3.890
NOEUPP  TYR  118 HB2   ARG+ 119 HN         3.890
NOEUPP  TYR  118 HB3   ARG+ 119 HN         3.890
NOEUPP  TYR  118 QB    ARG+ 119 HN         3.660
NOEUPP  TYR  118 QD    TYR  118 HH         7.640
NOEUPP  TYR  118 QD    ARG+ 119 HN         7.640
NOEUPP  TYR  118 QE    TYR  118 HH         5.590
NOEUPP  TYR  118 QD    ALA  121 QB         6.800
NOEUPP  ARG+ 119 HN    ARG+ 119 HG2        4.970
NOEUPP  ARG+ 119 HN    ARG+ 119 HG3        4.970
NOEUPP  ARG+ 119 HN    ARG+ 119 QG         4.580
NOEUPP  ARG+ 119 HN    ARG+ 119 QD         6.380
NOEUPP  ARG+ 119 HN    GLU- 120 HN         3.300
NOEUPP  ARG+ 119 HA    ARG+ 119 HG2        3.830
NOEUPP  ARG+ 119 HA    ARG+ 119 HG3        3.830
NOEUPP  ARG+ 119 HA    ARG+ 119 QG         3.460
NOEUPP  ARG+ 119 HA    ARG+ 119 QD         6.380
NOEUPP  ARG+ 119 HA    GLU- 120 HN         3.610
NOEUPP  ARG+ 119 HA    SER  122 QB         3.960
NOEUPP  ARG+ 119 QB    GLU- 120 HN         4.140
NOEUPP  ARG+ 119 QG    GLU- 120 HN         5.940
NOEUPP  GLU- 120 HN    GLU- 120 HB2        2.900
NOEUPP  GLU- 120 HN    GLU- 120 HB3        2.900
NOEUPP  GLU- 120 HN    GLU- 120 QG         5.660
NOEUPP  GLU- 120 HN    ALA  121 HN         3.270
NOEUPP  GLU- 120 HA    GLU- 120 QB         2.700
NOEUPP  GLU- 120 HA    ALA  121 HN         3.520
NOEUPP  GLU- 120 HA    GLU- 123 HN         3.110
NOEUPP  GLU- 120 HB2   ALA  121 HN         3.360
NOEUPP  GLU- 120 HB3   ALA  121 HN         3.360
NOEUPP  ALA  121 HN    SER  122 HN         3.330
NOEUPP  ALA  121 HA    LYS+ 124 HN         3.860
NOEUPP  ALA  121 HA    LYS+ 124 QB         4.490
NOEUPP  ALA  121 QB    GLU- 123 HN         6.530
NOEUPP  SER  122 HN    SER  122 HA         2.900
NOEUPP  SER  122 HN    GLU- 123 HN         3.270
NOEUPP  SER  122 HA    ALA  125 HN         3.610
NOEUPP  SER  122 HA    ALA  125 QB         3.800
NOEUPP  GLU- 123 HN    GLU- 123 HB2        2.900
NOEUPP  GLU- 123 HN    GLU- 123 HB3        2.900
NOEUPP  GLU- 123 HN    GLU- 123 QG         5.480
NOEUPP  GLU- 123 HN    LYS+ 124 HN         3.080
NOEUPP  GLU- 123 HA    GLU- 123 HB2        2.990
NOEUPP  GLU- 123 HA    GLU- 123 HB3        2.990
NOEUPP  GLU- 123 HA    ARG+ 126 QB         4.300
NOEUPP  GLU- 123 HB2   LYS+ 124 HN         3.580
NOEUPP  GLU- 123 HB3   LYS+ 124 HN         3.580
NOEUPP  LYS+ 124 HN    LYS+ 124 QG         4.760
NOEUPP  LYS+ 124 HN    LYS+ 124 QD         5.140
NOEUPP  LYS+ 124 HA    LYS+ 124 QD         4.390
NOEUPP  LYS+ 124 QB    ALA  125 HN         4.700
NOEUPP  ALA  125 HN    ALA  125 QB         3.680
NOEUPP  ALA  125 HA    ARG+ 126 HN         3.550
NOEUPP  ALA  125 HA    ASN  127 HN         3.790
NOEUPP  ALA  125 QB    ASN  127 HN         5.100
NOEUPP  ARG+ 126 HN    ARG+ 126 QG         5.420
NOEUPP  ARG+ 126 HN    ARG+ 126 HD2        3.980
NOEUPP  ARG+ 126 HN    ARG+ 126 HD3        3.980
NOEUPP  ARG+ 126 HN    ARG+ 126 QD         3.680
NOEUPP  ARG+ 126 HN    ASN  127 HN         3.520
NOEUPP  ARG+ 126 HA    ARG+ 126 QD         4.760
NOEUPP  ARG+ 126 QG    ASN  127 HN         6.070
NOEUPP  ASN  127 HN    ASN  127 HB2        3.170
NOEUPP  ASN  127 HN    ASN  127 HB3        3.170
NOEUPP  ASN  127 HA    PRO  128 HD2        2.960
NOEUPP  ASN  127 HA    PRO  128 HD3        2.960
NOEUPP  ASN  127 HA    GLU- 129 HN         4.350
NOEUPP  ASN  127 QB    LYS+ 131 HN         6.380
NOEUPP  PRO  128 HA    LYS+ 131 HN         3.390
NOEUPP  PRO  128 HA    LYS+ 131 HB2        3.330
NOEUPP  PRO  128 HA    LYS+ 131 HB3        3.330
NOEUPP  PRO  128 QG    GLU- 129 HN         3.580
NOEUPP  PRO  128 QD    GLU- 129 HN         3.430
NOEUPP  GLU- 129 HN    PRO  128 HA         3.580
NOEUPP  GLU- 129 HN    GLU- 129 HB2        3.330
NOEUPP  GLU- 129 HN    GLU- 129 HB3        2.930
NOEUPP  GLU- 129 HN    GLU- 129 QG         5.420
NOEUPP  GLU- 129 HN    LYS+ 130 HN         2.830
NOEUPP  GLU- 129 HA    LYS+ 130 HN         3.420
NOEUPP  GLU- 129 HB2   LYS+ 130 HN         3.520
NOEUPP  GLU- 129 HB3   LYS+ 130 HN         3.520
NOEUPP  GLU- 129 QB    LYS+ 130 HN         3.220
NOEUPP  GLU- 129 QG    LYS+ 130 HN         6.380
NOEUPP  LYS+ 130 HN    LYS+ 130 HA         2.870
NOEUPP  LYS+ 130 HN    LYS+ 130 QG         4.830
NOEUPP  LYS+ 130 HN    LYS+ 130 QE         6.380
NOEUPP  LYS+ 130 HN    LYS+ 131 HN         2.830
NOEUPP  LYS+ 130 HA    LYS+ 130 QE         6.380
NOEUPP  LYS+ 130 HA    VAL  133 HN         3.890
NOEUPP  LYS+ 130 HA    VAL  133 HB         2.770
NOEUPP  LYS+ 130 HA    LEU  134 HN         3.700
NOEUPP  LYS+ 130 QB    LYS+ 131 HN         4.210
NOEUPP  LYS+ 131 HN    LYS+ 131 HB2        3.270
NOEUPP  LYS+ 131 HN    LYS+ 131 HB3        3.270
NOEUPP  LYS+ 131 HN    LYS+ 131 QB         2.980
NOEUPP  LYS+ 131 HN    LYS+ 131 QG         5.510
NOEUPP  LYS+ 131 HN    LYS+ 131 QD         4.830
NOEUPP  LYS+ 131 HN    SER  132 HN         3.330
NOEUPP  LYS+ 131 HA    LYS+ 131 QD         6.070
NOEUPP  LYS+ 131 HA    SER  132 HN         3.420
NOEUPP  LYS+ 131 HA    LEU  134 HN         3.860
NOEUPP  SER  132 HN    VAL  133 HN         2.990
NOEUPP  SER  132 HA    VAL  133 HN         3.170
NOEUPP  SER  132 HA    GLN  135 HN         3.520
NOEUPP  VAL  133 HN    VAL  133 HB         2.900
NOEUPP  VAL  133 HN    VAL  133 QQG        4.260
NOEUPP  VAL  133 HN    LEU  134 HN         3.050
NOEUPP  VAL  133 HA    LYS+ 136 HN         3.730
NOEUPP  VAL  133 HA    LYS+ 136 QB         5.350
NOEUPP  VAL  133 HB    LEU  134 HN         2.930
NOEUPP  VAL  133 QQG   LEU  134 HN         6.450
NOEUPP  LEU  134 HN    LEU  134 HA         2.900
NOEUPP  LEU  134 HN    LEU  134 HG         3.640
NOEUPP  LEU  134 HN    LEU  134 QQD        6.800
NOEUPP  LEU  134 HN    GLN  135 HN         3.450
NOEUPP  LEU  134 HA    LEU  134 HG         3.330
NOEUPP  LEU  134 HA    ILE  137 HN         3.330
NOEUPP  LEU  134 HA    ILE  137 HB         3.050
NOEUPP  LEU  134 HG    GLN  135 HN         4.170
NOEUPP  LEU  134 HG    GLN  135 HA         3.670
NOEUPP  LEU  134 QQD   GLN  135 HN         7.630
NOEUPP  LEU  134 QQD   GLN  135 HA         7.350
NOEUPP  GLN  135 HN    GLN  135 HB2        3.140
NOEUPP  GLN  135 HN    GLN  135 HB3        3.140
NOEUPP  GLN  135 HN    GLN  135 QG         5.660
NOEUPP  GLN  135 HN    LYS+ 136 HN         3.330
NOEUPP  GLN  135 HA    GLN  135 HB2        3.050
NOEUPP  GLN  135 HA    GLN  135 HB3        3.050
NOEUPP  GLN  135 HA    LEU  138 HN         3.670
NOEUPP  GLN  135 HA    LEU  138 QB         4.180
NOEUPP  LYS+ 136 HN    LYS+ 136 QG         4.610
NOEUPP  LYS+ 136 HN    LYS+ 136 QD         5.320
NOEUPP  LYS+ 136 HN    ILE  137 HN         3.140
NOEUPP  LYS+ 136 HA    LYS+ 136 QD         5.760
NOEUPP  LYS+ 136 HA    GLU- 139 HN         3.240
NOEUPP  LYS+ 136 HA    GLU- 139 QB         4.520
NOEUPP  LYS+ 136 QB    ILE  137 HN         4.140
NOEUPP  LYS+ 136 QG    ILE  137 HN         5.260
NOEUPP  LYS+ 136 QD    ILE  137 HN         6.380
NOEUPP  ILE  137 HN    ILE  137 HB         3.110
NOEUPP  ILE  137 HN    ILE  137 QG1        5.380
NOEUPP  ILE  137 HN    LEU  138 HN         3.390
NOEUPP  ILE  137 HA    ASP- 140 HN         3.730
NOEUPP  ILE  137 HA    ASP- 140 HB2        3.520
NOEUPP  ILE  137 HA    ASP- 140 HB3        3.520
NOEUPP  ILE  137 HB    LEU  138 HN         3.240
NOEUPP  ILE  137 QG2   LEU  138 HN         5.750
NOEUPP  ILE  137 QG2   GLU- 141 QG         6.660
NOEUPP  LEU  138 HN    LEU  138 QB         3.900
NOEUPP  LEU  138 HN    LEU  138 HG         3.330
NOEUPP  LEU  138 HN    LEU  138 QQD        6.360
NOEUPP  LEU  138 HN    GLU- 139 HN         3.300
NOEUPP  LEU  138 HA    LEU  138 HG         3.450
NOEUPP  LEU  138 HA    GLU- 141 HN         3.730
NOEUPP  LEU  138 HA    GLU- 141 QB         5.040
NOEUPP  GLU- 139 HN    GLU- 139 HB2        3.580
NOEUPP  GLU- 139 HN    GLU- 139 HB3        3.580
NOEUPP  GLU- 139 HN    GLU- 139 QB         3.270
NOEUPP  GLU- 139 HN    GLU- 139 QG         5.170
NOEUPP  GLU- 139 HA    GLU- 141 HN         4.070
NOEUPP  GLU- 139 HA    GLU- 142 QB         3.490
NOEUPP  GLU- 139 QB    ASP- 140 HN         3.990
NOEUPP  ASP- 140 HN    ASP- 140 HB2        3.240
NOEUPP  ASP- 140 HN    ASP- 140 HB3        3.240
NOEUPP  ASP- 140 HN    ASP- 140 QB         2.910
NOEUPP  ASP- 140 HN    GLU- 141 HN         3.330
NOEUPP  ASP- 140 HA    ASP- 140 QB         2.720
NOEUPP  ASP- 140 HA    LYS+ 143 HB2        3.300
NOEUPP  ASP- 140 HA    LYS+ 143 HB3        3.300
NOEUPP  ASP- 140 HB2   GLU- 141 HN         3.640
NOEUPP  ASP- 140 HB3   GLU- 141 HN         3.640
NOEUPP  GLU- 141 HN    GLU- 141 QG         5.200
NOEUPP  GLU- 141 HN    GLU- 142 HN         3.050
NOEUPP  GLU- 141 HN    LYS+ 143 HN         4.510
NOEUPP  GLU- 141 HA    GLU- 142 HN         3.550
NOEUPP  GLU- 141 HA    HIS  144 HN         3.640
NOEUPP  GLU- 141 HA    HIS  144 QB         4.700
NOEUPP  GLU- 142 HN    GLU- 142 HB2        3.020
NOEUPP  GLU- 142 HN    GLU- 142 HB3        3.020
NOEUPP  GLU- 142 HN    GLU- 142 QB         2.730
NOEUPP  GLU- 142 HN    GLU- 142 QG         5.110
NOEUPP  GLU- 142 HN    LYS+ 143 HN         2.900
NOEUPP  GLU- 142 HA    LYS+ 143 HN         3.550
NOEUPP  GLU- 142 HA    ILE  145 HB         3.390
NOEUPP  GLU- 142 QB    LYS+ 143 HN         4.300
NOEUPP  LYS+ 143 HN    LYS+ 143 HB2        3.170
NOEUPP  LYS+ 143 HN    LYS+ 143 HB3        3.170
NOEUPP  LYS+ 143 HN    LYS+ 143 QG         4.920
NOEUPP  LYS+ 143 HN    LYS+ 143 QD         5.970
NOEUPP  LYS+ 143 HN    HIS  144 HN         3.210
NOEUPP  LYS+ 143 HN    HIS  144 HD2        5.000
NOEUPP  LYS+ 143 HA    GLU- 146 HN         3.640
NOEUPP  LYS+ 143 HA    GLU- 146 QB         3.960
NOEUPP  LYS+ 143 HA    GLU- 146 QG         4.860
NOEUPP  LYS+ 143 HB2   HIS  144 HN         3.670
NOEUPP  LYS+ 143 HB2   HIS  144 HD2        4.760
NOEUPP  LYS+ 143 HB2   TRP  147 HE1        5.500
NOEUPP  LYS+ 143 HB3   HIS  144 HN         3.670
NOEUPP  LYS+ 143 HB3   HIS  144 HD2        4.760
NOEUPP  LYS+ 143 HB3   TRP  147 HE1        5.500
NOEUPP  LYS+ 143 QB    TRP  147 HE1        5.050
NOEUPP  LYS+ 143 QG    HIS  144 HD2        6.070
NOEUPP  HIS  144 HN    HIS  144 HB2        3.620
NOEUPP  HIS  144 HN    HIS  144 HB3        3.120
NOEUPP  HIS  144 HN    HIS  144 HD2        3.760
NOEUPP  HIS  144 HN    ILE  145 HN         3.360
NOEUPP  HIS  144 HA    HIS  144 HD2        2.960
NOEUPP  HIS  144 HA    ILE  145 HN         3.580
NOEUPP  HIS  144 HA    TRP  147 QB         4.490
NOEUPP  HIS  144 HA    TRP  147 HE3        3.890
NOEUPP  HIS  144 QB    ILE  145 HN         4.950
NOEUPP  HIS  144 HD2   TRP  147 QB         6.310
NOEUPP  HIS  144 HD2   TRP  147 HE3        3.480
NOEUPP  HIS  144 HD2   TRP  147 HZ3        3.950
NOEUPP  ILE  145 HN    ILE  145 HB         3.050
NOEUPP  ILE  145 HN    ILE  145 QG2        4.230
NOEUPP  ILE  145 HN    ILE  145 QG1        6.380
NOEUPP  ILE  145 HN    ILE  145 QD1        4.330
NOEUPP  ILE  145 HN    GLU- 146 HN         3.520
NOEUPP  ILE  145 HA    ILE  145 QD1        4.020
NOEUPP  ILE  145 HA    TRP  147 HN         4.380
NOEUPP  ILE  145 HA    LEU  148 HN         3.520
NOEUPP  ILE  145 HA    LEU  148 HB2        3.420
NOEUPP  ILE  145 HA    LEU  148 HB3        3.420
NOEUPP  ILE  145 HA    LEU  148 QB         3.170
NOEUPP  ILE  145 HA    LEU  148 HG         4.040
NOEUPP  ILE  145 HB    ILE  145 QD1        3.770
NOEUPP  ILE  145 QG2   GLU- 146 HN         5.440
NOEUPP  ILE  145 QG1   GLU- 146 HN         6.380
NOEUPP  GLU- 146 HN    GLU- 146 HB2        3.480
NOEUPP  GLU- 146 HN    GLU- 146 HB3        3.480
NOEUPP  GLU- 146 HN    GLU- 146 QB         3.290
NOEUPP  GLU- 146 HN    GLU- 146 QG         4.760
NOEUPP  GLU- 146 HN    TRP  147 HN         3.270
NOEUPP  GLU- 146 HN    LEU  148 HN         4.510
NOEUPP  GLU- 146 HA    GLU- 146 QG         3.870
NOEUPP  GLU- 146 HA    TRP  147 HN         3.550
NOEUPP  GLU- 146 HB2   TRP  147 HN         4.040
NOEUPP  GLU- 146 HB3   TRP  147 HN         4.040
NOEUPP  GLU- 146 QB    TRP  147 HN         3.500
NOEUPP  GLU- 146 QG    TRP  147 HD1        5.450
NOEUPP  TRP  147 HN    TRP  147 HB2        3.450
NOEUPP  TRP  147 HN    TRP  147 HB3        3.450
NOEUPP  TRP  147 HN    TRP  147 QB         3.230
NOEUPP  TRP  147 HN    TRP  147 HD1        3.640
NOEUPP  TRP  147 HN    LEU  148 HN         3.050
NOEUPP  TRP  147 HN    GLU- 149 HN         4.230
NOEUPP  TRP  147 HA    TRP  147 HD1        2.590
NOEUPP  TRP  147 HA    TRP  147 HE1        5.100
NOEUPP  TRP  147 HA    THR  150 HN         3.170
NOEUPP  TRP  147 HA    THR  150 HB         3.450
NOEUPP  TRP  147 HB2   LEU  148 HN         3.700
NOEUPP  TRP  147 HB3   LEU  148 HN         3.700
NOEUPP  TRP  147 QB    TRP  147 HE3        3.490
NOEUPP  LEU  148 HN    LEU  148 HB2        3.070
NOEUPP  LEU  148 HN    LEU  148 HB3        3.470
NOEUPP  LEU  148 HN    LEU  148 QB         2.990
NOEUPP  LEU  148 HN    LEU  148 HG         4.240
NOEUPP  LEU  148 HN    LEU  148 QD1        5.500
NOEUPP  LEU  148 HN    LEU  148 QD2        5.500
NOEUPP  LEU  148 HN    LEU  148 QQD        4.890
NOEUPP  LEU  148 HN    GLU- 149 HN         3.390
NOEUPP  LEU  148 HA    LEU  148 HG         3.890
NOEUPP  LEU  148 HA    LEU  148 QD1        4.700
NOEUPP  LEU  148 HA    LEU  148 QD2        4.700
NOEUPP  LEU  148 HA    LEU  148 QQD        4.240
NOEUPP  LEU  148 HA    GLU- 149 HN         3.550
NOEUPP  LEU  148 HA    ILE  151 HN         3.610
NOEUPP  LEU  148 HA    ILE  151 HB         2.710
NOEUPP  LEU  148 HG    GLU- 149 HN         4.650
NOEUPP  LEU  148 QD1   GLU- 149 HN         5.910
NOEUPP  LEU  148 QD2   GLU- 149 HN         5.910
NOEUPP  LEU  148 QQD   GLU- 149 HN         5.430
NOEUPP  GLU- 149 HN    GLU- 149 HB2        3.140
NOEUPP  GLU- 149 HN    GLU- 149 HB3        3.140
NOEUPP  GLU- 149 HN    GLU- 149 QB         2.860
NOEUPP  GLU- 149 HN    GLU- 149 QG         5.140
NOEUPP  GLU- 149 HN    THR  150 HN         3.330
NOEUPP  GLU- 149 HA    ASN  152 HN         3.270
NOEUPP  GLU- 149 HA    ASN  152 HB2        4.290
NOEUPP  GLU- 149 HA    ASN  152 HB3        4.290
NOEUPP  GLU- 149 HA    ASN  152 QB         3.840
NOEUPP  GLU- 149 HB2   THR  150 HN         3.520
NOEUPP  GLU- 149 HB3   THR  150 HN         3.520
NOEUPP  THR  150 HN    THR  150 HB         3.360
NOEUPP  THR  150 HN    THR  150 QG2        4.200
NOEUPP  THR  150 HN    ILE  151 HN         2.770
NOEUPP  THR  150 HA    ILE  151 HN         3.420
NOEUPP  THR  150 HB    ILE  151 HN         3.890
NOEUPP  THR  150 QG2   ILE  151 HN         4.480
NOEUPP  ILE  151 HN    ILE  151 HB         3.390
NOEUPP  ILE  151 HN    ILE  151 QG2        4.640
NOEUPP  ILE  151 HN    ILE  151 QG1        5.850
NOEUPP  ILE  151 HN    ILE  151 QD1        5.010
NOEUPP  ILE  151 HN    ASN  152 HN         2.770
NOEUPP  ILE  151 HA    ASN  152 HN         3.210
NOEUPP  ILE  151 HB    ASN  152 HN         3.520
NOEUPP  ILE  151 QG2   ILE  151 QD1        4.460
NOEUPP  ILE  151 QG2   ASN  152 HN         4.670
NOEUPP  ASN  152 HN    ASN  152 HB2        3.210
NOEUPP  ASN  152 HN    ASN  152 HB3        3.210
NOEUPP  ASN  152 HN    ASN  152 QB         3.020
NOEUPP  ASN  152 HA    GLY  153 HN         3.360
NOEUPP  ASP-  40 HB2   HIS  144 HE1        2.870
NOEUPP  ASP-  40 HB3   HIS  144 HE1        2.870
NOEUPP  ASP-  40 QB    HIS  144 HD2        5.600
NOEUPP  TYR    3 QD    ALA  121 HA         7.640
NOEUPP  TYR    3 QD    ALA  121 QB         7.270
NOEUPP  TYR    3 QD    LYS+ 130 QG         8.520
NOEUPP  TYR    3 QD    LEU  134 QQD        9.120
NOEUPP  TYR    3 QE    ALA  121 HA         7.630
NOEUPP  TYR    3 QE    ALA  121 QB         8.260
NOEUPP  TYR    3 QE    LYS+ 130 QG         8.510
NOEUPP  TYR    3 QE    LEU  134 QQD        8.870
NOEUPP  LEU   17 HB2   LEU  107 QD1        7.590
NOEUPP  LEU   17 HB2   LEU  107 QD2        7.590
NOEUPP  LEU   17 HB3   LEU  107 QD1        7.590
NOEUPP  LEU   17 HB3   LEU  107 QD2        7.590
NOEUPP  LEU   17 QB    LEU  107 QQD        5.820
NOEUPP  LEU   17 QQD   LEU  107 QQD        9.390
NOEUPP  TYR   18 HN    LEU  107 QQD        7.040
NOEUPP  TYR   18 HA    LEU  107 QQD        6.580
NOEUPP  TYR   18 QD    LEU  107 QD1        8.050
NOEUPP  TYR   18 QD    LEU  107 QD2        8.050
NOEUPP  TYR   18 QD    LEU  107 QQD        7.770
NOEUPP  TYR   18 QE    LEU  107 QD1        7.670
NOEUPP  TYR   18 QE    LEU  148 QD1        7.020
NOEUPP  TYR   18 QE    LEU  148 QD2        7.020
NOEUPP  TYR   18 QE    LEU  148 QQD        6.450
NOEUPP  TYR   18 HH    GLU- 111 HG2        3.920
NOEUPP  TYR   18 HH    GLU- 111 HG3        3.920
NOEUPP  TYR   18 HH    GLU- 111 QG         3.730
NOEUPP  TYR   18 HH    HIS  144 HB2        5.500
NOEUPP  TYR   18 HH    HIS  144 HB3        5.500
NOEUPP  TYR   18 HH    HIS  144 QB         5.150
NOEUPP  TYR   18 HH    LEU  148 QQD        6.520
NOEUPP  ALA   21 QB    LEU  107 QD1        7.560
NOEUPP  GLU-  41 HN    HIS  144 HE1        4.790
NOEUPP  HIS   44 HD2   ILE  137 HA         4.820
NOEUPP  HIS   44 HD2   ILE  137 QG2        5.380
NOEUPP  HIS   44 HD2   ILE  137 QG1        5.660
NOEUPP  HIS   44 HE1   ILE  137 QG2        6.530
NOEUPP  HIS   44 HE1   GLU- 141 QG         6.220
NOEUPP  HIS   44 HE2   ASP- 140 HA         5.190
NOEUPP  HIS   44 HE2   ASP- 140 HB2        4.230
NOEUPP  HIS   44 HE2   ASP- 140 HB3        4.230
NOEUPP  TRP   47 HB2   VAL  133 QG1        8.630
NOEUPP  TRP   47 HB2   VAL  133 QG2        8.630
NOEUPP  TRP   47 HB3   VAL  133 QG1        8.630
NOEUPP  TRP   47 HB3   VAL  133 QG2        8.630
NOEUPP  TRP   47 QB    VAL  133 QQG        6.780
NOEUPP  TRP   47 HE3   VAL  133 QQG        6.380
NOEUPP  TRP   47 HE3   ILE  137 QD1        4.390
NOEUPP  TRP   47 HZ3   ILE  137 HB         3.920
NOEUPP  ASP- 140 HB2   HIS   44 HE1        2.870
NOEUPP  ASP- 140 HB3   HIS   44 HE1        2.870
NOEUPP  ASP- 140 QB    HIS   44 HD2        5.600
NOEUPP  TYR  103 QD    ALA   21 HA         7.640
NOEUPP  TYR  103 QD    ALA   21 QB         7.270
NOEUPP  TYR  103 QD    LYS+  30 QG         8.520
NOEUPP  TYR  103 QD    LEU   34 QQD        9.120
NOEUPP  TYR  103 QE    ALA   21 HA         7.630
NOEUPP  TYR  103 QE    ALA   21 QB         8.260
NOEUPP  TYR  103 QE    LYS+  30 QG         8.510
NOEUPP  TYR  103 QE    LEU   34 QQD        8.870
NOEUPP  LEU  117 HB2   LEU    7 QD1        7.590
NOEUPP  LEU  117 HB2   LEU    7 QD2        7.590
NOEUPP  LEU  117 HB3   LEU    7 QD1        7.590
NOEUPP  LEU  117 HB3   LEU    7 QD2        7.590
NOEUPP  LEU  117 QB    LEU    7 QQD        5.820
NOEUPP  LEU  117 QQD   LEU    7 QQD        9.390
NOEUPP  TYR  118 HN    LEU    7 QQD        7.040
NOEUPP  TYR  118 HA    LEU    7 QQD        6.580
NOEUPP  TYR  118 QD    LEU    7 QD1        8.050
NOEUPP  TYR  118 QD    LEU    7 QD2        8.050
NOEUPP  TYR  118 QD    LEU    7 QQD        7.770
NOEUPP  TYR  118 QE    LEU    7 QD1        7.670
NOEUPP  TYR  118 QE    LEU   48 QD1        7.020
NOEUPP  TYR  118 QE    LEU   48 QD2        7.020
NOEUPP  TYR  118 QE    LEU   48 QQD        6.450
NOEUPP  TYR  118 HH    GLU-  11 HG2        3.920
NOEUPP  TYR  118 HH    GLU-  11 HG3        3.920
NOEUPP  TYR  118 HH    GLU-  11 QG         3.730
NOEUPP  TYR  118 HH    HIS   44 HB2        5.500
NOEUPP  TYR  118 HH    HIS   44 HB3        5.500
NOEUPP  TYR  118 HH    HIS   44 QB         5.150
NOEUPP  TYR  118 HH    LEU   48 QQD        6.520
NOEUPP  ALA  121 QB    LEU    7 QD1        7.560
NOEUPP  GLU- 141 HN    HIS   44 HE1        4.790
NOEUPP  HIS  144 HD2   ILE   37 HA         4.820
NOEUPP  HIS  144 HD2   ILE   37 QG2        5.380
NOEUPP  HIS  144 HD2   ILE   37 QG1        5.660
NOEUPP  HIS  144 HE1   ILE   37 QG2        6.530
NOEUPP  HIS  144 HE1   GLU-  41 QG         6.220
NOEUPP  HIS  144 HE2   ASP-  40 HA         5.190
NOEUPP  HIS  144 HE2   ASP-  40 HB2        4.230
NOEUPP  HIS  144 HE2   ASP-  40 HB3        4.230
NOEUPP  TRP  147 HB2   VAL   33 QG1        8.630
NOEUPP  TRP  147 HB2   VAL   33 QG2        8.630
NOEUPP  TRP  147 HB3   VAL   33 QG1        8.630
NOEUPP  TRP  147 HB3   VAL   33 QG2        8.630
NOEUPP  TRP  147 QB    VAL   33 QQG        6.780
NOEUPP  TRP  147 HE3   VAL   33 QQG        6.380
NOEUPP  TRP  147 HE3   ILE   37 QD1        4.390
NOEUPP  TRP  147 HZ3   ILE   37 HB         3.920
NOEUPP  LEU    7 HN    LEU   48 QQD        7.480
NOEUPP  LEU    7 QB    LEU   48 QQD        8.010
NOEUPP  LEU    7 QD1   LEU   48 QD1        9.920
NOEUPP  LEU    7 QD1   LEU   48 QD2        9.920
NOEUPP  LEU    7 QD2   LEU   48 QD1        9.920
NOEUPP  LEU    7 QD2   LEU   48 QD2        9.920
NOEUPP  LEU    7 QQD   LEU   48 QQD        7.800
NOEUPP  TYR    8 HA    LEU   48 QD1        4.300
NOEUPP  TYR    8 HA    LEU   48 QD2        4.300
NOEUPP  TYR    8 HA    LEU   48 QQD        3.660
NOEUPP  TYR    8 QB    LEU   48 QQD        7.580
NOEUPP  TYR    8 QD    ILE   45 QG2        7.550
NOEUPP  TYR    8 QD    LEU   48 QD1        7.550
NOEUPP  TYR    8 QD    LEU   48 QD2        7.550
NOEUPP  TYR    8 QD    LEU   48 QQD        7.200
NOEUPP  TYR    8 QD    GLU-  49 HA         7.550
NOEUPP  TYR    8 QE    ILE   45 QG2        6.640
NOEUPP  TYR    8 QE    LEU   48 QB         7.640
NOEUPP  TYR    8 QE    GLU-  49 QG         7.920
NOEUPP  TYR   18 QD    ILE   37 QG2        8.360
NOEUPP  TYR   18 QD    GLU-  41 QG         8.520
NOEUPP  TYR   18 QD    LEU   34 QQD        7.320
NOEUPP  TYR   18 QE    ILE   37 QG2        7.270
NOEUPP  TYR   18 QE    LEU   34 QQD        8.350
NOEUPP  TYR   18 QE    LEU   34 HG         6.370
NOEUPP  TYR   18 HH    ILE   37 QD1        5.190
NOEUPP  TYR   18 HH    ILE   37 QG2        5.070
NOEUPP  TYR   18 HH    ILE   37 QG1        6.310
NOEUPP  ARG+  19 HN    LEU   38 QQD        7.010
NOEUPP  SER   22 HN    LEU   34 QB         6.380
NOEUPP  ALA   25 QB    LYS+  31 HN         4.820
NOEUPP  LEU  107 HN    LEU  148 QQD        7.480
NOEUPP  LEU  107 QB    LEU  148 QQD        8.010
NOEUPP  LEU  107 QD1   LEU  148 QD1        9.920
NOEUPP  LEU  107 QD1   LEU  148 QD2        9.920
NOEUPP  LEU  107 QD2   LEU  148 QD1        9.920
NOEUPP  LEU  107 QD2   LEU  148 QD2        9.920
NOEUPP  LEU  107 QQD   LEU  148 QQD        7.800
NOEUPP  TYR  108 HA    LEU  148 QD1        4.300
NOEUPP  TYR  108 HA    LEU  148 QD2        4.300
NOEUPP  TYR  108 HA    LEU  148 QQD        3.660
NOEUPP  TYR  108 QB    LEU  148 QQD        7.580
NOEUPP  TYR  108 QD    ILE  145 QG2        7.550
NOEUPP  TYR  108 QD    LEU  148 QD1        7.550
NOEUPP  TYR  108 QD    LEU  148 QD2        7.550
NOEUPP  TYR  108 QD    LEU  148 QQD        7.200
NOEUPP  TYR  108 QD    GLU- 149 HA         7.550
NOEUPP  TYR  108 QE    ILE  145 QG2        6.640
NOEUPP  TYR  108 QE    LEU  148 QB         7.640
NOEUPP  TYR  108 QE    GLU- 149 QG         7.920
NOEUPP  TYR  118 QD    ILE  137 QG2        8.360
NOEUPP  TYR  118 QD    GLU- 141 QG         8.520
NOEUPP  TYR  118 QD    LEU  134 QQD        7.320
NOEUPP  TYR  118 QE    ILE  137 QG2        7.270
NOEUPP  TYR  118 QE    LEU  134 QQD        8.350
NOEUPP  TYR  118 QE    LEU  134 HG         6.370
NOEUPP  TYR  118 HH    ILE  137 QD1        5.190
NOEUPP  TYR  118 HH    ILE  137 QG2        4.030
NOEUPP  TYR  118 HH    ILE  137 QG1        6.310
NOEUPP  ARG+ 119 HN    LEU  138 QQD        7.010
NOEUPP  SER  122 HN    LEU  134 QB         6.380
NOEUPP  ALA  125 QB    LYS+ 131 HN         4.820

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1H        MET   1   7.230  22.069   0.221
    2   2H    MET   1          2H        MET   1   5.721  21.581  -0.196
    3   3H    MET   1          3H        MET   1   6.158  23.147  -0.374
    4    HA   MET   1           HA       MET   1   6.103  22.065  -2.510
    5   1HB   MET   1          1HB       MET   1   8.880  22.884  -1.562
    6   2HB   MET   1          2HB       MET   1   8.470  22.507  -3.237
    7   1HG   MET   1          1HG       MET   1   8.378  24.865  -3.018
    8   2HG   MET   1          2HG       MET   1   6.731  24.281  -3.218
    9   1HE   MET   1          1HE       MET   1   7.203  27.237  -2.413
   10   2HE   MET   1          2HE       MET   1   5.588  26.490  -2.479
   11   3HE   MET   1          3HE       MET   1   6.073  27.436  -1.055
   12    H    ASP   2           H        ASP   2   8.857  20.580  -0.654
   13    HA   ASP   2           HA       ASP   2   8.859  18.329  -2.497
   14   1HB   ASP   2          1HB       ASP   2  10.848  19.628  -1.659
   15   2HB   ASP   2          2HB       ASP   2  10.588  18.915  -0.068
   16    H    TYR   3           H        TYR   3   6.515  18.485  -0.621
   17    HA   TYR   3           HA       TYR   3   6.790  16.614   1.511
   18   1HB   TYR   3          1HB       TYR   3   4.222  16.675   1.454
   19   2HB   TYR   3          2HB       TYR   3   5.065  18.185   1.718
   20    HD1  TYR   3           1HD      TYR   3   3.682  16.161  -1.193
   21    HD2  TYR   3           2HD      TYR   3   4.344  20.045   0.559
   22    HE1  TYR   3           1HE      TYR   3   2.650  17.222  -3.179
   23    HE2  TYR   3           2HE      TYR   3   3.331  21.113  -1.472
   24    HH   TYR   3           HH       TYR   3   2.155  19.192  -4.236
   25    H    LEU   4           H        LEU   4   6.619  15.890  -1.731
   26    HA   LEU   4           HA       LEU   4   4.871  13.727  -1.873
   27   1HB   LEU   4          1HB       LEU   4   5.888  13.093  -3.926
   28   2HB   LEU   4          2HB       LEU   4   5.868  14.841  -3.790
   29    HG   LEU   4           HG       LEU   4   8.340  14.408  -2.809
   30   1HD1  LEU   4          1HD1      LEU   4   8.252  11.910  -3.112
   31   2HD1  LEU   4          2HD1      LEU   4   7.968  12.153  -4.839
   32   3HD1  LEU   4          3HD1      LEU   4   9.502  12.664  -4.100
   33   1HD2  LEU   4          1HD2      LEU   4   7.658  14.431  -5.780
   34   2HD2  LEU   4          2HD2      LEU   4   7.802  15.856  -4.725
   35   3HD2  LEU   4          3HD2      LEU   4   9.228  14.867  -5.066
   36    H    ARG   5           H        ARG   5   8.192  13.610  -0.697
   37    HA   ARG   5           HA       ARG   5   8.439  10.742  -0.445
   38   1HB   ARG   5          1HB       ARG   5   9.789  12.973   1.145
   39   2HB   ARG   5          2HB       ARG   5  10.307  11.285   1.084
   40   1HG   ARG   5          1HG       ARG   5  10.785  11.493  -1.338
   41   2HG   ARG   5          2HG       ARG   5  10.236  13.181  -1.308
   42   1HD   ARG   5          1HD       ARG   5  11.983  13.668   0.422
   43   2HD   ARG   5          2HD       ARG   5  12.622  12.029   0.187
   44    HE   ARG   5           HE       ARG   5  12.588  13.006  -2.369
   45   1HH1  ARG   5          1HH2      ARG   5  13.966  14.373   0.548
   46   2HH1  ARG   5          2HH2      ARG   5  15.122  15.327  -0.337
   47   1HH2  ARG   5          1HH1      ARG   5  14.069  14.275  -3.437
   48   2HH2  ARG   5          2HH1      ARG   5  15.204  15.228  -2.530
   49    H    GLU   6           H        GLU   6   7.126  13.220   1.708
   50    HA   GLU   6           HA       GLU   6   6.877  11.529   4.039
   51   1HB   GLU   6          1HB       GLU   6   7.010  14.067   3.979
   52   2HB   GLU   6          2HB       GLU   6   5.354  14.096   3.384
   53   1HG   GLU   6          1HG       GLU   6   4.537  12.998   5.409
   54   2HG   GLU   6          2HG       GLU   6   6.183  12.692   5.965
   55    H    LEU   7           H        LEU   7   4.616  12.530   1.468
   56    HA   LEU   7           HA       LEU   7   2.375  10.969   2.319
   57   1HB   LEU   7          1HB       LEU   7   3.237  12.034  -0.408
   58   2HB   LEU   7          2HB       LEU   7   1.808  11.033  -0.180
   59    HG   LEU   7           HG       LEU   7   1.048  12.702   1.593
   60   1HD1  LEU   7          1HD1      LEU   7   3.047  14.050   1.940
   61   2HD1  LEU   7          2HD1      LEU   7   3.104  14.443   0.205
   62   3HD1  LEU   7          3HD1      LEU   7   1.791  15.059   1.224
   63   1HD2  LEU   7          1HD2      LEU   7   1.225  13.622  -1.302
   64   2HD2  LEU   7          2HD2      LEU   7   0.029  12.494  -0.625
   65   3HD2  LEU   7          3HD2      LEU   7   0.037  14.173  -0.093
   66    H    TYR   8           H        TYR   8   4.891  10.122  -0.111
   67    HA   TYR   8           HA       TYR   8   4.160   7.445  -0.684
   68   1HB   TYR   8          1HB       TYR   8   6.151   9.211  -1.371
   69   2HB   TYR   8          2HB       TYR   8   7.080   8.265  -0.280
   70    HD1  TYR   8           1HD      TYR   8   7.445   8.882  -3.269
   71    HD2  TYR   8           2HD      TYR   8   5.889   5.461  -1.148
   72    HE1  TYR   8           1HE      TYR   8   8.193   7.399  -5.114
   73    HE2  TYR   8           2HE      TYR   8   6.667   3.984  -2.988
   74    HH   TYR   8           HH       TYR   8   8.340   5.237  -5.883
   75    H    LYS   9           H        LYS   9   6.342   8.577   1.964
   76    HA   LYS   9           HA       LYS   9   6.760   5.934   2.972
   77   1HB   LYS   9          1HB       LYS   9   7.045   8.675   4.267
   78   2HB   LYS   9          2HB       LYS   9   7.314   7.188   5.187
   79   1HG   LYS   9          1HG       LYS   9   9.013   6.447   3.537
   80   2HG   LYS   9          2HG       LYS   9   8.829   7.977   2.662
   81   1HD   LYS   9          1HD       LYS   9   9.542   9.224   4.685
   82   2HD   LYS   9          2HD       LYS   9   9.667   7.697   5.587
   83   1HE   LYS   9          1HE       LYS   9  11.370   6.897   3.931
   84   2HE   LYS   9          2HE       LYS   9  11.296   8.469   3.124
   85   1HZ   LYS   9          1HZ       LYS   9  12.060   9.488   5.215
   86   2HZ   LYS   9          2HZ       LYS   9  12.134   8.027   5.946
   87   3HZ   LYS   9          3HZ       LYS   9  13.137   8.371   4.707
   88    H    LEU  10           H        LEU  10   4.244   8.233   4.055
   89    HA   LEU  10           HA       LEU  10   3.177   6.355   5.890
   90   1HB   LEU  10          1HB       LEU  10   2.213   8.935   4.691
   91   2HB   LEU  10          2HB       LEU  10   1.072   7.947   5.606
   92    HG   LEU  10           HG       LEU  10   3.800   8.630   6.774
   93   1HD1  LEU  10          1HD1      LEU  10   2.802  10.753   6.234
   94   2HD1  LEU  10          2HD1      LEU  10   1.260  10.281   7.003
   95   3HD1  LEU  10          3HD1      LEU  10   2.733  10.498   7.980
   96   1HD2  LEU  10          1HD2      LEU  10   1.106   7.973   8.050
   97   2HD2  LEU  10          2HD2      LEU  10   2.474   6.850   7.902
   98   3HD2  LEU  10          3HD2      LEU  10   2.626   8.288   8.914
   99    H    GLU  11           H        GLU  11   2.430   7.036   2.516
  100    HA   GLU  11           HA       GLU  11   0.446   5.069   1.984
  101   1HB   GLU  11          1HB       GLU  11   2.549   6.607   0.519
  102   2HB   GLU  11          2HB       GLU  11   2.033   5.281  -0.358
  103   1HG   GLU  11          1HG       GLU  11   0.198   7.446   0.817
  104   2HG   GLU  11          2HG       GLU  11   0.850   7.461  -0.816
  105    H    GLN  12           H        GLN  12   4.071   4.641   2.142
  106    HA   GLN  12           HA       GLN  12   3.767   1.817   1.729
  107   1HB   GLN  12          1HB       GLN  12   6.096   3.634   2.287
  108   2HB   GLN  12          2HB       GLN  12   6.256   1.869   2.242
  109   1HG   GLN  12          1HG       GLN  12   5.208   1.814   0.006
  110   2HG   GLN  12          2HG       GLN  12   5.133   3.559  -0.026
  111   1HE2  GLN  12          2HE2      GLN  12   6.776   1.294  -1.552
  112   2HE2  GLN  12          1HE2      GLN  12   8.391   1.983  -1.544
  113    H    GLN  13           H        GLN  13   3.879   3.733   4.625
  114    HA   GLN  13           HA       GLN  13   4.435   1.498   6.418
  115   1HB   GLN  13          1HB       GLN  13   3.135   4.244   6.756
  116   2HB   GLN  13          2HB       GLN  13   3.147   3.096   8.086
  117   1HG   GLN  13          1HG       GLN  13   5.710   3.961   6.688
  118   2HG   GLN  13          2HG       GLN  13   5.022   4.822   8.062
  119   1HE2  GLN  13          2HE2      GLN  13   6.960   2.071   7.142
  120   2HE2  GLN  13          1HE2      GLN  13   7.094   1.409   8.766
  121    H    ALA  14           H        ALA  14   1.391   2.733   4.995
  122    HA   ALA  14           HA       ALA  14  -0.234   0.715   6.378
  123   1HB   ALA  14          1HB       ALA  14  -1.215   2.765   5.334
  124   2HB   ALA  14          2HB       ALA  14  -0.661   2.220   3.736
  125   3HB   ALA  14          3HB       ALA  14  -1.883   1.286   4.625
  126    H    MET  15           H        MET  15   1.565   0.864   3.265
  127    HA   MET  15           HA       MET  15   0.693  -1.687   2.289
  128   1HB   MET  15          1HB       MET  15   1.802   0.051   0.900
  129   2HB   MET  15          2HB       MET  15   3.320  -0.254   1.744
  130   1HG   MET  15          1HG       MET  15   3.265  -1.325  -0.444
  131   2HG   MET  15          2HG       MET  15   3.509  -2.463   0.869
  132   1HE   MET  15          1HE       MET  15  -0.079  -0.968  -0.179
  133   2HE   MET  15          2HE       MET  15   0.938  -0.944  -1.640
  134   3HE   MET  15          3HE       MET  15  -0.439  -2.065  -1.530
  135    H    LYS  16           H        LYS  16   3.565  -0.894   4.325
  136    HA   LYS  16           HA       LYS  16   4.593  -3.579   4.413
  137   1HB   LYS  16          1HB       LYS  16   5.603  -1.215   4.970
  138   2HB   LYS  16          2HB       LYS  16   4.956  -1.475   6.582
  139   1HG   LYS  16          1HG       LYS  16   6.947  -3.286   5.111
  140   2HG   LYS  16          2HG       LYS  16   7.383  -2.008   6.227
  141   1HD   LYS  16          1HD       LYS  16   7.415  -3.523   7.837
  142   2HD   LYS  16          2HD       LYS  16   5.652  -3.515   7.793
  143   1HE   LYS  16          1HE       LYS  16   5.725  -5.385   6.116
  144   2HE   LYS  16          2HE       LYS  16   7.491  -5.350   6.172
  145   1HZ   LYS  16          1HZ       LYS  16   7.357  -5.939   8.540
  146   2HZ   LYS  16          2HZ       LYS  16   5.724  -5.998   8.475
  147   3HZ   LYS  16          3HZ       LYS  16   6.615  -7.072   7.634
  148    H    LEU  17           H        LEU  17   2.329  -1.812   6.495
  149    HA   LEU  17           HA       LEU  17   1.798  -3.973   8.350
  150   1HB   LEU  17          1HB       LEU  17   0.754  -1.313   7.654
  151   2HB   LEU  17          2HB       LEU  17  -0.564  -2.366   7.971
  152    HG   LEU  17           HG       LEU  17   1.845  -2.051   9.830
  153   1HD1  LEU  17          1HD1      LEU  17   0.647   0.063   9.511
  154   2HD1  LEU  17          2HD1      LEU  17  -0.880  -0.709  10.000
  155   3HD1  LEU  17          3HD1      LEU  17   0.471  -0.554  11.157
  156   1HD2  LEU  17          1HD2      LEU  17  -0.937  -3.198  10.357
  157   2HD2  LEU  17          2HD2      LEU  17   0.562  -4.141  10.230
  158   3HD2  LEU  17          3HD2      LEU  17   0.354  -2.992  11.559
  159    H    TYR  18           H        TYR  18   0.227  -3.018   5.329
  160    HA   TYR  18           HA       TYR  18  -1.722  -5.057   5.215
  161   1HB   TYR  18          1HB       TYR  18  -0.512  -3.136   3.279
  162   2HB   TYR  18          2HB       TYR  18  -1.371  -4.466   2.604
  163    HD1  TYR  18           1HD      TYR  18  -3.744  -4.993   3.806
  164    HD2  TYR  18           2HD      TYR  18  -1.796  -1.168   3.571
  165    HE1  TYR  18           1HE      TYR  18  -5.926  -3.850   4.203
  166    HE2  TYR  18           2HE      TYR  18  -3.906  -0.022   4.139
  167    HH   TYR  18           HH       TYR  18  -6.224  -0.291   4.361
  168    H    ARG  19           H        ARG  19   1.646  -5.167   4.085
  169    HA   ARG  19           HA       ARG  19   1.730  -7.628   2.734
  170   1HB   ARG  19          1HB       ARG  19   3.576  -5.862   3.199
  171   2HB   ARG  19          2HB       ARG  19   3.787  -6.653   4.755
  172   1HG   ARG  19          1HG       ARG  19   5.480  -7.486   3.377
  173   2HG   ARG  19          2HG       ARG  19   4.315  -8.807   3.497
  174   1HD   ARG  19          1HD       ARG  19   3.446  -8.286   1.261
  175   2HD   ARG  19          2HD       ARG  19   4.422  -6.806   1.204
  176    HE   ARG  19           HE       ARG  19   5.833  -9.404   1.524
  177   1HH1  ARG  19          1HH2      ARG  19   5.064  -6.799  -0.697
  178   2HH1  ARG  19          2HH2      ARG  19   6.376  -7.210  -1.767
  179   1HH2  ARG  19          1HH1      ARG  19   7.483  -9.861   0.118
  180   2HH2  ARG  19          2HH1      ARG  19   7.695  -8.904  -1.317
  181    H    GLU  20           H        GLU  20   1.556  -7.068   6.202
  182    HA   GLU  20           HA       GLU  20   1.769  -9.964   6.862
  183   1HB   GLU  20          1HB       GLU  20   2.792  -7.723   8.022
  184   2HB   GLU  20          2HB       GLU  20   1.289  -7.808   8.913
  185   1HG   GLU  20          1HG       GLU  20   1.805 -10.107   9.646
  186   2HG   GLU  20          2HG       GLU  20   3.288 -10.101   8.685
  187    H    ALA  21           H        ALA  21  -0.516  -7.278   7.097
  188    HA   ALA  21           HA       ALA  21  -2.720  -8.557   8.278
  189   1HB   ALA  21          1HB       ALA  21  -2.604  -6.150   7.557
  190   2HB   ALA  21          2HB       ALA  21  -2.879  -6.696   5.881
  191   3HB   ALA  21          3HB       ALA  21  -4.117  -6.962   7.105
  192    H    SER  22           H        SER  22  -1.726  -8.788   4.820
  193    HA   SER  22           HA       SER  22  -3.675 -10.540   3.842
  194   1HB   SER  22          1HB       SER  22  -1.958  -9.332   2.539
  195   2HB   SER  22          2HB       SER  22  -0.715 -10.427   3.171
  196    HG   SER  22           HG       SER  22  -1.552 -11.025   1.086
  197    H    GLU  23           H        GLU  23  -0.917 -11.397   5.973
  198    HA   GLU  23           HA       GLU  23  -1.222 -14.288   5.518
  199   1HB   GLU  23          1HB       GLU  23   0.866 -12.927   6.339
  200   2HB   GLU  23          2HB       GLU  23   0.080 -12.945   7.907
  201   1HG   GLU  23          1HG       GLU  23  -0.037 -15.462   7.779
  202   2HG   GLU  23          2HG       GLU  23   0.890 -15.386   6.280
  203    H    LYS  24           H        LYS  24  -2.193 -11.974   8.089
  204    HA   LYS  24           HA       LYS  24  -3.634 -14.015   9.585
  205   1HB   LYS  24          1HB       LYS  24  -3.075 -11.178   9.937
  206   2HB   LYS  24          2HB       LYS  24  -4.787 -11.466  10.224
  207   1HG   LYS  24          1HG       LYS  24  -2.533 -13.066  11.508
  208   2HG   LYS  24          2HG       LYS  24  -3.339 -11.691  12.268
  209   1HD   LYS  24          1HD       LYS  24  -5.458 -12.857  12.365
  210   2HD   LYS  24          2HD       LYS  24  -4.850 -14.194  11.379
  211   1HE   LYS  24          1HE       LYS  24  -3.161 -14.725  13.126
  212   2HE   LYS  24          2HE       LYS  24  -3.826 -13.449  14.148
  213   1HZ   LYS  24          1HZ       LYS  24  -5.957 -14.673  14.142
  214   2HZ   LYS  24          2HZ       LYS  24  -5.320 -15.845  13.201
  215   3HZ   LYS  24          3HZ       LYS  24  -4.760 -15.624  14.715
  216    H    ALA  25           H        ALA  25  -4.609 -11.793   7.062
  217    HA   ALA  25           HA       ALA  25  -7.386 -12.587   6.961
  218   1HB   ALA  25          1HB       ALA  25  -6.545 -10.381   6.224
  219   2HB   ALA  25          2HB       ALA  25  -5.589 -11.176   4.945
  220   3HB   ALA  25          3HB       ALA  25  -7.352 -11.229   4.893
  221    H    ARG  26           H        ARG  26  -5.337 -14.902   6.723
  222    HA   ARG  26           HA       ARG  26  -5.136 -15.919   4.134
  223   1HB   ARG  26          1HB       ARG  26  -4.648 -17.997   5.232
  224   2HB   ARG  26          2HB       ARG  26  -4.033 -16.701   6.227
  225   1HG   ARG  26          1HG       ARG  26  -6.462 -16.922   7.426
  226   2HG   ARG  26          2HG       ARG  26  -6.383 -18.532   6.696
  227   1HD   ARG  26          1HD       ARG  26  -4.016 -18.600   7.820
  228   2HD   ARG  26          2HD       ARG  26  -4.613 -17.250   8.789
  229    HE   ARG  26           HE       ARG  26  -6.531 -19.420   8.747
  230   1HH1  ARG  26          1HH2      ARG  26  -3.543 -18.562  10.357
  231   2HH1  ARG  26          2HH2      ARG  26  -3.905 -19.557  11.743
  232   1HH2  ARG  26          1HH1      ARG  26  -6.927 -20.665  10.522
  233   2HH2  ARG  26          2HH1      ARG  26  -5.779 -20.715  11.825
  234    H    ASN  27           H        ASN  27  -8.031 -15.797   6.051
  235    HA   ASN  27           HA       ASN  27  -9.597 -17.799   4.727
  236   1HB   ASN  27          1HB       ASN  27 -10.109 -16.743   6.938
  237   2HB   ASN  27          2HB       ASN  27 -10.444 -15.216   6.119
  238   1HD2  ASN  27          2HD2      ASN  27 -12.657 -14.902   5.952
  239   2HD2  ASN  27          1HD2      ASN  27 -13.803 -16.201   5.667
  240    HA   PRO  28           HA       PRO  28  -9.478 -15.809   0.829
  241   1HB   PRO  28          1HB       PRO  28 -11.334 -17.175  -0.657
  242   2HB   PRO  28          2HB       PRO  28  -9.791 -17.883  -0.090
  243   1HG   PRO  28          1HG       PRO  28 -12.518 -18.077   1.233
  244   2HG   PRO  28          2HG       PRO  28 -11.387 -19.415   0.837
  245   1HD   PRO  28          1HD       PRO  28 -11.467 -18.339   3.305
  246   2HD   PRO  28          2HD       PRO  28  -9.891 -18.770   2.568
  247    H    GLU  29           H        GLU  29 -12.416 -15.558   2.654
  248    HA   GLU  29           HA       GLU  29 -13.880 -13.801   0.872
  249   1HB   GLU  29          1HB       GLU  29 -14.732 -15.184   2.843
  250   2HB   GLU  29          2HB       GLU  29 -14.060 -13.973   3.910
  251   1HG   GLU  29          1HG       GLU  29 -16.117 -13.433   1.717
  252   2HG   GLU  29          2HG       GLU  29 -16.536 -13.805   3.383
  253    H    LYS  30           H        LYS  30 -11.851 -13.286   3.684
  254    HA   LYS  30           HA       LYS  30 -11.558 -10.413   3.450
  255   1HB   LYS  30          1HB       LYS  30 -11.112 -12.070   5.490
  256   2HB   LYS  30          2HB       LYS  30  -9.518 -12.224   4.777
  257   1HG   LYS  30          1HG       LYS  30  -9.189 -10.477   6.287
  258   2HG   LYS  30          2HG       LYS  30  -9.508  -9.585   4.802
  259   1HD   LYS  30          1HD       LYS  30 -10.773  -8.509   6.499
  260   2HD   LYS  30          2HD       LYS  30 -11.969  -9.450   5.590
  261   1HE   LYS  30          1HE       LYS  30 -11.813 -11.263   7.315
  262   2HE   LYS  30          2HE       LYS  30 -10.604 -10.317   8.189
  263   1HZ   LYS  30          1HZ       LYS  30 -12.300  -8.598   8.534
  264   2HZ   LYS  30          2HZ       LYS  30 -13.421  -9.488   7.732
  265   3HZ   LYS  30          3HZ       LYS  30 -12.805 -10.023   9.145
  266    H    LYS  31           H        LYS  31  -9.508 -13.139   2.396
  267    HA   LYS  31           HA       LYS  31  -7.543 -11.497   1.138
  268   1HB   LYS  31          1HB       LYS  31  -7.482 -14.009   1.944
  269   2HB   LYS  31          2HB       LYS  31  -7.967 -14.363   0.295
  270   1HG   LYS  31          1HG       LYS  31  -5.914 -13.860  -0.555
  271   2HG   LYS  31          2HG       LYS  31  -5.726 -12.420   0.448
  272   1HD   LYS  31          1HD       LYS  31  -5.123 -13.808   2.391
  273   2HD   LYS  31          2HD       LYS  31  -5.249 -15.277   1.391
  274   1HE   LYS  31          1HE       LYS  31  -3.451 -14.504  -0.064
  275   2HE   LYS  31          2HE       LYS  31  -3.465 -12.906   0.696
  276   1HZ   LYS  31          1HZ       LYS  31  -2.731 -13.919   2.759
  277   2HZ   LYS  31          2HZ       LYS  31  -2.654 -15.411   2.062
  278   3HZ   LYS  31          3HZ       LYS  31  -1.655 -14.210   1.566
  279    H    SER  32           H        SER  32 -10.595 -11.632   0.091
  280    HA   SER  32           HA       SER  32  -9.705 -10.663  -2.590
  281   1HB   SER  32          1HB       SER  32 -12.265 -12.171  -1.922
  282   2HB   SER  32          2HB       SER  32 -11.966 -11.335  -3.459
  283    HG   SER  32           HG       SER  32 -11.440 -13.592  -3.517
  284    H    VAL  33           H        VAL  33 -10.453  -9.512   0.260
  285    HA   VAL  33           HA       VAL  33 -11.983  -7.162  -0.810
  286    HB   VAL  33           HB       VAL  33 -12.009  -8.417   1.950
  287   1HG1  VAL  33          1HG1      VAL  33 -11.892  -6.005   2.332
  288   2HG1  VAL  33          2HG1      VAL  33 -13.133  -5.715   1.087
  289   3HG1  VAL  33          3HG1      VAL  33 -13.543  -6.564   2.592
  290   1HG2  VAL  33          1HG2      VAL  33 -14.244  -7.705  -0.010
  291   2HG2  VAL  33          2HG2      VAL  33 -13.586  -9.333   0.223
  292   3HG2  VAL  33          3HG2      VAL  33 -14.425  -8.533   1.554
  293    H    LEU  34           H        LEU  34  -9.308  -8.073   1.579
  294    HA   LEU  34           HA       LEU  34  -8.288  -5.347   1.368
  295   1HB   LEU  34          1HB       LEU  34  -6.870  -5.805   2.962
  296   2HB   LEU  34          2HB       LEU  34  -8.056  -7.035   3.363
  297    HG   LEU  34           HG       LEU  34  -5.584  -7.449   1.715
  298   1HD1  LEU  34          1HD1      LEU  34  -5.083  -6.779   4.090
  299   2HD1  LEU  34          2HD1      LEU  34  -6.008  -8.183   4.647
  300   3HD1  LEU  34          3HD1      LEU  34  -4.520  -8.405   3.698
  301   1HD2  LEU  34          1HD2      LEU  34  -7.351  -9.513   3.058
  302   2HD2  LEU  34          2HD2      LEU  34  -7.207  -9.224   1.306
  303   3HD2  LEU  34          3HD2      LEU  34  -5.827  -9.858   2.212
  304    H    GLN  35           H        GLN  35  -8.156  -8.096  -0.670
  305    HA   GLN  35           HA       GLN  35  -5.646  -7.647  -1.953
  306   1HB   GLN  35          1HB       GLN  35  -7.258  -9.659  -1.925
  307   2HB   GLN  35          2HB       GLN  35  -8.103  -8.880  -3.255
  308   1HG   GLN  35          1HG       GLN  35  -5.141  -9.641  -3.195
  309   2HG   GLN  35          2HG       GLN  35  -6.405 -10.639  -3.892
  310   1HE2  GLN  35          2HE2      GLN  35  -3.953  -9.235  -5.109
  311   2HE2  GLN  35          1HE2      GLN  35  -4.649  -8.391  -6.484
  312    H    LYS  36           H        LYS  36  -8.938  -6.362  -2.627
  313    HA   LYS  36           HA       LYS  36  -8.115  -4.978  -5.042
  314   1HB   LYS  36          1HB       LYS  36 -10.532  -4.627  -3.203
  315   2HB   LYS  36          2HB       LYS  36 -10.347  -3.746  -4.711
  316   1HG   LYS  36          1HG       LYS  36 -10.344  -6.792  -4.685
  317   2HG   LYS  36          2HG       LYS  36 -11.835  -5.865  -4.630
  318   1HD   LYS  36          1HD       LYS  36 -11.438  -6.504  -6.896
  319   2HD   LYS  36          2HD       LYS  36 -11.282  -4.751  -6.761
  320   1HE   LYS  36          1HE       LYS  36  -8.829  -4.941  -6.791
  321   2HE   LYS  36          2HE       LYS  36  -8.937  -6.709  -6.817
  322   1HZ   LYS  36          1HZ       LYS  36  -9.935  -6.555  -9.008
  323   2HZ   LYS  36          2HZ       LYS  36  -9.982  -4.917  -8.946
  324   3HZ   LYS  36          3HZ       LYS  36  -8.540  -5.679  -9.000
  325    H    ILE  37           H        ILE  37  -8.208  -4.007  -1.659
  326    HA   ILE  37           HA       ILE  37  -7.255  -1.266  -2.133
  327    HB   ILE  37           HB       ILE  37  -6.906  -3.203   0.206
  328   1HG1  ILE  37          1HG1      ILE  37  -8.842  -0.922  -0.114
  329   2HG1  ILE  37          2HG1      ILE  37  -9.189  -2.656  -0.081
  330   1HG2  ILE  37          1HG2      ILE  37  -5.049  -1.536   0.234
  331   2HG2  ILE  37          2HG2      ILE  37  -6.248  -0.225   0.174
  332   3HG2  ILE  37          3HG2      ILE  37  -6.134  -1.295   1.580
  333   1HD1  ILE  37          1HD1      ILE  37  -8.371  -2.737   2.287
  334   2HD1  ILE  37          2HD1      ILE  37  -8.273  -0.956   2.256
  335   3HD1  ILE  37          3HD1      ILE  37  -9.829  -1.759   2.028
  336    H    LEU  38           H        LEU  38  -5.431  -4.335  -1.293
  337    HA   LEU  38           HA       LEU  38  -2.892  -3.297  -1.650
  338   1HB   LEU  38          1HB       LEU  38  -4.092  -6.023  -2.108
  339   2HB   LEU  38          2HB       LEU  38  -2.425  -5.762  -2.571
  340    HG   LEU  38           HG       LEU  38  -3.449  -5.153   0.237
  341   1HD1  LEU  38          1HD1      LEU  38  -3.747  -7.551  -0.264
  342   2HD1  LEU  38          2HD1      LEU  38  -2.055  -7.655  -0.809
  343   3HD1  LEU  38          3HD1      LEU  38  -2.433  -7.296   0.892
  344   1HD2  LEU  38          1HD2      LEU  38  -0.690  -5.415  -1.045
  345   2HD2  LEU  38          2HD2      LEU  38  -1.374  -4.010  -0.199
  346   3HD2  LEU  38          3HD2      LEU  38  -0.939  -5.468   0.700
  347    H    GLU  39           H        GLU  39  -4.936  -4.498  -4.370
  348    HA   GLU  39           HA       GLU  39  -2.900  -3.961  -6.330
  349   1HB   GLU  39          1HB       GLU  39  -4.767  -5.580  -6.613
  350   2HB   GLU  39          2HB       GLU  39  -5.933  -4.252  -6.618
  351   1HG   GLU  39          1HG       GLU  39  -5.037  -3.401  -8.719
  352   2HG   GLU  39          2HG       GLU  39  -3.684  -4.536  -8.654
  353    H    ASP  40           H        ASP  40  -5.545  -1.906  -5.111
  354    HA   ASP  40           HA       ASP  40  -5.118   0.331  -6.905
  355   1HB   ASP  40          1HB       ASP  40  -6.517  -0.322  -4.294
  356   2HB   ASP  40          2HB       ASP  40  -6.219   1.298  -4.599
  357    H    GLU  41           H        GLU  41  -3.736  -0.751  -3.830
  358    HA   GLU  41           HA       GLU  41  -2.760   1.872  -3.083
  359   1HB   GLU  41          1HB       GLU  41  -3.936   0.075  -1.701
  360   2HB   GLU  41          2HB       GLU  41  -2.433  -0.842  -1.706
  361   1HG   GLU  41          1HG       GLU  41  -2.950   0.288   0.373
  362   2HG   GLU  41          2HG       GLU  41  -1.476   0.997  -0.311
  363    H    GLU  42           H        GLU  42  -1.372  -1.183  -4.245
  364    HA   GLU  42           HA       GLU  42   1.381  -0.330  -4.453
  365   1HB   GLU  42          1HB       GLU  42   0.556  -2.670  -4.707
  366   2HB   GLU  42          2HB       GLU  42  -0.290  -2.205  -6.187
  367   1HG   GLU  42          1HG       GLU  42   1.876  -1.645  -7.256
  368   2HG   GLU  42          2HG       GLU  42   2.725  -2.031  -5.756
  369    H    LYS  43           H        LYS  43  -1.517   0.230  -6.463
  370    HA   LYS  43           HA       LYS  43  -0.184   1.308  -8.748
  371   1HB   LYS  43          1HB       LYS  43  -2.822   0.689  -8.104
  372   2HB   LYS  43          2HB       LYS  43  -2.863   2.432  -8.129
  373   1HG   LYS  43          1HG       LYS  43  -3.444   1.872 -10.276
  374   2HG   LYS  43          2HG       LYS  43  -1.731   2.232 -10.477
  375   1HD   LYS  43          1HD       LYS  43  -2.883  -0.581 -10.116
  376   2HD   LYS  43          2HD       LYS  43  -2.650   0.191 -11.685
  377   1HE   LYS  43          1HE       LYS  43  -0.213   0.398 -11.231
  378   2HE   LYS  43          2HE       LYS  43  -0.439  -0.448  -9.689
  379   1HZ   LYS  43          1HZ       LYS  43  -1.220  -2.382 -10.919
  380   2HZ   LYS  43          2HZ       LYS  43  -1.067  -1.608 -12.352
  381   3HZ   LYS  43          3HZ       LYS  43   0.257  -1.963 -11.468
  382    H    HIS  44           H        HIS  44  -1.218   2.989  -5.731
  383    HA   HIS  44           HA       HIS  44  -0.723   5.614  -6.580
  384   1HB   HIS  44          1HB       HIS  44  -0.564   4.215  -3.869
  385   2HB   HIS  44          2HB       HIS  44  -0.633   5.933  -4.166
  386    HD2  HIS  44           2HD      HIS  44  -2.962   5.018  -6.626
  387    HE1  HIS  44           1HE      HIS  44  -5.423   4.773  -3.189
  388    HE2  HIS  44           2HE      HIS  44  -5.380   4.784  -5.734
  389    H    ILE  45           H        ILE  45   1.435   3.629  -4.472
  390    HA   ILE  45           HA       ILE  45   3.866   4.794  -4.834
  391    HB   ILE  45           HB       ILE  45   2.967   1.917  -4.616
  392   1HG1  ILE  45          1HG1      ILE  45   4.463   2.232  -2.471
  393   2HG1  ILE  45          2HG1      ILE  45   4.290   3.952  -2.791
  394   1HG2  ILE  45          1HG2      ILE  45   4.948   1.682  -5.940
  395   2HG2  ILE  45          2HG2      ILE  45   5.845   2.807  -4.886
  396   3HG2  ILE  45          3HG2      ILE  45   5.305   1.215  -4.284
  397   1HD1  ILE  45          1HD1      ILE  45   1.825   3.729  -2.557
  398   2HD1  ILE  45          2HD1      ILE  45   2.033   1.972  -2.311
  399   3HD1  ILE  45          3HD1      ILE  45   2.682   3.116  -1.132
  400    H    GLU  46           H        GLU  46   2.408   2.644  -7.353
  401    HA   GLU  46           HA       GLU  46   4.578   2.785  -9.147
  402   1HB   GLU  46          1HB       GLU  46   2.054   1.623  -9.134
  403   2HB   GLU  46          2HB       GLU  46   1.910   2.774 -10.450
  404   1HG   GLU  46          1HG       GLU  46   4.065   0.639 -10.133
  405   2HG   GLU  46          2HG       GLU  46   2.622   0.486 -11.124
  406    H    TRP  47           H        TRP  47   1.894   5.131  -8.781
  407    HA   TRP  47           HA       TRP  47   2.815   6.819 -10.990
  408   1HB   TRP  47          1HB       TRP  47   0.858   7.423  -8.736
  409   2HB   TRP  47          2HB       TRP  47   0.990   8.233 -10.274
  410    HD1  TRP  47           1HD      TRP  47   0.943   5.283 -11.909
  411    HE1  TRP  47           1HE      TRP  47  -1.326   4.110 -12.163
  412    HE3  TRP  47           3HE      TRP  47  -1.669   7.798  -8.315
  413    HZ2  TRP  47           2HZ      TRP  47  -3.922   4.185 -10.886
  414    HZ3  TRP  47           3HZ      TRP  47  -4.062   7.257  -7.850
  415    HH2  TRP  47           2HH      TRP  47  -5.154   5.388  -9.080
  416    H    LEU  48           H        LEU  48   2.971   6.884  -7.438
  417    HA   LEU  48           HA       LEU  48   4.216   9.367  -6.981
  418   1HB   LEU  48          1HB       LEU  48   4.291   6.657  -5.654
  419   2HB   LEU  48          2HB       LEU  48   5.270   7.945  -5.026
  420    HG   LEU  48           HG       LEU  48   2.291   8.274  -5.405
  421   1HD1  LEU  48          1HD1      LEU  48   2.620   6.396  -3.869
  422   2HD1  LEU  48          2HD1      LEU  48   3.832   7.305  -2.958
  423   3HD1  LEU  48          3HD1      LEU  48   2.122   7.811  -2.944
  424   1HD2  LEU  48          1HD2      LEU  48   4.338   9.671  -3.610
  425   2HD2  LEU  48          2HD2      LEU  48   3.628  10.360  -5.086
  426   3HD2  LEU  48          3HD2      LEU  48   2.601  10.036  -3.680
  427    H    GLU  49           H        GLU  49   5.655   6.287  -8.043
  428    HA   GLU  49           HA       GLU  49   8.388   7.218  -7.938
  429   1HB   GLU  49          1HB       GLU  49   7.329   4.798  -8.342
  430   2HB   GLU  49          2HB       GLU  49   7.445   5.237 -10.037
  431   1HG   GLU  49          1HG       GLU  49   9.888   5.755  -9.701
  432   2HG   GLU  49          2HG       GLU  49   9.745   5.222  -8.027
  433    H    THR  50           H        THR  50   5.970   7.322 -10.530
  434    HA   THR  50           HA       THR  50   7.669   8.706 -12.433
  435    HB   THR  50           HB       THR  50   4.993   7.651 -12.362
  436    HG1  THR  50           1HG      THR  50   6.557   7.123 -13.850
  437   1HG2  THR  50          1HG2      THR  50   4.087   9.926 -12.297
  438   2HG2  THR  50          2HG2      THR  50   5.096  10.381 -13.696
  439   3HG2  THR  50          3HG2      THR  50   3.824   9.156 -13.863
  440    H    ILE  51           H        ILE  51   5.825   9.818  -9.723
  441    HA   ILE  51           HA       ILE  51   6.080  12.649 -10.431
  442    HB   ILE  51           HB       ILE  51   4.915  11.194  -8.043
  443   1HG1  ILE  51          1HG1      ILE  51   3.442  12.854 -10.135
  444   2HG1  ILE  51          2HG1      ILE  51   3.742  11.143 -10.358
  445   1HG2  ILE  51          1HG2      ILE  51   5.627  13.356  -7.178
  446   2HG2  ILE  51          2HG2      ILE  51   4.867  14.196  -8.551
  447   3HG2  ILE  51          3HG2      ILE  51   3.883  13.357  -7.335
  448   1HD1  ILE  51          1HD1      ILE  51   2.534  10.664  -8.202
  449   2HD1  ILE  51          2HD1      ILE  51   2.042  12.375  -8.171
  450   3HD1  ILE  51          3HD1      ILE  51   1.542  11.327  -9.508
  451    H    ASN  52           H        ASN  52   7.926  10.434  -8.672
  452    HA   ASN  52           HA       ASN  52   9.269  12.168  -6.847
  453   1HB   ASN  52          1HB       ASN  52   9.115   9.603  -6.865
  454   2HB   ASN  52          2HB       ASN  52  10.417   9.621  -8.053
  455   1HD2  ASN  52          2HD2      ASN  52  11.211   8.200  -6.114
  456   2HD2  ASN  52          1HD2      ASN  52  12.120   9.076  -4.891
  457    H    GLY  53           H        GLY  53  11.559  12.752  -6.819
  458   1HA   GLY  53          1HA       GLY  53  13.102  13.165  -9.249
  459   2HA   GLY  53          2HA       GLY  53  12.315  14.646  -8.698
  460   1H    MET   1          1H        MET   1  -6.002 -10.287  15.187
  461   2H    MET   1          2H        MET   1  -4.370 -10.218  15.339
  462   3H    MET   1          3H        MET   1  -5.195 -11.529  15.877
  463    HA   MET   1           HA       MET   1  -6.318 -10.195  17.556
  464   1HB   MET   1          1HB       MET   1  -3.306 -10.447  17.546
  465   2HB   MET   1          2HB       MET   1  -4.090  -9.539  18.838
  466   1HG   MET   1          1HG       MET   1  -4.779 -12.412  18.121
  467   2HG   MET   1          2HG       MET   1  -3.719 -11.896  19.432
  468   1HE   MET   1          1HE       MET   1  -6.080 -13.860  20.085
  469   2HE   MET   1          2HE       MET   1  -4.963 -13.165  21.284
  470   3HE   MET   1          3HE       MET   1  -6.716 -13.098  21.560
  471    H    ASP   2           H        ASP   2  -7.406  -8.374  17.336
  472    HA   ASP   2           HA       ASP   2  -7.927  -6.167  17.041
  473   1HB   ASP   2          1HB       ASP   2  -5.656  -6.052  19.050
  474   2HB   ASP   2          2HB       ASP   2  -6.921  -4.836  18.857
  475    H    TYR   3           H        TYR   3  -6.710  -6.516  14.733
  476    HA   TYR   3           HA       TYR   3  -4.440  -4.617  14.532
  477   1HB   TYR   3          1HB       TYR   3  -3.547  -5.977  12.847
  478   2HB   TYR   3          2HB       TYR   3  -4.073  -7.059  14.109
  479    HD1  TYR   3           1HD      TYR   3  -6.481  -8.191  13.756
  480    HD2  TYR   3           2HD      TYR   3  -4.108  -6.428  10.608
  481    HE1  TYR   3           1HE      TYR   3  -7.676  -9.577  12.073
  482    HE2  TYR   3           2HE      TYR   3  -5.296  -7.837   8.940
  483    HH   TYR   3           HH       TYR   3  -6.893  -9.430   8.584
  484    H    LEU   4           H        LEU   4  -7.620  -4.424  13.700
  485    HA   LEU   4           HA       LEU   4  -7.186  -3.481  10.970
  486   1HB   LEU   4          1HB       LEU   4  -9.068  -4.609  10.691
  487   2HB   LEU   4          2HB       LEU   4  -9.257  -4.813  12.410
  488    HG   LEU   4           HG       LEU   4 -10.344  -2.484  12.423
  489   1HD1  LEU   4          1HD1      LEU   4  -9.808  -1.830  10.040
  490   2HD1  LEU   4          2HD1      LEU   4 -10.745  -3.218   9.474
  491   3HD1  LEU   4          3HD1      LEU   4 -11.548  -1.887  10.332
  492   1HD2  LEU   4          1HD2      LEU   4 -11.729  -4.835  11.073
  493   2HD2  LEU   4          2HD2      LEU   4 -11.553  -4.581  12.824
  494   3HD2  LEU   4          3HD2      LEU   4 -12.538  -3.465  11.871
  495    H    ARG   5           H        ARG   5  -8.122  -1.897  14.013
  496    HA   ARG   5           HA       ARG   5  -8.537   0.749  12.920
  497   1HB   ARG   5          1HB       ARG   5  -7.623  -0.312  15.616
  498   2HB   ARG   5          2HB       ARG   5  -7.430   1.392  15.244
  499   1HG   ARG   5          1HG       ARG   5  -9.452   1.157  16.439
  500   2HG   ARG   5          2HG       ARG   5  -9.838   1.630  14.787
  501   1HD   ARG   5          1HD       ARG   5 -10.529  -0.651  14.242
  502   2HD   ARG   5          2HD       ARG   5 -10.005  -1.239  15.823
  503    HE   ARG   5           HE       ARG   5 -12.461   0.227  15.172
  504   1HH1  ARG   5          1HH2      ARG   5 -10.393  -0.709  17.853
  505   2HH1  ARG   5          2HH2      ARG   5 -11.639  -0.402  19.030
  506   1HH2  ARG   5          1HH1      ARG   5 -13.983   0.623  16.741
  507   2HH2  ARG   5          2HH1      ARG   5 -13.608   0.327  18.413
  508    H    GLU   6           H        GLU   6  -5.601  -1.031  13.692
  509    HA   GLU   6           HA       GLU   6  -3.707   1.029  13.289
  510   1HB   GLU   6          1HB       GLU   6  -3.475  -1.407  14.263
  511   2HB   GLU   6          2HB       GLU   6  -3.230  -1.885  12.589
  512   1HG   GLU   6          1HG       GLU   6  -1.068  -1.599  13.434
  513   2HG   GLU   6          2HG       GLU   6  -1.351  -0.134  12.501
  514    H    LEU   7           H        LEU   7  -5.221  -1.152  10.928
  515    HA   LEU   7           HA       LEU   7  -3.684  -0.245   8.627
  516   1HB   LEU   7          1HB       LEU   7  -6.441  -1.563   8.708
  517   2HB   LEU   7          2HB       LEU   7  -5.396  -1.406   7.305
  518    HG   LEU   7           HG       LEU   7  -4.870  -3.092   9.771
  519   1HD1  LEU   7          1HD1      LEU   7  -6.612  -3.969   8.257
  520   2HD1  LEU   7          2HD1      LEU   7  -5.460  -3.897   6.904
  521   3HD1  LEU   7          3HD1      LEU   7  -5.166  -4.990   8.277
  522   1HD2  LEU   7          1HD2      LEU   7  -3.197  -2.816   7.251
  523   2HD2  LEU   7          2HD2      LEU   7  -2.743  -2.290   8.895
  524   3HD2  LEU   7          3HD2      LEU   7  -2.945  -4.008   8.553
  525    H    TYR   8           H        TYR   8  -7.036   0.356   9.654
  526    HA   TYR   8           HA       TYR   8  -7.868   2.202   7.689
  527   1HB   TYR   8          1HB       TYR   8  -8.934   0.871   9.818
  528   2HB   TYR   8          2HB       TYR   8  -8.728   2.379  10.617
  529    HD1  TYR   8           1HD      TYR   8  -9.592   4.064   7.943
  530    HD2  TYR   8           2HD      TYR   8 -11.260   0.843  10.290
  531    HE1  TYR   8           1HE      TYR   8 -11.890   4.818   7.377
  532    HE2  TYR   8           2HE      TYR   8 -13.549   1.606   9.704
  533    HH   TYR   8           HH       TYR   8 -14.806   3.213   8.644
  534    H    LYS   9           H        LYS   9  -6.430   2.926  10.896
  535    HA   LYS   9           HA       LYS   9  -6.645   5.746  10.511
  536   1HB   LYS   9          1HB       LYS   9  -6.387   4.585  12.726
  537   2HB   LYS   9          2HB       LYS   9  -4.677   4.304  12.360
  538   1HG   LYS   9          1HG       LYS   9  -4.220   6.688  12.341
  539   2HG   LYS   9          2HG       LYS   9  -5.950   7.081  12.355
  540   1HD   LYS   9          1HD       LYS   9  -6.176   6.111  14.611
  541   2HD   LYS   9          2HD       LYS   9  -4.443   5.710  14.625
  542   1HE   LYS   9          1HE       LYS   9  -3.852   8.085  14.431
  543   2HE   LYS   9          2HE       LYS   9  -5.553   8.531  14.248
  544   1HZ   LYS   9          1HZ       LYS   9  -5.951   7.746  16.513
  545   2HZ   LYS   9          2HZ       LYS   9  -4.386   7.307  16.693
  546   3HZ   LYS   9          3HZ       LYS   9  -4.781   8.881  16.525
  547    H    LEU  10           H        LEU  10  -3.764   3.718   9.900
  548    HA   LEU  10           HA       LEU  10  -2.260   5.850   8.833
  549   1HB   LEU  10          1HB       LEU  10  -2.120   2.854   8.613
  550   2HB   LEU  10          2HB       LEU  10  -1.087   3.835   7.575
  551    HG   LEU  10           HG       LEU  10  -1.159   4.285  10.586
  552   1HD1  LEU  10          1HD1      LEU  10  -0.536   1.970  10.225
  553   2HD1  LEU  10          2HD1      LEU  10   0.677   2.443   9.006
  554   3HD1  LEU  10          3HD1      LEU  10   0.883   2.903  10.715
  555   1HD2  LEU  10          1HD2      LEU  10   0.936   4.884   8.440
  556   2HD2  LEU  10          2HD2      LEU  10  -0.124   6.084   9.208
  557   3HD2  LEU  10          3HD2      LEU  10   1.086   5.241  10.175
  558    H    GLU  11           H        GLU  11  -4.546   3.617   7.290
  559    HA   GLU  11           HA       GLU  11  -4.485   4.560   4.632
  560   1HB   GLU  11          1HB       GLU  11  -6.276   3.063   6.434
  561   2HB   GLU  11          2HB       GLU  11  -7.200   3.854   5.257
  562   1HG   GLU  11          1HG       GLU  11  -4.767   2.070   4.713
  563   2HG   GLU  11          2HG       GLU  11  -6.432   1.508   4.736
  564    H    GLN  12           H        GLN  12  -6.366   5.998   7.420
  565    HA   GLN  12           HA       GLN  12  -7.273   8.135   5.682
  566   1HB   GLN  12          1HB       GLN  12  -7.552   7.482   8.624
  567   2HB   GLN  12          2HB       GLN  12  -8.170   8.990   7.916
  568   1HG   GLN  12          1HG       GLN  12  -9.438   7.738   6.254
  569   2HG   GLN  12          2HG       GLN  12  -8.904   6.210   6.933
  570   1HE2  GLN  12          2HE2      GLN  12 -11.644   7.932   6.805
  571   2HE2  GLN  12          1HE2      GLN  12 -12.252   7.672   8.432
  572    H    GLN  13           H        GLN  13  -4.573   7.786   7.852
  573    HA   GLN  13           HA       GLN  13  -3.950  10.617   8.001
  574   1HB   GLN  13          1HB       GLN  13  -2.295   8.090   8.381
  575   2HB   GLN  13          2HB       GLN  13  -1.567   9.696   8.470
  576   1HG   GLN  13          1HG       GLN  13  -3.003  10.364  10.297
  577   2HG   GLN  13          2HG       GLN  13  -3.935   8.878  10.208
  578   1HE2  GLN  13          2HE2      GLN  13  -1.467  10.352  11.951
  579   2HE2  GLN  13          1HE2      GLN  13  -0.705   8.887  12.555
  580    H    ALA  14           H        ALA  14  -3.515   8.249   5.419
  581    HA   ALA  14           HA       ALA  14  -1.765  10.027   3.844
  582   1HB   ALA  14          1HB       ALA  14  -1.712   7.566   3.528
  583   2HB   ALA  14          2HB       ALA  14  -3.431   7.570   3.077
  584   3HB   ALA  14          3HB       ALA  14  -2.237   8.393   2.050
  585    H    MET  15           H        MET  15  -5.279   9.080   3.732
  586    HA   MET  15           HA       MET  15  -6.220  10.948   1.823
  587   1HB   MET  15          1HB       MET  15  -7.588   9.213   2.821
  588   2HB   MET  15          2HB       MET  15  -7.447   9.910   4.422
  589   1HG   MET  15          1HG       MET  15  -9.093  11.383   4.137
  590   2HG   MET  15          2HG       MET  15  -8.581  11.832   2.509
  591   1HE   MET  15          1HE       MET  15  -9.584  11.042   0.352
  592   2HE   MET  15          2HE       MET  15  -8.431   9.771   0.779
  593   3HE   MET  15          3HE       MET  15 -10.039   9.336   0.160
  594    H    LYS  16           H        LYS  16  -5.707  11.603   5.392
  595    HA   LYS  16           HA       LYS  16  -6.514  14.369   5.136
  596   1HB   LYS  16          1HB       LYS  16  -5.046  12.785   7.280
  597   2HB   LYS  16          2HB       LYS  16  -5.281  14.537   7.404
  598   1HG   LYS  16          1HG       LYS  16  -7.732  14.245   7.122
  599   2HG   LYS  16          2HG       LYS  16  -7.517  12.482   7.112
  600   1HD   LYS  16          1HD       LYS  16  -6.596  12.544   9.376
  601   2HD   LYS  16          2HD       LYS  16  -6.641  14.328   9.378
  602   1HE   LYS  16          1HE       LYS  16  -9.090  14.282   9.087
  603   2HE   LYS  16          2HE       LYS  16  -9.072  12.514   9.079
  604   1HZ   LYS  16          1HZ       LYS  16  -8.227  12.582  11.374
  605   2HZ   LYS  16          2HZ       LYS  16  -8.230  14.216  11.375
  606   3HZ   LYS  16          3HZ       LYS  16  -9.637  13.398  11.286
  607    H    LEU  17           H        LEU  17  -3.348  12.751   4.882
  608    HA   LEU  17           HA       LEU  17  -1.849  15.211   4.626
  609   1HB   LEU  17          1HB       LEU  17  -1.361  12.332   4.291
  610   2HB   LEU  17          2HB       LEU  17  -0.643  13.194   2.989
  611    HG   LEU  17           HG       LEU  17  -0.192  13.729   5.956
  612   1HD1  LEU  17          1HD1      LEU  17   0.812  11.634   5.037
  613   2HD1  LEU  17          2HD1      LEU  17   1.699  12.608   3.845
  614   3HD1  LEU  17          3HD1      LEU  17   2.025  12.816   5.574
  615   1HD2  LEU  17          1HD2      LEU  17   1.120  15.028   3.522
  616   2HD2  LEU  17          2HD2      LEU  17   0.162  15.854   4.765
  617   3HD2  LEU  17          3HD2      LEU  17   1.726  15.165   5.185
  618    H    TYR  18           H        TYR  18  -3.615  13.161   2.317
  619    HA   TYR  18           HA       TYR  18  -2.959  14.597  -0.030
  620   1HB   TYR  18          1HB       TYR  18  -4.946  12.527   0.831
  621   2HB   TYR  18          2HB       TYR  18  -5.293  13.356  -0.630
  622    HD1  TYR  18           1HD      TYR  18  -3.113  13.642  -2.250
  623    HD2  TYR  18           2HD      TYR  18  -3.802  10.469   0.562
  624    HE1  TYR  18           1HE      TYR  18  -1.329  12.283  -3.348
  625    HE2  TYR  18           2HE      TYR  18  -1.995   9.131  -0.486
  626    HH   TYR  18           HH       TYR  18  -0.342   9.084  -2.068
  627    H    ARG  19           H        ARG  19  -5.593  15.215   2.332
  628    HA   ARG  19           HA       ARG  19  -6.835  17.393   0.899
  629   1HB   ARG  19          1HB       ARG  19  -6.550  16.758   3.864
  630   2HB   ARG  19          2HB       ARG  19  -7.306  18.243   3.302
  631   1HG   ARG  19          1HG       ARG  19  -8.982  16.974   2.037
  632   2HG   ARG  19          2HG       ARG  19  -8.276  15.444   2.601
  633   1HD   ARG  19          1HD       ARG  19  -8.813  15.930   4.893
  634   2HD   ARG  19          2HD       ARG  19  -9.177  17.614   4.547
  635    HE   ARG  19           HE       ARG  19 -10.929  15.288   4.114
  636   1HH1  ARG  19          1HH2      ARG  19 -10.529  18.710   3.426
  637   2HH1  ARG  19          2HH2      ARG  19 -12.229  18.935   3.125
  638   1HH2  ARG  19          1HH1      ARG  19 -13.085  15.664   3.722
  639   2HH2  ARG  19          2HH1      ARG  19 -13.626  17.258   3.286
  640    H    GLU  20           H        GLU  20  -4.136  17.493   3.251
  641    HA   GLU  20           HA       GLU  20  -3.836  20.383   3.035
  642   1HB   GLU  20          1HB       GLU  20  -3.145  18.479   4.844
  643   2HB   GLU  20          2HB       GLU  20  -1.606  18.608   4.037
  644   1HG   GLU  20          1HG       GLU  20  -3.126  21.004   5.173
  645   2HG   GLU  20          2HG       GLU  20  -2.007  20.043   6.128
  646    H    ALA  21           H        ALA  21  -2.051  17.642   1.694
  647    HA   ALA  21           HA       ALA  21  -0.192  19.073   0.083
  648   1HB   ALA  21          1HB       ALA  21  -0.091  16.642   0.463
  649   2HB   ALA  21          2HB       ALA  21  -1.576  16.422  -0.495
  650   3HB   ALA  21          3HB       ALA  21  -0.096  17.026  -1.268
  651    H    SER  22           H        SER  22  -3.656  18.239  -0.614
  652    HA   SER  22           HA       SER  22  -3.717  19.320  -3.238
  653   1HB   SER  22          1HB       SER  22  -5.495  17.908  -2.172
  654   2HB   SER  22          2HB       SER  22  -6.017  19.338  -1.260
  655    HG   SER  22           HG       SER  22  -7.202  19.063  -3.198
  656    H    GLU  23           H        GLU  23  -4.010  21.050  -0.078
  657    HA   GLU  23           HA       GLU  23  -4.813  23.576  -1.189
  658   1HB   GLU  23          1HB       GLU  23  -4.718  22.767   1.274
  659   2HB   GLU  23          2HB       GLU  23  -3.039  23.296   1.238
  660   1HG   GLU  23          1HG       GLU  23  -3.755  25.569   0.530
  661   2HG   GLU  23          2HG       GLU  23  -5.439  25.047   0.542
  662    H    LYS  24           H        LYS  24  -1.626  22.189  -0.570
  663    HA   LYS  24           HA       LYS  24  -0.086  24.453  -1.608
  664   1HB   LYS  24          1HB       LYS  24   0.712  21.555  -1.096
  665   2HB   LYS  24          2HB       LYS  24   1.819  22.892  -1.457
  666   1HG   LYS  24          1HG       LYS  24   1.076  24.080   0.587
  667   2HG   LYS  24          2HG       LYS  24  -0.023  22.742   0.976
  668   1HD   LYS  24          1HD       LYS  24   1.915  21.187   1.032
  669   2HD   LYS  24          2HD       LYS  24   3.013  22.557   0.783
  670   1HE   LYS  24          1HE       LYS  24   1.056  22.247   3.105
  671   2HE   LYS  24          2HE       LYS  24   2.755  21.789   3.183
  672   1HZ   LYS  24          1HZ       LYS  24   3.334  24.129   2.772
  673   2HZ   LYS  24          2HZ       LYS  24   1.749  24.546   2.726
  674   3HZ   LYS  24          3HZ       LYS  24   2.405  23.988   4.106
  675    H    ALA  25           H        ALA  25  -1.017  21.302  -2.972
  676    HA   ALA  25           HA       ALA  25   0.203  21.690  -5.552
  677   1HB   ALA  25          1HB       ALA  25  -0.131  19.470  -4.414
  678   2HB   ALA  25          2HB       ALA  25  -1.885  19.654  -4.654
  679   3HB   ALA  25          3HB       ALA  25  -0.806  19.530  -6.044
  680    H    ARG  26           H        ARG  26  -1.865  23.789  -4.833
  681    HA   ARG  26           HA       ARG  26  -4.342  23.404  -6.049
  682   1HB   ARG  26          1HB       ARG  26  -4.602  25.754  -5.713
  683   2HB   ARG  26          2HB       ARG  26  -3.576  25.147  -4.428
  684   1HG   ARG  26          1HG       ARG  26  -1.583  25.864  -6.090
  685   2HG   ARG  26          2HG       ARG  26  -2.850  26.865  -6.811
  686   1HD   ARG  26          1HD       ARG  26  -3.258  27.555  -4.279
  687   2HD   ARG  26          2HD       ARG  26  -1.612  26.997  -4.049
  688    HE   ARG  26           HE       ARG  26  -2.494  29.426  -5.399
  689   1HH1  ARG  26          1HH2      ARG  26   0.224  27.204  -5.306
  690   2HH1  ARG  26          2HH2      ARG  26   1.289  28.350  -6.073
  691   1HH2  ARG  26          1HH1      ARG  26  -1.079  30.823  -6.363
  692   2HH2  ARG  26          2HH1      ARG  26   0.569  30.344  -6.642
  693    H    ASN  27           H        ASN  27  -1.396  23.819  -7.755
  694    HA   ASN  27           HA       ASN  27  -2.286  24.870 -10.257
  695   1HB   ASN  27          1HB       ASN  27   0.079  24.675  -9.554
  696   2HB   ASN  27          2HB       ASN  27  -0.048  22.916  -9.543
  697   1HD2  ASN  27          2HD2      ASN  27   0.806  25.606 -11.464
  698   2HD2  ASN  27          1HD2      ASN  27   0.838  24.748 -12.997
  699    HA   PRO  28           HA       PRO  28  -5.053  21.685 -11.348
  700   1HB   PRO  28          1HB       PRO  28  -5.339  21.948 -14.072
  701   2HB   PRO  28          2HB       PRO  28  -5.976  23.106 -12.869
  702   1HG   PRO  28          1HG       PRO  28  -3.373  23.271 -14.414
  703   2HG   PRO  28          2HG       PRO  28  -4.613  24.550 -14.191
  704   1HD   PRO  28          1HD       PRO  28  -2.388  24.449 -12.652
  705   2HD   PRO  28          2HD       PRO  28  -3.969  24.901 -11.938
  706    H    GLU  29           H        GLU  29  -1.877  21.490 -12.831
  707    HA   GLU  29           HA       GLU  29  -2.058  18.944 -14.102
  708   1HB   GLU  29          1HB       GLU  29  -0.213  20.614 -14.339
  709   2HB   GLU  29          2HB       GLU  29   0.307  20.249 -12.699
  710   1HG   GLU  29          1HG       GLU  29   0.738  17.888 -13.365
  711   2HG   GLU  29          2HG       GLU  29   0.213  18.267 -15.007
  712    H    LYS  30           H        LYS  30  -0.727  19.713 -10.936
  713    HA   LYS  30           HA       LYS  30  -0.782  16.943 -10.002
  714   1HB   LYS  30          1HB       LYS  30  -0.086  19.571  -8.658
  715   2HB   LYS  30          2HB       LYS  30  -0.434  18.133  -7.702
  716   1HG   LYS  30          1HG       LYS  30   1.892  18.160  -7.918
  717   2HG   LYS  30          2HG       LYS  30   1.276  16.835  -8.891
  718   1HD   LYS  30          1HD       LYS  30   3.083  17.864 -10.058
  719   2HD   LYS  30          2HD       LYS  30   1.610  18.241 -10.955
  720   1HE   LYS  30          1HE       LYS  30   1.567  20.507 -10.023
  721   2HE   LYS  30          2HE       LYS  30   2.878  20.115  -8.903
  722   1HZ   LYS  30          1HZ       LYS  30   4.373  19.870 -10.769
  723   2HZ   LYS  30          2HZ       LYS  30   3.188  20.090 -11.864
  724   3HZ   LYS  30          3HZ       LYS  30   3.658  21.329 -10.896
  725    H    LYS  31           H        LYS  31  -2.949  19.741  -9.482
  726    HA   LYS  31           HA       LYS  31  -4.623  18.502  -7.571
  727   1HB   LYS  31          1HB       LYS  31  -4.520  20.923  -8.138
  728   2HB   LYS  31          2HB       LYS  31  -5.384  20.597  -9.627
  729   1HG   LYS  31          1HG       LYS  31  -6.690  19.643  -7.099
  730   2HG   LYS  31          2HG       LYS  31  -6.529  21.390  -7.285
  731   1HD   LYS  31          1HD       LYS  31  -7.704  21.382  -9.401
  732   2HD   LYS  31          2HD       LYS  31  -7.792  19.611  -9.413
  733   1HE   LYS  31          1HE       LYS  31  -9.143  19.648  -7.338
  734   2HE   LYS  31          2HE       LYS  31  -9.048  21.413  -7.293
  735   1HZ   LYS  31          1HZ       LYS  31 -10.257  21.474  -9.404
  736   2HZ   LYS  31          2HZ       LYS  31 -10.326  19.843  -9.471
  737   3HZ   LYS  31          3HZ       LYS  31 -11.129  20.651  -8.300
  738    H    SER  32           H        SER  32  -4.454  17.790 -10.937
  739    HA   SER  32           HA       SER  32  -6.907  16.093 -10.717
  740   1HB   SER  32          1HB       SER  32  -5.379  16.814 -13.250
  741   2HB   SER  32          2HB       SER  32  -6.985  16.074 -13.126
  742    HG   SER  32           HG       SER  32  -6.163  18.721 -12.599
  743    H    VAL  33           H        VAL  33  -3.843  15.631  -9.992
  744    HA   VAL  33           HA       VAL  33  -3.769  12.798 -10.996
  745    HB   VAL  33           HB       VAL  33  -1.531  14.728 -10.327
  746   1HG1  VAL  33          1HG1      VAL  33  -0.861  12.617  -9.297
  747   2HG1  VAL  33          2HG1      VAL  33  -1.319  11.719 -10.765
  748   3HG1  VAL  33          3HG1      VAL  33   0.044  12.860 -10.791
  749   1HG2  VAL  33          1HG2      VAL  33  -2.098  13.011 -12.789
  750   2HG2  VAL  33          2HG2      VAL  33  -2.481  14.735 -12.656
  751   3HG2  VAL  33          3HG2      VAL  33  -0.795  14.207 -12.602
  752    H    LEU  34           H        LEU  34  -3.192  14.900  -8.031
  753    HA   LEU  34           HA       LEU  34  -3.131  12.510  -6.376
  754   1HB   LEU  34          1HB       LEU  34  -2.479  13.801  -4.739
  755   2HB   LEU  34          2HB       LEU  34  -1.997  14.872  -6.038
  756    HG   LEU  34           HG       LEU  34  -4.575  15.002  -4.508
  757   1HD1  LEU  34          1HD1      LEU  34  -3.638  16.853  -3.221
  758   2HD1  LEU  34          2HD1      LEU  34  -2.500  15.511  -3.102
  759   3HD1  LEU  34          3HD1      LEU  34  -2.155  16.847  -4.201
  760   1HD2  LEU  34          1HD2      LEU  34  -3.335  17.156  -6.235
  761   2HD2  LEU  34          2HD2      LEU  34  -4.741  16.166  -6.691
  762   3HD2  LEU  34          3HD2      LEU  34  -4.855  17.286  -5.330
  763    H    GLN  35           H        GLN  35  -5.694  14.370  -7.813
  764    HA   GLN  35           HA       GLN  35  -7.746  13.773  -5.928
  765   1HB   GLN  35          1HB       GLN  35  -7.795  15.497  -7.717
  766   2HB   GLN  35          2HB       GLN  35  -8.016  14.215  -8.921
  767   1HG   GLN  35          1HG       GLN  35 -10.163  13.590  -7.756
  768   2HG   GLN  35          2HG       GLN  35  -9.855  14.857  -6.566
  769   1HE2  GLN  35          2HE2      GLN  35 -11.510  16.354  -6.996
  770   2HE2  GLN  35          1HE2      GLN  35 -11.810  17.011  -8.597
  771    H    LYS  36           H        LYS  36  -6.375  11.838  -8.604
  772    HA   LYS  36           HA       LYS  36  -8.501   9.853  -8.539
  773   1HB   LYS  36          1HB       LYS  36  -6.749  10.490 -10.427
  774   2HB   LYS  36          2HB       LYS  36  -5.745   9.259  -9.669
  775   1HG   LYS  36          1HG       LYS  36  -8.641   8.784 -10.535
  776   2HG   LYS  36          2HG       LYS  36  -7.289   8.609 -11.649
  777   1HD   LYS  36          1HD       LYS  36  -6.343   6.798 -10.428
  778   2HD   LYS  36          2HD       LYS  36  -7.450   7.023  -9.062
  779   1HE   LYS  36          1HE       LYS  36  -9.369   6.545 -10.627
  780   2HE   LYS  36          2HE       LYS  36  -8.180   6.098 -11.861
  781   1HZ   LYS  36          1HZ       LYS  36  -7.363   4.380 -10.308
  782   2HZ   LYS  36          2HZ       LYS  36  -8.463   4.819  -9.179
  783   3HZ   LYS  36          3HZ       LYS  36  -8.960   4.161 -10.594
  784    H    ILE  37           H        ILE  37  -5.247  10.014  -7.069
  785    HA   ILE  37           HA       ILE  37  -5.453   7.545  -5.549
  786    HB   ILE  37           HB       ILE  37  -4.019  10.160  -4.969
  787   1HG1  ILE  37          1HG1      ILE  37  -2.800   7.637  -6.047
  788   2HG1  ILE  37          2HG1      ILE  37  -3.199   9.096  -6.983
  789   1HG2  ILE  37          1HG2      ILE  37  -4.262   9.063  -2.839
  790   2HG2  ILE  37          2HG2      ILE  37  -3.957   7.469  -3.555
  791   3HG2  ILE  37          3HG2      ILE  37  -2.644   8.621  -3.365
  792   1HD1  ILE  37          1HD1      ILE  37  -1.621  10.385  -5.472
  793   2HD1  ILE  37          2HD1      ILE  37  -1.048   8.799  -4.884
  794   3HD1  ILE  37          3HD1      ILE  37  -0.886   9.219  -6.587
  795    H    LEU  38           H        LEU  38  -6.445  10.959  -4.691
  796    HA   LEU  38           HA       LEU  38  -7.570  10.367  -2.185
  797   1HB   LEU  38          1HB       LEU  38  -8.091  12.410  -4.318
  798   2HB   LEU  38          2HB       LEU  38  -9.312  12.257  -3.079
  799    HG   LEU  38           HG       LEU  38  -6.381  12.702  -2.433
  800   1HD1  LEU  38          1HD1      LEU  38  -7.190  14.597  -3.767
  801   2HD1  LEU  38          2HD1      LEU  38  -8.612  14.760  -2.708
  802   3HD1  LEU  38          3HD1      LEU  38  -6.977  15.075  -2.080
  803   1HD2  LEU  38          1HD2      LEU  38  -7.472  13.609  -0.277
  804   2HD2  LEU  38          2HD2      LEU  38  -8.997  12.947  -0.865
  805   3HD2  LEU  38          3HD2      LEU  38  -7.620  11.866  -0.522
  806    H    GLU  39           H        GLU  39  -9.250  10.078  -5.373
  807    HA   GLU  39           HA       GLU  39 -11.669   9.126  -4.155
  808   1HB   GLU  39          1HB       GLU  39 -11.493  10.215  -6.401
  809   2HB   GLU  39          2HB       GLU  39 -10.672   8.777  -7.023
  810   1HG   GLU  39          1HG       GLU  39 -12.677   7.418  -6.619
  811   2HG   GLU  39          2HG       GLU  39 -13.473   8.774  -5.814
  812    H    ASP  40           H        ASP  40  -8.846   7.333  -5.432
  813    HA   ASP  40           HA       ASP  40  -9.849   4.685  -5.051
  814   1HB   ASP  40          1HB       ASP  40  -7.157   6.102  -5.146
  815   2HB   ASP  40          2HB       ASP  40  -7.229   4.476  -4.686
  816    H    GLU  41           H        GLU  41  -8.326   7.043  -2.790
  817    HA   GLU  41           HA       GLU  41  -8.175   5.030  -0.650
  818   1HB   GLU  41          1HB       GLU  41  -7.958   8.054  -0.496
  819   2HB   GLU  41          2HB       GLU  41  -7.691   6.959   0.853
  820   1HG   GLU  41          1HG       GLU  41  -5.943   7.350  -1.587
  821   2HG   GLU  41          2HG       GLU  41  -5.594   7.764   0.070
  822    H    GLU  42           H        GLU  42 -10.455   7.632  -1.522
  823    HA   GLU  42           HA       GLU  42 -12.217   7.262   0.694
  824   1HB   GLU  42          1HB       GLU  42 -12.229   9.151  -0.976
  825   2HB   GLU  42          2HB       GLU  42 -12.997   8.058  -2.137
  826   1HG   GLU  42          1HG       GLU  42 -14.911   7.763  -0.600
  827   2HG   GLU  42          2HG       GLU  42 -14.102   8.743   0.625
  828    H    LYS  43           H        LYS  43 -11.941   5.501  -2.389
  829    HA   LYS  43           HA       LYS  43 -14.129   3.694  -2.019
  830   1HB   LYS  43          1HB       LYS  43 -12.154   4.091  -3.972
  831   2HB   LYS  43          2HB       LYS  43 -11.713   2.538  -3.310
  832   1HG   LYS  43          1HG       LYS  43 -13.149   2.064  -5.097
  833   2HG   LYS  43          2HG       LYS  43 -14.193   1.873  -3.679
  834   1HD   LYS  43          1HD       LYS  43 -15.080   4.180  -4.042
  835   2HD   LYS  43          2HD       LYS  43 -14.040   4.366  -5.454
  836   1HE   LYS  43          1HE       LYS  43 -16.219   2.246  -5.148
  837   2HE   LYS  43          2HE       LYS  43 -16.435   3.797  -5.962
  838   1HZ   LYS  43          1HZ       LYS  43 -14.702   3.142  -7.550
  839   2HZ   LYS  43          2HZ       LYS  43 -14.532   1.684  -6.826
  840   3HZ   LYS  43          3HZ       LYS  43 -15.931   2.073  -7.565
  841    H    HIS  44           H        HIS  44 -10.638   3.297  -0.903
  842    HA   HIS  44           HA       HIS  44 -11.043   0.821   0.335
  843   1HB   HIS  44          1HB       HIS  44  -9.144   3.096   1.098
  844   2HB   HIS  44          2HB       HIS  44  -9.027   1.404   1.444
  845    HD2  HIS  44           2HD      HIS  44  -9.970   0.935  -1.865
  846    HE1  HIS  44           1HE      HIS  44  -5.870   1.845  -2.395
  847    HE2  HIS  44           2HE      HIS  44  -7.983   0.999  -3.524
  848    H    ILE  45           H        ILE  45 -11.417   4.142   1.569
  849    HA   ILE  45           HA       ILE  45 -11.958   3.395   4.301
  850    HB   ILE  45           HB       ILE  45 -12.098   5.887   2.628
  851   1HG1  ILE  45          1HG1      ILE  45 -10.883   6.814   4.626
  852   2HG1  ILE  45          2HG1      ILE  45 -10.974   5.229   5.386
  853   1HG2  ILE  45          1HG2      ILE  45 -14.266   6.062   3.713
  854   2HG2  ILE  45          2HG2      ILE  45 -13.535   5.699   5.299
  855   3HG2  ILE  45          3HG2      ILE  45 -13.137   7.201   4.431
  856   1HD1  ILE  45          1HD1      ILE  45  -9.543   4.319   3.520
  857   2HD1  ILE  45          2HD1      ILE  45  -9.416   5.989   2.895
  858   3HD1  ILE  45          3HD1      ILE  45  -8.770   5.586   4.483
  859    H    GLU  46           H        GLU  46 -14.207   3.876   1.507
  860    HA   GLU  46           HA       GLU  46 -16.618   3.402   2.945
  861   1HB   GLU  46          1HB       GLU  46 -15.690   2.924   0.105
  862   2HB   GLU  46          2HB       GLU  46 -17.219   2.259   0.627
  863   1HG   GLU  46          1HG       GLU  46 -16.516   5.200   0.859
  864   2HG   GLU  46          2HG       GLU  46 -17.316   4.478  -0.538
  865    H    TRP  47           H        TRP  47 -14.363   1.023   1.456
  866    HA   TRP  47           HA       TRP  47 -15.939  -1.244   2.222
  867   1HB   TRP  47          1HB       TRP  47 -12.954  -1.141   1.665
  868   2HB   TRP  47          2HB       TRP  47 -14.024  -2.510   1.503
  869    HD1  TRP  47           1HD      TRP  47 -16.192  -0.593  -0.291
  870    HE1  TRP  47           1HE      TRP  47 -15.563  -0.100  -2.738
  871    HE3  TRP  47           3HE      TRP  47 -11.257  -1.822  -0.119
  872    HZ2  TRP  47           2HZ      TRP  47 -13.251  -0.446  -4.461
  873    HZ3  TRP  47           3HZ      TRP  47  -9.840  -1.747  -2.152
  874    HH2  TRP  47           2HH      TRP  47 -10.828  -1.053  -4.339
  875    H    LEU  48           H        LEU  48 -13.110   0.340   3.699
  876    HA   LEU  48           HA       LEU  48 -12.690  -1.355   5.927
  877   1HB   LEU  48          1HB       LEU  48 -12.261   1.566   5.287
  878   2HB   LEU  48          2HB       LEU  48 -11.898   1.025   6.886
  879    HG   LEU  48           HG       LEU  48 -10.720  -0.309   4.429
  880   1HD1  LEU  48          1HD1      LEU  48 -10.031   2.050   4.450
  881   2HD1  LEU  48          2HD1      LEU  48  -9.526   1.907   6.144
  882   3HD1  LEU  48          3HD1      LEU  48  -8.675   1.000   4.868
  883   1HD2  LEU  48          1HD2      LEU  48  -9.852  -0.291   7.357
  884   2HD2  LEU  48          2HD2      LEU  48 -10.591  -1.661   6.503
  885   3HD2  LEU  48          3HD2      LEU  48  -8.989  -1.090   6.025
  886    H    GLU  49           H        GLU  49 -14.930   1.411   5.602
  887    HA   GLU  49           HA       GLU  49 -16.100   1.095   8.214
  888   1HB   GLU  49          1HB       GLU  49 -16.340   3.018   6.382
  889   2HB   GLU  49          2HB       GLU  49 -17.724   2.084   5.850
  890   1HG   GLU  49          1HG       GLU  49 -18.636   2.140   8.189
  891   2HG   GLU  49          2HG       GLU  49 -17.266   3.133   8.681
  892    H    THR  50           H        THR  50 -17.175  -0.223   5.018
  893    HA   THR  50           HA       THR  50 -19.373  -1.710   5.974
  894    HB   THR  50           HB       THR  50 -17.457  -2.116   3.654
  895    HG1  THR  50           1HG      THR  50 -20.104  -1.095   3.802
  896   1HG2  THR  50          1HG2      THR  50 -18.511  -4.240   3.927
  897   2HG2  THR  50          2HG2      THR  50 -20.110  -3.476   4.155
  898   3HG2  THR  50          3HG2      THR  50 -19.277  -3.393   2.574
  899    H    ILE  51           H        ILE  51 -15.986  -2.455   6.198
  900    HA   ILE  51           HA       ILE  51 -16.503  -5.198   7.163
  901    HB   ILE  51           HB       ILE  51 -14.005  -3.699   6.337
  902   1HG1  ILE  51          1HG1      ILE  51 -15.503  -4.474   4.499
  903   2HG1  ILE  51          2HG1      ILE  51 -13.903  -5.180   4.459
  904   1HG2  ILE  51          1HG2      ILE  51 -13.174  -5.145   8.047
  905   2HG2  ILE  51          2HG2      ILE  51 -14.106  -6.527   7.433
  906   3HG2  ILE  51          3HG2      ILE  51 -12.751  -5.859   6.491
  907   1HD1  ILE  51          1HD1      ILE  51 -14.801  -7.319   5.318
  908   2HD1  ILE  51          2HD1      ILE  51 -16.421  -6.591   5.461
  909   3HD1  ILE  51          3HD1      ILE  51 -15.674  -6.793   3.872
  910    H    ASN  52           H        ASN  52 -15.930  -2.203   8.576
  911    HA   ASN  52           HA       ASN  52 -14.818  -3.111  11.101
  912   1HB   ASN  52          1HB       ASN  52 -14.659  -0.768  10.329
  913   2HB   ASN  52          2HB       ASN  52 -16.417  -0.611  10.408
  914   1HD2  ASN  52          2HD2      ASN  52 -16.987   0.568  12.208
  915   2HD2  ASN  52          1HD2      ASN  52 -16.195   0.421  13.768
  916    H    GLY  53           H        GLY  53 -15.829  -3.565  13.059
  917   1HA   GLY  53          1HA       GLY  53 -18.615  -3.441  13.656
  918   2HA   GLY  53          2HA       GLY  53 -18.247  -5.056  13.051
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1  12.658  16.676  -1.748
    2   2H    MET   1          2H        MET   1  11.961  15.204  -1.604
    3   3H    MET   1          3H        MET   1  12.577  15.684  -3.046
    4    HA   MET   1           HA       MET   1  10.932  17.450  -3.220
    5   1HB   MET   1          1HB       MET   1   9.864  14.621  -2.855
    6   2HB   MET   1          2HB       MET   1   8.847  15.972  -3.354
    7   1HG   MET   1          1HG       MET   1  11.303  14.994  -4.850
    8   2HG   MET   1          2HG       MET   1   9.621  14.689  -5.270
    9   1HE   MET   1          1HE       MET   1  11.674  15.780  -7.370
   10   2HE   MET   1          2HE       MET   1   9.952  15.501  -7.724
   11   3HE   MET   1          3HE       MET   1  10.713  17.045  -8.164
   12    H    ASP   2           H        ASP   2   9.810  18.914  -2.142
   13    HA   ASP   2           HA       ASP   2  10.045  19.079   0.610
   14   1HB   ASP   2          1HB       ASP   2   8.226  20.588  -1.302
   15   2HB   ASP   2          2HB       ASP   2   8.512  21.068   0.368
   16    H    TYR   3           H        TYR   3   7.099  17.973  -1.102
   17    HA   TYR   3           HA       TYR   3   5.948  17.194   1.520
   18   1HB   TYR   3          1HB       TYR   3   3.926  18.380   1.225
   19   2HB   TYR   3          2HB       TYR   3   5.227  19.522   1.014
   20    HD1  TYR   3           1HD      TYR   3   5.829  20.313  -1.347
   21    HD2  TYR   3           2HD      TYR   3   2.268  18.044  -0.468
   22    HE1  TYR   3           1HE      TYR   3   4.826  21.052  -3.501
   23    HE2  TYR   3           2HE      TYR   3   1.259  18.798  -2.616
   24    HH   TYR   3           HH       TYR   3   3.017  20.945  -4.890
   25    H    LEU   4           H        LEU   4   6.921  15.667  -0.906
   26    HA   LEU   4           HA       LEU   4   4.408  14.226  -1.633
   27   1HB   LEU   4          1HB       LEU   4   6.861  14.188  -3.395
   28   2HB   LEU   4          2HB       LEU   4   5.183  13.936  -3.835
   29    HG   LEU   4           HG       LEU   4   6.453  16.578  -3.054
   30   1HD1  LEU   4          1HD1      LEU   4   7.312  15.673  -5.213
   31   2HD1  LEU   4          2HD1      LEU   4   5.648  15.624  -5.817
   32   3HD1  LEU   4          3HD1      LEU   4   6.397  17.176  -5.405
   33   1HD2  LEU   4          1HD2      LEU   4   3.736  15.986  -4.355
   34   2HD2  LEU   4          2HD2      LEU   4   3.963  16.535  -2.688
   35   3HD2  LEU   4          3HD2      LEU   4   4.395  17.602  -4.029
   36    H    ARG   5           H        ARG   5   7.919  13.781  -1.310
   37    HA   ARG   5           HA       ARG   5   7.866  10.902  -1.105
   38   1HB   ARG   5          1HB       ARG   5   9.840  12.651  -1.443
   39   2HB   ARG   5          2HB       ARG   5  10.002  12.529   0.304
   40   1HG   ARG   5          1HG       ARG   5  10.030  10.172  -1.648
   41   2HG   ARG   5          2HG       ARG   5  11.468  11.034  -1.143
   42   1HD   ARG   5          1HD       ARG   5  11.704   9.810   0.664
   43   2HD   ARG   5          2HD       ARG   5  10.103  10.230   1.260
   44    HE   ARG   5           HE       ARG   5   9.449   8.332  -0.549
   45   1HH1  ARG   5          1HH2      ARG   5  11.945   8.204   1.905
   46   2HH1  ARG   5          2HH2      ARG   5  11.870   6.468   2.017
   47   1HH2  ARG   5          1HH1      ARG   5   9.417   6.121  -0.368
   48   2HH2  ARG   5          2HH1      ARG   5  10.429   5.333   0.802
   49    H    GLU   6           H        GLU   6   7.372  13.406   1.289
   50    HA   GLU   6           HA       GLU   6   7.238  11.819   3.650
   51   1HB   GLU   6          1HB       GLU   6   7.297  14.355   3.391
   52   2HB   GLU   6          2HB       GLU   6   5.586  14.302   2.990
   53   1HG   GLU   6          1HG       GLU   6   5.042  13.374   5.186
   54   2HG   GLU   6          2HG       GLU   6   6.750  13.121   5.555
   55    H    LEU   7           H        LEU   7   4.804  12.488   1.167
   56    HA   LEU   7           HA       LEU   7   2.573  11.183   2.485
   57   1HB   LEU   7          1HB       LEU   7   2.991  11.664  -0.502
   58   2HB   LEU   7          2HB       LEU   7   1.478  11.276   0.289
   59    HG   LEU   7           HG       LEU   7   3.087  13.808   0.710
   60   1HD1  LEU   7          1HD1      LEU   7   2.027  13.606  -1.541
   61   2HD1  LEU   7          2HD1      LEU   7   0.452  13.379  -0.752
   62   3HD1  LEU   7          3HD1      LEU   7   1.334  14.912  -0.572
   63   1HD2  LEU   7          1HD2      LEU   7   0.325  13.051   1.732
   64   2HD2  LEU   7          2HD2      LEU   7   1.794  13.302   2.712
   65   3HD2  LEU   7          3HD2      LEU   7   1.072  14.663   1.851
   66    H    TYR   8           H        TYR   8   4.743  10.139  -0.146
   67    HA   TYR   8           HA       TYR   8   3.987   7.504  -0.663
   68   1HB   TYR   8          1HB       TYR   8   5.967   9.104  -1.473
   69   2HB   TYR   8          2HB       TYR   8   6.887   8.430  -0.190
   70    HD1  TYR   8           1HD      TYR   8   6.638   8.321  -3.535
   71    HD2  TYR   8           2HD      TYR   8   6.871   5.628  -0.176
   72    HE1  TYR   8           1HE      TYR   8   7.517   6.539  -5.027
   73    HE2  TYR   8           2HE      TYR   8   7.846   3.895  -1.665
   74    HH   TYR   8           HH       TYR   8   8.334   4.385  -5.155
   75    H    LYS   9           H        LYS   9   6.238   8.507   1.886
   76    HA   LYS   9           HA       LYS   9   6.611   5.860   2.835
   77   1HB   LYS   9          1HB       LYS   9   7.981   8.020   3.221
   78   2HB   LYS   9          2HB       LYS   9   6.934   8.324   4.613
   79   1HG   LYS   9          1HG       LYS   9   7.747   6.405   5.777
   80   2HG   LYS   9          2HG       LYS   9   8.259   5.613   4.284
   81   1HD   LYS   9          1HD       LYS   9  10.274   6.263   5.231
   82   2HD   LYS   9          2HD       LYS   9   9.967   7.428   3.956
   83   1HE   LYS   9          1HE       LYS   9  10.803   8.691   5.762
   84   2HE   LYS   9          2HE       LYS   9   9.071   9.026   5.717
   85   1HZ   LYS   9          1HZ       LYS   9   8.802   7.437   7.563
   86   2HZ   LYS   9          2HZ       LYS   9  10.402   7.095   7.558
   87   3HZ   LYS   9          3HZ       LYS   9   9.887   8.580   7.980
   88    H    LEU  10           H        LEU  10   4.269   8.201   4.144
   89    HA   LEU  10           HA       LEU  10   3.216   6.305   5.991
   90   1HB   LEU  10          1HB       LEU  10   2.309   8.997   4.983
   91   2HB   LEU  10          2HB       LEU  10   1.261   8.041   6.033
   92    HG   LEU  10           HG       LEU  10   4.148   8.640   6.811
   93   1HD1  LEU  10          1HD1      LEU  10   3.008  10.780   6.461
   94   2HD1  LEU  10          2HD1      LEU  10   1.683  10.254   7.537
   95   3HD1  LEU  10          3HD1      LEU  10   3.325  10.489   8.178
   96   1HD2  LEU  10          1HD2      LEU  10   1.671   7.952   8.462
   97   2HD2  LEU  10          2HD2      LEU  10   2.993   6.832   8.087
   98   3HD2  LEU  10          3HD2      LEU  10   3.304   8.247   9.094
   99    H    GLU  11           H        GLU  11   2.441   7.134   2.657
  100    HA   GLU  11           HA       GLU  11   0.248   5.358   2.206
  101   1HB   GLU  11          1HB       GLU  11   2.315   6.826   0.672
  102   2HB   GLU  11          2HB       GLU  11   1.859   5.431  -0.170
  103   1HG   GLU  11          1HG       GLU  11  -0.101   7.506   0.960
  104   2HG   GLU  11          2HG       GLU  11   0.620   7.615  -0.639
  105    H    GLN  12           H        GLN  12   3.829   4.630   2.244
  106    HA   GLN  12           HA       GLN  12   3.322   1.843   1.840
  107   1HB   GLN  12          1HB       GLN  12   5.731   3.483   2.591
  108   2HB   GLN  12          2HB       GLN  12   5.762   1.711   2.648
  109   1HG   GLN  12          1HG       GLN  12   4.910   1.637   0.317
  110   2HG   GLN  12          2HG       GLN  12   5.069   3.382   0.214
  111   1HE2  GLN  12          2HE2      GLN  12   6.580   0.841  -1.011
  112   2HE2  GLN  12          1HE2      GLN  12   8.264   1.289  -0.785
  113    H    GLN  13           H        GLN  13   3.415   3.735   4.771
  114    HA   GLN  13           HA       GLN  13   3.841   1.531   6.588
  115   1HB   GLN  13          1HB       GLN  13   2.382   4.181   6.941
  116   2HB   GLN  13          2HB       GLN  13   2.494   2.988   8.225
  117   1HG   GLN  13          1HG       GLN  13   4.908   4.241   6.863
  118   2HG   GLN  13          2HG       GLN  13   4.224   4.768   8.395
  119   1HE2  GLN  13          2HE2      GLN  13   6.710   2.921   7.154
  120   2HE2  GLN  13          1HE2      GLN  13   6.918   1.845   8.529
  121    H    ALA  14           H        ALA  14   0.882   2.556   4.876
  122    HA   ALA  14           HA       ALA  14  -0.816   0.626   6.290
  123   1HB   ALA  14          1HB       ALA  14  -1.758   2.620   5.159
  124   2HB   ALA  14          2HB       ALA  14  -1.136   2.047   3.593
  125   3HB   ALA  14          3HB       ALA  14  -2.392   1.124   4.447
  126    H    MET  15           H        MET  15   1.166   0.575   3.280
  127    HA   MET  15           HA       MET  15   0.417  -2.114   2.480
  128   1HB   MET  15          1HB       MET  15   2.336  -0.037   1.676
  129   2HB   MET  15          2HB       MET  15   3.058  -1.624   1.572
  130   1HG   MET  15          1HG       MET  15   0.297  -1.424   0.453
  131   2HG   MET  15          2HG       MET  15   1.491  -0.417  -0.336
  132   1HE   MET  15          1HE       MET  15   1.063  -4.087   1.050
  133   2HE   MET  15          2HE       MET  15   2.103  -5.020  -0.049
  134   3HE   MET  15          3HE       MET  15   2.829  -3.930   1.145
  135    H    LYS  16           H        LYS  16   3.020  -0.926   4.625
  136    HA   LYS  16           HA       LYS  16   4.154  -3.518   5.147
  137   1HB   LYS  16          1HB       LYS  16   4.916  -0.954   5.706
  138   2HB   LYS  16          2HB       LYS  16   4.136  -1.322   7.230
  139   1HG   LYS  16          1HG       LYS  16   6.231  -2.024   7.776
  140   2HG   LYS  16          2HG       LYS  16   5.694  -3.537   7.054
  141   1HD   LYS  16          1HD       LYS  16   7.350  -1.332   5.738
  142   2HD   LYS  16          2HD       LYS  16   7.935  -2.911   6.272
  143   1HE   LYS  16          1HE       LYS  16   6.494  -4.024   4.580
  144   2HE   LYS  16          2HE       LYS  16   5.898  -2.444   4.046
  145   1HZ   LYS  16          1HZ       LYS  16   8.183  -1.874   3.407
  146   2HZ   LYS  16          2HZ       LYS  16   8.731  -3.333   3.896
  147   3HZ   LYS  16          3HZ       LYS  16   7.710  -3.229   2.630
  148    H    LEU  17           H        LEU  17   1.645  -1.665   6.859
  149    HA   LEU  17           HA       LEU  17   1.046  -3.703   8.795
  150   1HB   LEU  17          1HB       LEU  17  -0.015  -1.111   7.941
  151   2HB   LEU  17          2HB       LEU  17  -1.335  -2.192   8.235
  152    HG   LEU  17           HG       LEU  17   0.981  -1.841  10.199
  153   1HD1  LEU  17          1HD1      LEU  17  -0.152   0.328   9.799
  154   2HD1  LEU  17          2HD1      LEU  17  -1.694  -0.416  10.279
  155   3HD1  LEU  17          3HD1      LEU  17  -0.368  -0.279  11.448
  156   1HD2  LEU  17          1HD2      LEU  17  -1.872  -2.864  10.597
  157   2HD2  LEU  17          2HD2      LEU  17  -0.413  -3.874  10.550
  158   3HD2  LEU  17          3HD2      LEU  17  -0.631  -2.705  11.859
  159    H    TYR  18           H        TYR  18  -0.288  -3.134   5.521
  160    HA   TYR  18           HA       TYR  18  -2.155  -5.209   5.474
  161   1HB   TYR  18          1HB       TYR  18  -0.604  -3.661   3.438
  162   2HB   TYR  18          2HB       TYR  18  -1.395  -5.087   2.893
  163    HD1  TYR  18           1HD      TYR  18  -3.940  -5.212   4.210
  164    HD2  TYR  18           2HD      TYR  18  -1.834  -1.770   2.710
  165    HE1  TYR  18           1HE      TYR  18  -6.097  -3.999   3.976
  166    HE2  TYR  18           2HE      TYR  18  -3.973  -0.522   2.566
  167    HH   TYR  18           HH       TYR  18  -6.219  -0.560   3.011
  168    H    ARG  19           H        ARG  19   1.372  -5.420   4.869
  169    HA   ARG  19           HA       ARG  19   1.393  -8.120   3.972
  170   1HB   ARG  19          1HB       ARG  19   3.320  -6.115   4.685
  171   2HB   ARG  19          2HB       ARG  19   3.743  -7.548   5.607
  172   1HG   ARG  19          1HG       ARG  19   3.283  -7.461   2.592
  173   2HG   ARG  19          2HG       ARG  19   4.863  -7.390   3.381
  174   1HD   ARG  19          1HD       ARG  19   4.554  -9.631   4.324
  175   2HD   ARG  19          2HD       ARG  19   2.921  -9.724   3.634
  176    HE   ARG  19           HE       ARG  19   4.828  -9.182   1.559
  177   1HH1  ARG  19          1HH2      ARG  19   3.769 -11.852   3.562
  178   2HH1  ARG  19          2HH2      ARG  19   4.179 -13.042   2.357
  179   1HH2  ARG  19          1HH1      ARG  19   5.320 -10.750   0.058
  180   2HH2  ARG  19          2HH1      ARG  19   5.038 -12.426   0.427
  181    H    GLU  20           H        GLU  20   0.991  -6.902   7.229
  182    HA   GLU  20           HA       GLU  20   1.098  -9.622   8.440
  183   1HB   GLU  20          1HB       GLU  20   1.798  -7.063   9.323
  184   2HB   GLU  20          2HB       GLU  20   0.216  -7.287  10.030
  185   1HG   GLU  20          1HG       GLU  20   1.682  -8.099  11.668
  186   2HG   GLU  20          2HG       GLU  20   1.083  -9.565  10.901
  187    H    ALA  21           H        ALA  21  -1.251  -7.045   7.776
  188    HA   ALA  21           HA       ALA  21  -3.553  -8.247   8.880
  189   1HB   ALA  21          1HB       ALA  21  -3.389  -5.921   7.930
  190   2HB   ALA  21          2HB       ALA  21  -3.436  -6.646   6.300
  191   3HB   ALA  21          3HB       ALA  21  -4.818  -6.821   7.376
  192    H    SER  22           H        SER  22  -2.062  -8.843   5.674
  193    HA   SER  22           HA       SER  22  -3.954 -10.752   4.710
  194   1HB   SER  22          1HB       SER  22  -2.126  -9.606   3.409
  195   2HB   SER  22          2HB       SER  22  -0.959 -10.700   4.166
  196    HG   SER  22           HG       SER  22  -2.058 -12.449   3.202
  197    H    GLU  23           H        GLU  23  -1.173 -11.162   6.937
  198    HA   GLU  23           HA       GLU  23  -1.341 -14.074   6.971
  199   1HB   GLU  23          1HB       GLU  23   0.674 -12.490   7.525
  200   2HB   GLU  23          2HB       GLU  23  -0.046 -12.406   9.128
  201   1HG   GLU  23          1HG       GLU  23  -0.013 -14.909   9.259
  202   2HG   GLU  23          2HG       GLU  23   0.730 -14.970   7.663
  203    H    LYS  24           H        LYS  24  -2.474 -11.433   9.042
  204    HA   LYS  24           HA       LYS  24  -3.839 -13.030  11.037
  205   1HB   LYS  24          1HB       LYS  24  -3.915 -10.151  10.150
  206   2HB   LYS  24          2HB       LYS  24  -5.329 -10.772  10.981
  207   1HG   LYS  24          1HG       LYS  24  -3.943  -9.785  12.622
  208   2HG   LYS  24          2HG       LYS  24  -3.950 -11.528  12.877
  209   1HD   LYS  24          1HD       LYS  24  -1.697 -11.671  11.787
  210   2HD   LYS  24          2HD       LYS  24  -1.717  -9.903  11.573
  211   1HE   LYS  24          1HE       LYS  24  -1.964  -9.623  14.040
  212   2HE   LYS  24          2HE       LYS  24  -1.940 -11.377  14.240
  213   1HZ   LYS  24          1HZ       LYS  24   0.328 -11.376  13.316
  214   2HZ   LYS  24          2HZ       LYS  24   0.304  -9.742  13.185
  215   3HZ   LYS  24          3HZ       LYS  24   0.246 -10.446  14.654
  216    H    ALA  25           H        ALA  25  -5.003 -11.716   7.925
  217    HA   ALA  25           HA       ALA  25  -7.657 -12.802   8.057
  218   1HB   ALA  25          1HB       ALA  25  -7.078 -11.020   6.514
  219   2HB   ALA  25          2HB       ALA  25  -5.879 -12.046   5.699
  220   3HB   ALA  25          3HB       ALA  25  -7.599 -12.446   5.598
  221    H    ARG  26           H        ARG  26  -4.902 -14.017   6.149
  222    HA   ARG  26           HA       ARG  26  -4.593 -15.952   5.011
  223   1HB   ARG  26          1HB       ARG  26  -4.019 -16.225   7.631
  224   2HB   ARG  26          2HB       ARG  26  -5.212 -17.495   7.519
  225   1HG   ARG  26          1HG       ARG  26  -3.091 -18.505   7.199
  226   2HG   ARG  26          2HG       ARG  26  -3.802 -18.458   5.581
  227   1HD   ARG  26          1HD       ARG  26  -2.462 -16.481   5.010
  228   2HD   ARG  26          2HD       ARG  26  -1.881 -16.339   6.665
  229    HE   ARG  26           HE       ARG  26  -0.972 -18.222   4.595
  230   1HH1  ARG  26          1HH2      ARG  26  -0.858 -17.553   8.039
  231   2HH1  ARG  26          2HH2      ARG  26   0.600 -18.481   8.257
  232   1HH2  ARG  26          1HH1      ARG  26   0.880 -19.387   4.953
  233   2HH2  ARG  26          2HH1      ARG  26   1.550 -19.490   6.555
  234    H    ASN  27           H        ASN  27  -7.438 -15.124   4.983
  235    HA   ASN  27           HA       ASN  27  -8.758 -17.719   4.289
  236   1HB   ASN  27          1HB       ASN  27  -9.453 -16.721   6.474
  237   2HB   ASN  27          2HB       ASN  27  -9.916 -15.237   5.646
  238   1HD2  ASN  27          2HD2      ASN  27 -12.107 -15.122   5.205
  239   2HD2  ASN  27          1HD2      ASN  27 -13.132 -16.533   5.001
  240    HA   PRO  28           HA       PRO  28  -8.749 -15.888   0.370
  241   1HB   PRO  28          1HB       PRO  28 -10.643 -17.295  -1.059
  242   2HB   PRO  28          2HB       PRO  28  -9.064 -17.951  -0.534
  243   1HG   PRO  28          1HG       PRO  28 -11.752 -18.246   0.835
  244   2HG   PRO  28          2HG       PRO  28 -10.544 -19.524   0.474
  245   1HD   PRO  28          1HD       PRO  28 -10.698 -18.378   2.912
  246   2HD   PRO  28          2HD       PRO  28  -9.104 -18.769   2.197
  247    H    GLU  29           H        GLU  29 -11.898 -15.811   1.958
  248    HA   GLU  29           HA       GLU  29 -13.231 -13.997   0.209
  249   1HB   GLU  29          1HB       GLU  29 -14.157 -15.370   2.201
  250   2HB   GLU  29          2HB       GLU  29 -13.550 -14.088   3.230
  251   1HG   GLU  29          1HG       GLU  29 -15.836 -13.605   2.877
  252   2HG   GLU  29          2HG       GLU  29 -14.960 -12.446   1.886
  253    H    LYS  30           H        LYS  30 -11.361 -13.366   3.112
  254    HA   LYS  30           HA       LYS  30 -11.170 -10.478   2.813
  255   1HB   LYS  30          1HB       LYS  30  -9.503 -12.497   4.372
  256   2HB   LYS  30          2HB       LYS  30  -9.171 -10.765   4.410
  257   1HG   LYS  30          1HG       LYS  30 -11.794 -12.031   5.275
  258   2HG   LYS  30          2HG       LYS  30 -10.477 -11.605   6.366
  259   1HD   LYS  30          1HD       LYS  30 -10.965  -9.390   6.370
  260   2HD   LYS  30          2HD       LYS  30 -11.314  -9.333   4.655
  261   1HE   LYS  30          1HE       LYS  30 -13.325  -8.797   5.815
  262   2HE   LYS  30          2HE       LYS  30 -13.534 -10.365   5.034
  263   1HZ   LYS  30          1HZ       LYS  30 -13.128 -11.418   7.207
  264   2HZ   LYS  30          2HZ       LYS  30 -12.927  -9.959   7.920
  265   3HZ   LYS  30          3HZ       LYS  30 -14.381 -10.382   7.312
  266    H    LYS  31           H        LYS  31  -9.033 -13.153   1.820
  267    HA   LYS  31           HA       LYS  31  -7.014 -11.493   0.720
  268   1HB   LYS  31          1HB       LYS  31  -7.038 -14.051   1.324
  269   2HB   LYS  31          2HB       LYS  31  -7.440 -14.242  -0.395
  270   1HG   LYS  31          1HG       LYS  31  -5.400 -12.986  -1.010
  271   2HG   LYS  31          2HG       LYS  31  -5.075 -12.636   0.697
  272   1HD   LYS  31          1HD       LYS  31  -4.777 -15.054   1.139
  273   2HD   LYS  31          2HD       LYS  31  -5.082 -15.400  -0.583
  274   1HE   LYS  31          1HE       LYS  31  -3.158 -13.923  -1.194
  275   2HE   LYS  31          2HE       LYS  31  -2.853 -13.615   0.519
  276   1HZ   LYS  31          1HZ       LYS  31  -2.399 -15.999   0.794
  277   2HZ   LYS  31          2HZ       LYS  31  -2.678 -16.278  -0.794
  278   3HZ   LYS  31          3HZ       LYS  31  -1.407 -15.364  -0.335
  279    H    SER  32           H        SER  32 -10.113 -11.961  -0.593
  280    HA   SER  32           HA       SER  32  -9.218 -10.649  -3.134
  281   1HB   SER  32          1HB       SER  32 -11.749 -12.227  -2.530
  282   2HB   SER  32          2HB       SER  32 -11.412 -11.398  -4.059
  283    HG   SER  32           HG       SER  32  -9.609 -12.741  -4.362
  284    H    VAL  33           H        VAL  33 -10.067  -9.600  -0.260
  285    HA   VAL  33           HA       VAL  33 -11.657  -7.284  -1.315
  286    HB   VAL  33           HB       VAL  33 -11.760  -8.652   1.391
  287   1HG1  VAL  33          1HG1      VAL  33 -11.766  -6.261   1.901
  288   2HG1  VAL  33          2HG1      VAL  33 -12.977  -5.961   0.632
  289   3HG1  VAL  33          3HG1      VAL  33 -13.397  -6.907   2.076
  290   1HG2  VAL  33          1HG2      VAL  33 -13.940  -7.935  -0.627
  291   2HG2  VAL  33          2HG2      VAL  33 -13.224  -9.545  -0.442
  292   3HG2  VAL  33          3HG2      VAL  33 -14.151  -8.844   0.887
  293    H    LEU  34           H        LEU  34  -8.901  -8.206   0.910
  294    HA   LEU  34           HA       LEU  34  -8.076  -5.400   0.934
  295   1HB   LEU  34          1HB       LEU  34  -6.677  -5.919   2.539
  296   2HB   LEU  34          2HB       LEU  34  -7.792  -7.248   2.793
  297    HG   LEU  34           HG       LEU  34  -5.240  -7.325   1.222
  298   1HD1  LEU  34          1HD1      LEU  34  -4.891  -7.005   3.687
  299   2HD1  LEU  34          2HD1      LEU  34  -5.792  -8.492   3.994
  300   3HD1  LEU  34          3HD1      LEU  34  -4.242  -8.548   3.121
  301   1HD2  LEU  34          1HD2      LEU  34  -6.848  -9.689   2.218
  302   2HD2  LEU  34          2HD2      LEU  34  -6.775  -9.151   0.523
  303   3HD2  LEU  34          3HD2      LEU  34  -5.321  -9.765   1.318
  304    H    GLN  35           H        GLN  35  -7.656  -8.063  -1.269
  305    HA   GLN  35           HA       GLN  35  -5.188  -7.232  -2.447
  306   1HB   GLN  35          1HB       GLN  35  -6.099  -9.440  -2.759
  307   2HB   GLN  35          2HB       GLN  35  -7.514  -8.797  -3.619
  308   1HG   GLN  35          1HG       GLN  35  -6.015  -7.997  -5.441
  309   2HG   GLN  35          2HG       GLN  35  -4.610  -8.545  -4.526
  310   1HE2  GLN  35          2HE2      GLN  35  -3.840 -10.143  -5.967
  311   2HE2  GLN  35          1HE2      GLN  35  -4.808 -11.536  -6.428
  312    H    LYS  36           H        LYS  36  -8.586  -6.285  -3.225
  313    HA   LYS  36           HA       LYS  36  -7.809  -4.675  -5.492
  314   1HB   LYS  36          1HB       LYS  36 -10.084  -3.632  -5.242
  315   2HB   LYS  36          2HB       LYS  36 -10.092  -5.389  -5.382
  316   1HG   LYS  36          1HG       LYS  36 -10.529  -5.677  -3.029
  317   2HG   LYS  36          2HG       LYS  36 -10.274  -3.954  -2.704
  318   1HD   LYS  36          1HD       LYS  36 -12.260  -3.418  -4.110
  319   2HD   LYS  36          2HD       LYS  36 -12.531  -5.155  -4.367
  320   1HE   LYS  36          1HE       LYS  36 -12.832  -5.503  -1.956
  321   2HE   LYS  36          2HE       LYS  36 -12.414  -3.821  -1.625
  322   1HZ   LYS  36          1HZ       LYS  36 -14.823  -4.144  -1.629
  323   2HZ   LYS  36          2HZ       LYS  36 -14.407  -3.145  -2.851
  324   3HZ   LYS  36          3HZ       LYS  36 -14.801  -4.702  -3.165
  325    H    ILE  37           H        ILE  37  -7.903  -3.895  -2.061
  326    HA   ILE  37           HA       ILE  37  -7.198  -1.059  -2.464
  327    HB   ILE  37           HB       ILE  37  -6.777  -2.946  -0.118
  328   1HG1  ILE  37          1HG1      ILE  37  -8.957  -0.910  -0.391
  329   2HG1  ILE  37          2HG1      ILE  37  -9.121  -2.668  -0.586
  330   1HG2  ILE  37          1HG2      ILE  37  -5.248  -1.292   0.385
  331   2HG2  ILE  37          2HG2      ILE  37  -6.065  -0.081  -0.600
  332   3HG2  ILE  37          3HG2      ILE  37  -6.689  -0.443   0.992
  333   1HD1  ILE  37          1HD1      ILE  37  -8.318  -2.912   1.806
  334   2HD1  ILE  37          2HD1      ILE  37  -8.583  -1.151   1.963
  335   3HD1  ILE  37          3HD1      ILE  37  -9.927  -2.214   1.566
  336    H    LEU  38           H        LEU  38  -5.270  -4.089  -1.791
  337    HA   LEU  38           HA       LEU  38  -2.758  -2.813  -1.882
  338   1HB   LEU  38          1HB       LEU  38  -3.674  -5.623  -2.549
  339   2HB   LEU  38          2HB       LEU  38  -1.989  -5.172  -2.723
  340    HG   LEU  38           HG       LEU  38  -3.503  -4.797  -0.100
  341   1HD1  LEU  38          1HD1      LEU  38  -3.460  -7.192  -0.703
  342   2HD1  LEU  38          2HD1      LEU  38  -1.704  -7.100  -0.973
  343   3HD1  LEU  38          3HD1      LEU  38  -2.379  -6.852   0.654
  344   1HD2  LEU  38          1HD2      LEU  38  -0.555  -4.795  -0.890
  345   2HD2  LEU  38          2HD2      LEU  38  -1.490  -3.423  -0.250
  346   3HD2  LEU  38          3HD2      LEU  38  -1.138  -4.809   0.777
  347    H    GLU  39           H        GLU  39  -4.660  -4.000  -4.722
  348    HA   GLU  39           HA       GLU  39  -2.559  -3.239  -6.560
  349   1HB   GLU  39          1HB       GLU  39  -5.549  -3.755  -6.932
  350   2HB   GLU  39          2HB       GLU  39  -4.448  -3.397  -8.266
  351   1HG   GLU  39          1HG       GLU  39  -3.071  -5.382  -7.670
  352   2HG   GLU  39          2HG       GLU  39  -4.220  -5.795  -6.400
  353    H    ASP  40           H        ASP  40  -5.259  -1.411  -5.183
  354    HA   ASP  40           HA       ASP  40  -4.937   0.959  -6.787
  355   1HB   ASP  40          1HB       ASP  40  -6.253   0.118  -4.195
  356   2HB   ASP  40          2HB       ASP  40  -5.991   1.768  -4.448
  357    H    GLU  41           H        GLU  41  -3.423  -0.252  -3.753
  358    HA   GLU  41           HA       GLU  41  -2.109   2.328  -3.245
  359   1HB   GLU  41          1HB       GLU  41  -1.482  -0.391  -2.030
  360   2HB   GLU  41          2HB       GLU  41  -0.807   1.143  -1.510
  361   1HG   GLU  41          1HG       GLU  41  -3.669   0.213  -1.174
  362   2HG   GLU  41          2HG       GLU  41  -2.458   0.412   0.063
  363    H    GLU  42           H        GLU  42  -1.107  -0.748  -4.741
  364    HA   GLU  42           HA       GLU  42   1.571   0.097  -5.352
  365   1HB   GLU  42          1HB       GLU  42   0.678  -2.241  -5.461
  366   2HB   GLU  42          2HB       GLU  42  -0.207  -1.806  -6.931
  367   1HG   GLU  42          1HG       GLU  42   1.916  -1.304  -8.078
  368   2HG   GLU  42          2HG       GLU  42   2.817  -1.558  -6.580
  369    H    LYS  43           H        LYS  43  -1.545   0.744  -6.957
  370    HA   LYS  43           HA       LYS  43  -0.409   2.027  -9.304
  371   1HB   LYS  43          1HB       LYS  43  -3.023   1.331  -8.558
  372   2HB   LYS  43          2HB       LYS  43  -3.027   3.066  -8.359
  373   1HG   LYS  43          1HG       LYS  43  -3.645   2.940 -10.538
  374   2HG   LYS  43          2HG       LYS  43  -1.906   3.035 -10.778
  375   1HD   LYS  43          1HD       LYS  43  -3.720   0.585 -10.940
  376   2HD   LYS  43          2HD       LYS  43  -2.850   1.379 -12.238
  377   1HE   LYS  43          1HE       LYS  43  -1.428  -0.344 -11.993
  378   2HE   LYS  43          2HE       LYS  43  -0.703   0.705 -10.784
  379   1HZ   LYS  43          1HZ       LYS  43  -2.109  -0.543  -9.098
  380   2HZ   LYS  43          2HZ       LYS  43  -2.619  -1.522 -10.295
  381   3HZ   LYS  43          3HZ       LYS  43  -1.043  -1.512  -9.886
  382    H    HIS  44           H        HIS  44  -1.427   3.378  -6.065
  383    HA   HIS  44           HA       HIS  44  -0.831   6.044  -6.645
  384   1HB   HIS  44          1HB       HIS  44  -0.588   4.449  -4.048
  385   2HB   HIS  44          2HB       HIS  44  -0.704   6.168  -4.243
  386    HD2  HIS  44           2HD      HIS  44  -3.137   5.434  -6.628
  387    HE1  HIS  44           1HE      HIS  44  -5.398   4.815  -3.096
  388    HE2  HIS  44           2HE      HIS  44  -5.497   5.044  -5.636
  389    H    ILE  45           H        ILE  45   1.280   3.425  -5.381
  390    HA   ILE  45           HA       ILE  45   3.610   5.064  -5.100
  391    HB   ILE  45           HB       ILE  45   2.964   2.155  -5.027
  392   1HG1  ILE  45          1HG1      ILE  45   4.511   2.267  -3.052
  393   2HG1  ILE  45          2HG1      ILE  45   4.821   3.964  -3.412
  394   1HG2  ILE  45          1HG2      ILE  45   4.783   1.974  -6.637
  395   2HG2  ILE  45          2HG2      ILE  45   5.823   3.003  -5.615
  396   3HG2  ILE  45          3HG2      ILE  45   5.302   1.400  -5.057
  397   1HD1  ILE  45          1HD1      ILE  45   2.409   4.468  -2.974
  398   2HD1  ILE  45          2HD1      ILE  45   2.140   2.742  -2.626
  399   3HD1  ILE  45          3HD1      ILE  45   3.203   3.704  -1.588
  400    H    GLU  46           H        GLU  46   2.450   3.256  -8.031
  401    HA   GLU  46           HA       GLU  46   4.708   3.841  -9.648
  402   1HB   GLU  46          1HB       GLU  46   1.748   3.549 -10.284
  403   2HB   GLU  46          2HB       GLU  46   2.952   3.823 -11.514
  404   1HG   GLU  46          1HG       GLU  46   3.015   1.458  -9.619
  405   2HG   GLU  46          2HG       GLU  46   2.247   1.448 -11.205
  406    H    TRP  47           H        TRP  47   1.778   5.846  -9.042
  407    HA   TRP  47           HA       TRP  47   2.666   7.935 -10.809
  408   1HB   TRP  47          1HB       TRP  47   0.703   8.156  -8.489
  409   2HB   TRP  47          2HB       TRP  47   0.776   9.147  -9.924
  410    HD1  TRP  47           1HD      TRP  47   0.817   6.429 -11.898
  411    HE1  TRP  47           1HE      TRP  47  -1.424   5.180 -12.219
  412    HE3  TRP  47           3HE      TRP  47  -1.779   8.377  -7.965
  413    HZ2  TRP  47           2HZ      TRP  47  -4.084   5.228 -11.044
  414    HZ3  TRP  47           3HZ      TRP  47  -4.166   7.815  -7.579
  415    HH2  TRP  47           2HH      TRP  47  -5.326   6.216  -9.111
  416    H    LEU  48           H        LEU  48   2.764   7.476  -7.287
  417    HA   LEU  48           HA       LEU  48   3.899   9.963  -6.520
  418   1HB   LEU  48          1HB       LEU  48   3.876   7.129  -5.443
  419   2HB   LEU  48          2HB       LEU  48   4.810   8.318  -4.615
  420    HG   LEU  48           HG       LEU  48   1.857   8.710  -5.169
  421   1HD1  LEU  48          1HD1      LEU  48   1.526   8.032  -2.798
  422   2HD1  LEU  48          2HD1      LEU  48   2.154   6.709  -3.784
  423   3HD1  LEU  48          3HD1      LEU  48   3.249   7.586  -2.704
  424   1HD2  LEU  48          1HD2      LEU  48   3.771  10.018  -3.170
  425   2HD2  LEU  48          2HD2      LEU  48   3.105  10.792  -4.625
  426   3HD2  LEU  48          3HD2      LEU  48   2.029  10.338  -3.300
  427    H    GLU  49           H        GLU  49   5.529   6.917  -7.460
  428    HA   GLU  49           HA       GLU  49   8.212   7.954  -7.337
  429   1HB   GLU  49          1HB       GLU  49   7.385   5.512  -7.635
  430   2HB   GLU  49          2HB       GLU  49   7.217   5.876  -9.340
  431   1HG   GLU  49          1HG       GLU  49   9.636   6.545  -9.415
  432   2HG   GLU  49          2HG       GLU  49   9.786   6.119  -7.710
  433    H    THR  50           H        THR  50   5.859   7.796 -10.013
  434    HA   THR  50           HA       THR  50   7.458   9.048 -11.998
  435    HB   THR  50           HB       THR  50   4.437   8.994 -11.647
  436    HG1  THR  50           1HG      THR  50   5.202   6.962 -11.863
  437   1HG2  THR  50          1HG2      THR  50   4.944  10.687 -13.265
  438   2HG2  THR  50          2HG2      THR  50   6.124   9.612 -14.073
  439   3HG2  THR  50          3HG2      THR  50   4.375   9.227 -14.096
  440    H    ILE  51           H        ILE  51   5.629  10.490  -9.407
  441    HA   ILE  51           HA       ILE  51   6.124  13.231 -10.354
  442    HB   ILE  51           HB       ILE  51   4.288  11.909  -8.407
  443   1HG1  ILE  51          1HG1      ILE  51   2.726  13.686  -9.220
  444   2HG1  ILE  51          2HG1      ILE  51   4.031  14.405 -10.161
  445   1HG2  ILE  51          1HG2      ILE  51   5.377  13.390  -6.826
  446   2HG2  ILE  51          2HG2      ILE  51   5.086  14.780  -7.919
  447   3HG2  ILE  51          3HG2      ILE  51   3.727  13.911  -7.173
  448   1HD1  ILE  51          1HD1      ILE  51   2.849  11.633 -10.563
  449   2HD1  ILE  51          2HD1      ILE  51   2.508  13.074 -11.540
  450   3HD1  ILE  51          3HD1      ILE  51   4.136  12.369 -11.559
  451    H    ASN  52           H        ASN  52   7.591  11.091  -8.210
  452    HA   ASN  52           HA       ASN  52   9.055  13.072  -6.637
  453   1HB   ASN  52          1HB       ASN  52   8.374  10.789  -5.821
  454   2HB   ASN  52          2HB       ASN  52   9.539  10.082  -6.944
  455   1HD2  ASN  52          2HD2      ASN  52  10.668   9.100  -5.150
  456   2HD2  ASN  52          1HD2      ASN  52  11.654  10.097  -4.092
  457    H    GLY  53           H        GLY  53  11.526  12.875  -6.517
  458   1HA   GLY  53          1HA       GLY  53  13.083  12.197  -8.860
  459   2HA   GLY  53          2HA       GLY  53  12.819  13.938  -8.759
  460   1H    MET   1          1H        MET   1  -6.169  -6.384  19.946
  461   2H    MET   1          2H        MET   1  -6.952  -7.677  19.333
  462   3H    MET   1          3H        MET   1  -5.552  -7.884  20.157
  463    HA   MET   1           HA       MET   1  -4.301  -6.703  18.492
  464   1HB   MET   1          1HB       MET   1  -5.818  -9.178  17.702
  465   2HB   MET   1          2HB       MET   1  -4.895  -8.324  16.462
  466   1HG   MET   1          1HG       MET   1  -3.729  -9.238  19.113
  467   2HG   MET   1          2HG       MET   1  -3.580 -10.099  17.581
  468   1HE   MET   1          1HE       MET   1  -1.144  -9.118  19.545
  469   2HE   MET   1          2HE       MET   1  -0.915 -10.123  18.093
  470   3HE   MET   1          3HE       MET   1   0.044  -8.641  18.313
  471    H    ASP   2           H        ASP   2  -7.507  -7.344  16.918
  472    HA   ASP   2           HA       ASP   2  -8.729  -6.066  15.492
  473   1HB   ASP   2          1HB       ASP   2  -7.824  -3.790  17.290
  474   2HB   ASP   2          2HB       ASP   2  -9.256  -3.823  16.266
  475    H    TYR   3           H        TYR   3  -6.389  -6.685  14.346
  476    HA   TYR   3           HA       TYR   3  -4.575  -4.817  13.679
  477   1HB   TYR   3          1HB       TYR   3  -3.888  -6.294  11.834
  478   2HB   TYR   3          2HB       TYR   3  -4.334  -7.225  13.250
  479    HD1  TYR   3           1HD      TYR   3  -5.195  -6.413   9.757
  480    HD2  TYR   3           2HD      TYR   3  -6.453  -8.603  13.262
  481    HE1  TYR   3           1HE      TYR   3  -6.779  -7.743   8.373
  482    HE2  TYR   3           2HE      TYR   3  -8.054  -9.887  11.882
  483    HH   TYR   3           HH       TYR   3  -8.905 -10.251   9.793
  484    H    LEU   4           H        LEU   4  -7.478  -5.293  12.045
  485    HA   LEU   4           HA       LEU   4  -7.147  -3.747   9.688
  486   1HB   LEU   4          1HB       LEU   4  -9.499  -3.987   9.419
  487   2HB   LEU   4          2HB       LEU   4  -8.774  -5.485  10.048
  488    HG   LEU   4           HG       LEU   4  -9.551  -4.398  12.376
  489   1HD1  LEU   4          1HD1      LEU   4 -10.628  -2.377  11.389
  490   2HD1  LEU   4          2HD1      LEU   4 -11.672  -3.420  10.407
  491   3HD1  LEU   4          3HD1      LEU   4 -11.812  -3.415  12.177
  492   1HD2  LEU   4          1HD2      LEU   4 -11.407  -5.908  10.489
  493   2HD2  LEU   4          2HD2      LEU   4 -10.181  -6.634  11.552
  494   3HD2  LEU   4          3HD2      LEU   4 -11.580  -5.808  12.256
  495    H    ARG   5           H        ARG   5  -7.198  -2.507  12.677
  496    HA   ARG   5           HA       ARG   5  -8.906  -0.087  12.111
  497   1HB   ARG   5          1HB       ARG   5  -9.626  -1.720  13.972
  498   2HB   ARG   5          2HB       ARG   5  -8.184  -1.208  14.854
  499   1HG   ARG   5          1HG       ARG   5  -9.048   1.178  14.729
  500   2HG   ARG   5          2HG       ARG   5 -10.524   0.538  13.980
  501   1HD   ARG   5          1HD       ARG   5 -10.778  -0.966  16.019
  502   2HD   ARG   5          2HD       ARG   5  -9.433  -0.100  16.753
  503    HE   ARG   5           HE       ARG   5 -10.766   1.975  16.656
  504   1HH1  ARG   5          1HH2      ARG   5 -12.634  -0.990  16.415
  505   2HH1  ARG   5          2HH2      ARG   5 -14.083  -0.220  16.998
  506   1HH2  ARG   5          1HH1      ARG   5 -12.658   2.881  17.368
  507   2HH2  ARG   5          2HH1      ARG   5 -14.092   1.907  17.508
  508    H    GLU   6           H        GLU   6  -5.988  -1.322  13.656
  509    HA   GLU   6           HA       GLU   6  -4.424   1.050  13.730
  510   1HB   GLU   6          1HB       GLU   6  -3.900  -1.386  14.560
  511   2HB   GLU   6          2HB       GLU   6  -3.441  -1.713  12.902
  512   1HG   GLU   6          1HG       GLU   6  -1.427  -1.155  13.993
  513   2HG   GLU   6          2HG       GLU   6  -1.830   0.286  13.069
  514    H    LEU   7           H        LEU   7  -4.910  -1.315  11.072
  515    HA   LEU   7           HA       LEU   7  -3.434   0.192   9.167
  516   1HB   LEU   7          1HB       LEU   7  -3.541  -1.578   7.944
  517   2HB   LEU   7          2HB       LEU   7  -4.388  -2.327   9.272
  518    HG   LEU   7           HG       LEU   7  -6.524  -1.505   8.164
  519   1HD1  LEU   7          1HD1      LEU   7  -5.581   0.056   6.459
  520   2HD1  LEU   7          2HD1      LEU   7  -4.641  -1.274   5.777
  521   3HD1  LEU   7          3HD1      LEU   7  -6.419  -1.279   5.700
  522   1HD2  LEU   7          1HD2      LEU   7  -4.810  -3.534   6.649
  523   2HD2  LEU   7          2HD2      LEU   7  -5.677  -3.894   8.144
  524   3HD2  LEU   7          3HD2      LEU   7  -6.586  -3.481   6.681
  525    H    TYR   8           H        TYR   8  -6.977   0.242   9.629
  526    HA   TYR   8           HA       TYR   8  -7.754   2.163   7.712
  527   1HB   TYR   8          1HB       TYR   8  -8.892   0.778   9.787
  528   2HB   TYR   8          2HB       TYR   8  -8.757   2.279  10.591
  529    HD1  TYR   8           1HD      TYR   8  -9.583   4.048   8.056
  530    HD2  TYR   8           2HD      TYR   8 -11.193   0.553  10.012
  531    HE1  TYR   8           1HE      TYR   8 -11.896   4.804   7.540
  532    HE2  TYR   8           2HE      TYR   8 -13.491   1.280   9.416
  533    HH   TYR   8           HH       TYR   8 -14.780   2.968   8.520
  534    H    LYS   9           H        LYS   9  -6.404   2.754  10.976
  535    HA   LYS   9           HA       LYS   9  -6.714   5.585  10.807
  536   1HB   LYS   9          1HB       LYS   9  -6.459   4.319  12.931
  537   2HB   LYS   9          2HB       LYS   9  -4.768   3.981  12.536
  538   1HG   LYS   9          1HG       LYS   9  -4.212   6.343  12.632
  539   2HG   LYS   9          2HG       LYS   9  -5.918   6.793  12.818
  540   1HD   LYS   9          1HD       LYS   9  -6.026   5.648  14.980
  541   2HD   LYS   9          2HD       LYS   9  -4.351   5.104  14.830
  542   1HE   LYS   9          1HE       LYS   9  -5.191   8.041  14.831
  543   2HE   LYS   9          2HE       LYS   9  -4.780   7.155  16.301
  544   1HZ   LYS   9          1HZ       LYS   9  -2.569   6.744  15.385
  545   2HZ   LYS   9          2HZ       LYS   9  -2.920   7.564  14.011
  546   3HZ   LYS   9          3HZ       LYS   9  -2.859   8.348  15.444
  547    H    LEU  10           H        LEU  10  -3.623   3.819  10.270
  548    HA   LEU  10           HA       LEU  10  -2.347   6.013   9.140
  549   1HB   LEU  10          1HB       LEU  10  -1.934   3.031   8.708
  550   2HB   LEU  10          2HB       LEU  10  -0.898   4.288   8.025
  551    HG   LEU  10           HG       LEU  10  -0.925   5.186  10.556
  552   1HD1  LEU  10          1HD1      LEU  10  -2.248   3.574  11.655
  553   2HD1  LEU  10          2HD1      LEU  10  -1.350   2.228  10.926
  554   3HD1  LEU  10          3HD1      LEU  10  -0.586   3.277  12.136
  555   1HD2  LEU  10          1HD2      LEU  10   0.841   2.893   9.593
  556   2HD2  LEU  10          2HD2      LEU  10   1.090   4.621   9.237
  557   3HD2  LEU  10          3HD2      LEU  10   1.240   4.035  10.896
  558    H    GLU  11           H        GLU  11  -4.486   3.665   7.473
  559    HA   GLU  11           HA       GLU  11  -4.399   4.784   4.870
  560   1HB   GLU  11          1HB       GLU  11  -6.170   3.076   6.496
  561   2HB   GLU  11          2HB       GLU  11  -7.085   3.888   5.332
  562   1HG   GLU  11          1HG       GLU  11  -4.560   2.232   4.773
  563   2HG   GLU  11          2HG       GLU  11  -6.192   1.596   4.743
  564    H    GLN  12           H        GLN  12  -6.257   6.040   7.748
  565    HA   GLN  12           HA       GLN  12  -7.272   8.226   6.125
  566   1HB   GLN  12          1HB       GLN  12  -7.561   7.400   9.006
  567   2HB   GLN  12          2HB       GLN  12  -8.214   8.919   8.365
  568   1HG   GLN  12          1HG       GLN  12  -9.394   7.678   6.584
  569   2HG   GLN  12          2HG       GLN  12  -8.835   6.160   7.259
  570   1HE2  GLN  12          2HE2      GLN  12  -9.375   5.985   9.807
  571   2HE2  GLN  12          1HE2      GLN  12 -11.007   6.492  10.215
  572    H    GLN  13           H        GLN  13  -4.557   7.853   8.280
  573    HA   GLN  13           HA       GLN  13  -4.024  10.710   8.575
  574   1HB   GLN  13          1HB       GLN  13  -2.282   8.234   8.901
  575   2HB   GLN  13          2HB       GLN  13  -1.641   9.873   9.049
  576   1HG   GLN  13          1HG       GLN  13  -3.273  10.395  10.829
  577   2HG   GLN  13          2HG       GLN  13  -3.935   8.763  10.725
  578   1HE2  GLN  13          2HE2      GLN  13  -0.660  10.332  11.133
  579   2HE2  GLN  13          1HE2      GLN  13  -0.168   9.199  12.382
  580    H    ALA  14           H        ALA  14  -3.204   8.330   6.038
  581    HA   ALA  14           HA       ALA  14  -1.592  10.209   4.491
  582   1HB   ALA  14          1HB       ALA  14  -1.501   7.754   4.137
  583   2HB   ALA  14          2HB       ALA  14  -3.215   7.747   3.660
  584   3HB   ALA  14          3HB       ALA  14  -2.013   8.596   2.662
  585    H    MET  15           H        MET  15  -5.085   9.397   4.659
  586    HA   MET  15           HA       MET  15  -5.913  11.106   2.491
  587   1HB   MET  15          1HB       MET  15  -7.319   9.326   3.353
  588   2HB   MET  15          2HB       MET  15  -7.396  10.059   4.943
  589   1HG   MET  15          1HG       MET  15  -9.052  11.446   4.431
  590   2HG   MET  15          2HG       MET  15  -8.352  11.909   2.882
  591   1HE   MET  15          1HE       MET  15  -8.919  11.102   0.692
  592   2HE   MET  15          2HE       MET  15  -7.972   9.683   1.161
  593   3HE   MET  15          3HE       MET  15  -9.535   9.475   0.327
  594    H    LYS  16           H        LYS  16  -5.729  11.812   6.038
  595    HA   LYS  16           HA       LYS  16  -6.539  14.560   5.806
  596   1HB   LYS  16          1HB       LYS  16  -5.054  12.899   7.839
  597   2HB   LYS  16          2HB       LYS  16  -4.960  14.648   7.996
  598   1HG   LYS  16          1HG       LYS  16  -7.631  13.213   7.722
  599   2HG   LYS  16          2HG       LYS  16  -6.836  13.466   9.283
  600   1HD   LYS  16          1HD       LYS  16  -6.877  15.899   8.994
  601   2HD   LYS  16          2HD       LYS  16  -7.505  15.741   7.358
  602   1HE   LYS  16          1HE       LYS  16  -9.319  16.369   8.763
  603   2HE   LYS  16          2HE       LYS  16  -9.584  14.707   8.229
  604   1HZ   LYS  16          1HZ       LYS  16  -8.803  13.953  10.412
  605   2HZ   LYS  16          2HZ       LYS  16  -8.502  15.490  10.891
  606   3HZ   LYS  16          3HZ       LYS  16 -10.032  15.005  10.611
  607    H    LEU  17           H        LEU  17  -3.271  13.110   5.605
  608    HA   LEU  17           HA       LEU  17  -1.928  15.559   5.023
  609   1HB   LEU  17          1HB       LEU  17  -1.334  12.716   5.000
  610   2HB   LEU  17          2HB       LEU  17  -0.729  13.392   3.519
  611    HG   LEU  17           HG       LEU  17  -0.154  14.473   6.312
  612   1HD1  LEU  17          1HD1      LEU  17   0.797  12.248   5.909
  613   2HD1  LEU  17          2HD1      LEU  17   1.600  12.832   4.437
  614   3HD1  LEU  17          3HD1      LEU  17   2.071  13.475   6.028
  615   1HD2  LEU  17          1HD2      LEU  17   1.128  15.182   3.630
  616   2HD2  LEU  17          2HD2      LEU  17   0.107  16.255   4.605
  617   3HD2  LEU  17          3HD2      LEU  17   1.682  15.744   5.219
  618    H    TYR  18           H        TYR  18  -3.611  13.293   2.842
  619    HA   TYR  18           HA       TYR  18  -2.956  14.603   0.416
  620   1HB   TYR  18          1HB       TYR  18  -4.842  12.483   1.297
  621   2HB   TYR  18          2HB       TYR  18  -5.269  13.288  -0.166
  622    HD1  TYR  18           1HD      TYR  18  -3.260  13.656  -1.893
  623    HD2  TYR  18           2HD      TYR  18  -3.535  10.519   1.032
  624    HE1  TYR  18           1HE      TYR  18  -1.546  12.333  -3.153
  625    HE2  TYR  18           2HE      TYR  18  -1.798   9.224  -0.181
  626    HH   TYR  18           HH       TYR  18  -0.342   9.189  -1.957
  627    H    ARG  19           H        ARG  19  -5.655  15.251   2.666
  628    HA   ARG  19           HA       ARG  19  -7.061  17.156   1.054
  629   1HB   ARG  19          1HB       ARG  19  -7.819  16.241   3.300
  630   2HB   ARG  19          2HB       ARG  19  -6.621  17.287   4.069
  631   1HG   ARG  19          1HG       ARG  19  -7.803  19.233   2.764
  632   2HG   ARG  19          2HG       ARG  19  -9.117  18.090   2.518
  633   1HD   ARG  19          1HD       ARG  19  -7.960  18.879   5.234
  634   2HD   ARG  19          2HD       ARG  19  -9.323  19.695   4.456
  635    HE   ARG  19           HE       ARG  19  -9.904  16.903   4.607
  636   1HH1  ARG  19          1HH2      ARG  19  -9.686  19.687   6.725
  637   2HH1  ARG  19          2HH2      ARG  19 -10.906  19.083   7.809
  638   1HH2  ARG  19          1HH1      ARG  19 -11.480  16.195   6.032
  639   2HH2  ARG  19          2HH1      ARG  19 -11.897  17.164   7.413
  640    H    GLU  20           H        GLU  20  -4.300  17.678   3.281
  641    HA   GLU  20           HA       GLU  20  -4.065  20.518   2.662
  642   1HB   GLU  20          1HB       GLU  20  -3.163  19.000   4.690
  643   2HB   GLU  20          2HB       GLU  20  -1.755  18.833   3.663
  644   1HG   GLU  20          1HG       GLU  20  -1.741  21.403   3.463
  645   2HG   GLU  20          2HG       GLU  20  -2.938  21.416   4.758
  646    H    ALA  21           H        ALA  21  -2.328  17.630   1.609
  647    HA   ALA  21           HA       ALA  21  -0.528  18.814  -0.207
  648   1HB   ALA  21          1HB       ALA  21  -0.549  16.402   0.437
  649   2HB   ALA  21          2HB       ALA  21  -1.970  16.175  -0.619
  650   3HB   ALA  21          3HB       ALA  21  -0.421  16.670  -1.314
  651    H    SER  22           H        SER  22  -4.030  18.174  -0.705
  652    HA   SER  22           HA       SER  22  -4.147  18.965  -3.446
  653   1HB   SER  22          1HB       SER  22  -5.937  17.810  -2.066
  654   2HB   SER  22          2HB       SER  22  -6.337  19.409  -1.406
  655    HG   SER  22           HG       SER  22  -7.598  18.843  -3.253
  656    H    GLU  23           H        GLU  23  -4.069  20.962  -0.471
  657    HA   GLU  23           HA       GLU  23  -4.666  23.475  -1.833
  658   1HB   GLU  23          1HB       GLU  23  -4.843  22.833   0.697
  659   2HB   GLU  23          2HB       GLU  23  -3.125  23.203   0.754
  660   1HG   GLU  23          1HG       GLU  23  -3.565  25.481  -0.126
  661   2HG   GLU  23          2HG       GLU  23  -5.289  25.115  -0.222
  662    H    LYS  24           H        LYS  24  -1.706  21.782  -0.846
  663    HA   LYS  24           HA       LYS  24   0.171  23.726  -1.955
  664   1HB   LYS  24          1HB       LYS  24   0.411  20.783  -1.214
  665   2HB   LYS  24          2HB       LYS  24   1.705  21.645  -2.036
  666   1HG   LYS  24          1HG       LYS  24   2.230  21.652   0.261
  667   2HG   LYS  24          2HG       LYS  24   1.832  23.299  -0.222
  668   1HD   LYS  24          1HD       LYS  24  -0.420  23.041   0.828
  669   2HD   LYS  24          2HD       LYS  24   0.017  21.407   1.354
  670   1HE   LYS  24          1HE       LYS  24   1.654  23.873   2.071
  671   2HE   LYS  24          2HE       LYS  24   0.238  23.404   3.013
  672   1HZ   LYS  24          1HZ       LYS  24   1.256  21.388   3.652
  673   2HZ   LYS  24          2HZ       LYS  24   2.500  21.538   2.573
  674   3HZ   LYS  24          3HZ       LYS  24   2.388  22.524   3.871
  675    H    ALA  25           H        ALA  25  -1.295  20.802  -3.308
  676    HA   ALA  25           HA       ALA  25  -0.298  21.135  -5.999
  677   1HB   ALA  25          1HB       ALA  25  -0.751  18.927  -5.000
  678   2HB   ALA  25          2HB       ALA  25  -2.468  19.359  -4.805
  679   3HB   ALA  25          3HB       ALA  25  -1.793  19.180  -6.410
  680    H    ARG  26           H        ARG  26  -1.713  23.550  -5.138
  681    HA   ARG  26           HA       ARG  26  -4.348  23.773  -6.125
  682   1HB   ARG  26          1HB       ARG  26  -3.934  26.157  -6.045
  683   2HB   ARG  26          2HB       ARG  26  -3.179  25.367  -4.679
  684   1HG   ARG  26          1HG       ARG  26  -1.059  25.362  -6.473
  685   2HG   ARG  26          2HG       ARG  26  -1.937  26.807  -6.988
  686   1HD   ARG  26          1HD       ARG  26  -1.899  27.544  -4.560
  687   2HD   ARG  26          2HD       ARG  26  -0.861  26.154  -4.212
  688    HE   ARG  26           HE       ARG  26   0.283  27.603  -6.385
  689   1HH1  ARG  26          1HH2      ARG  26  -0.161  28.049  -2.941
  690   2HH1  ARG  26          2HH2      ARG  26   1.238  29.081  -2.803
  691   1HH2  ARG  26          1HH1      ARG  26   2.052  28.920  -6.142
  692   2HH2  ARG  26          2HH1      ARG  26   2.455  29.554  -4.575
  693    H    ASN  27           H        ASN  27  -1.461  23.457  -8.001
  694    HA   ASN  27           HA       ASN  27  -2.382  24.530 -10.504
  695   1HB   ASN  27          1HB       ASN  27  -0.007  24.113  -9.930
  696   2HB   ASN  27          2HB       ASN  27  -0.314  22.378  -9.843
  697   1HD2  ASN  27          2HD2      ASN  27   0.680  24.903 -11.918
  698   2HD2  ASN  27          1HD2      ASN  27   0.507  24.001 -13.417
  699    HA   PRO  28           HA       PRO  28  -5.495  21.505 -11.265
  700   1HB   PRO  28          1HB       PRO  28  -5.976  21.765 -13.954
  701   2HB   PRO  28          2HB       PRO  28  -6.415  23.000 -12.735
  702   1HG   PRO  28          1HG       PRO  28  -3.924  22.903 -14.468
  703   2HG   PRO  28          2HG       PRO  28  -5.044  24.283 -14.220
  704   1HD   PRO  28          1HD       PRO  28  -2.742  24.066 -12.818
  705   2HD   PRO  28          2HD       PRO  28  -4.235  24.655 -12.023
  706    H    GLU  29           H        GLU  29  -2.404  21.094 -12.831
  707    HA   GLU  29           HA       GLU  29  -2.920  18.500 -14.066
  708   1HB   GLU  29          1HB       GLU  29  -0.999  20.029 -14.674
  709   2HB   GLU  29          2HB       GLU  29  -0.292  19.691 -13.103
  710   1HG   GLU  29          1HG       GLU  29  -0.743  17.120 -14.087
  711   2HG   GLU  29          2HG       GLU  29  -0.388  18.016 -15.552
  712    H    LYS  30           H        LYS  30  -1.165  19.475 -11.179
  713    HA   LYS  30           HA       LYS  30  -1.003  16.876  -9.947
  714   1HB   LYS  30          1HB       LYS  30  -0.905  19.651  -8.679
  715   2HB   LYS  30          2HB       LYS  30  -0.501  18.141  -7.849
  716   1HG   LYS  30          1HG       LYS  30   0.985  19.196 -10.281
  717   2HG   LYS  30          2HG       LYS  30   1.480  19.425  -8.601
  718   1HD   LYS  30          1HD       LYS  30   1.587  16.953  -8.292
  719   2HD   LYS  30          2HD       LYS  30   1.198  16.723  -9.999
  720   1HE   LYS  30          1HE       LYS  30   3.664  18.130  -8.888
  721   2HE   LYS  30          2HE       LYS  30   3.598  16.492  -9.548
  722   1HZ   LYS  30          1HZ       LYS  30   2.773  17.587 -11.681
  723   2HZ   LYS  30          2HZ       LYS  30   3.204  19.017 -11.044
  724   3HZ   LYS  30          3HZ       LYS  30   4.345  17.880 -11.297
  725    H    LYS  31           H        LYS  31  -3.404  19.485  -9.518
  726    HA   LYS  31           HA       LYS  31  -5.111  18.033  -7.763
  727   1HB   LYS  31          1HB       LYS  31  -5.030  20.562  -8.379
  728   2HB   LYS  31          2HB       LYS  31  -6.171  20.129  -9.655
  729   1HG   LYS  31          1HG       LYS  31  -7.781  19.338  -8.019
  730   2HG   LYS  31          2HG       LYS  31  -6.575  19.392  -6.720
  731   1HD   LYS  31          1HD       LYS  31  -6.470  21.848  -6.891
  732   2HD   LYS  31          2HD       LYS  31  -7.677  21.816  -8.200
  733   1HE   LYS  31          1HE       LYS  31  -9.309  20.746  -6.678
  734   2HE   LYS  31          2HE       LYS  31  -8.104  20.710  -5.384
  735   1HZ   LYS  31          1HZ       LYS  31  -8.092  23.139  -5.402
  736   2HZ   LYS  31          2HZ       LYS  31  -9.183  23.190  -6.622
  737   3HZ   LYS  31          3HZ       LYS  31  -9.614  22.606  -5.161
  738    H    SER  32           H        SER  32  -4.488  17.203 -10.956
  739    HA   SER  32           HA       SER  32  -6.930  15.479 -10.986
  740   1HB   SER  32          1HB       SER  32  -5.289  16.373 -13.395
  741   2HB   SER  32          2HB       SER  32  -6.781  15.418 -13.415
  742    HG   SER  32           HG       SER  32  -6.396  18.144 -12.784
  743    H    VAL  33           H        VAL  33  -3.883  15.267 -10.065
  744    HA   VAL  33           HA       VAL  33  -3.598  12.406 -10.946
  745    HB   VAL  33           HB       VAL  33  -1.478  14.410 -10.092
  746   1HG1  VAL  33          1HG1      VAL  33  -0.874  12.256  -9.090
  747   2HG1  VAL  33          2HG1      VAL  33  -1.194  11.419 -10.628
  748   3HG1  VAL  33          3HG1      VAL  33   0.155  12.565 -10.486
  749   1HG2  VAL  33          1HG2      VAL  33  -1.828  12.795 -12.660
  750   2HG2  VAL  33          2HG2      VAL  33  -2.194  14.520 -12.487
  751   3HG2  VAL  33          3HG2      VAL  33  -0.529  13.958 -12.312
  752    H    LEU  34           H        LEU  34  -3.256  14.639  -8.033
  753    HA   LEU  34           HA       LEU  34  -3.233  12.327  -6.278
  754   1HB   LEU  34          1HB       LEU  34  -2.621  13.685  -4.708
  755   2HB   LEU  34          2HB       LEU  34  -2.158  14.744  -6.024
  756    HG   LEU  34           HG       LEU  34  -4.775  14.837  -4.553
  757   1HD1  LEU  34          1HD1      LEU  34  -2.716  15.352  -3.111
  758   2HD1  LEU  34          2HD1      LEU  34  -2.434  16.746  -4.155
  759   3HD1  LEU  34          3HD1      LEU  34  -3.932  16.628  -3.197
  760   1HD2  LEU  34          1HD2      LEU  34  -3.523  17.004  -6.247
  761   2HD2  LEU  34          2HD2      LEU  34  -4.894  15.979  -6.733
  762   3HD2  LEU  34          3HD2      LEU  34  -5.068  17.105  -5.380
  763    H    GLN  35           H        GLN  35  -5.761  14.126  -7.887
  764    HA   GLN  35           HA       GLN  35  -7.870  13.561  -6.033
  765   1HB   GLN  35          1HB       GLN  35  -7.956  15.303  -7.721
  766   2HB   GLN  35          2HB       GLN  35  -7.999  14.094  -9.019
  767   1HG   GLN  35          1HG       GLN  35 -10.175  13.278  -8.201
  768   2HG   GLN  35          2HG       GLN  35 -10.072  14.328  -6.785
  769   1HE2  GLN  35          2HE2      GLN  35 -10.715  14.247 -10.287
  770   2HE2  GLN  35          1HE2      GLN  35 -11.332  15.891 -10.351
  771    H    LYS  36           H        LYS  36  -6.429  11.600  -8.647
  772    HA   LYS  36           HA       LYS  36  -8.515   9.555  -8.575
  773   1HB   LYS  36          1HB       LYS  36  -5.612   9.432  -9.559
  774   2HB   LYS  36          2HB       LYS  36  -6.830   8.175  -9.807
  775   1HG   LYS  36          1HG       LYS  36  -8.222   9.779 -11.113
  776   2HG   LYS  36          2HG       LYS  36  -7.005  11.031 -10.866
  777   1HD   LYS  36          1HD       LYS  36  -6.692  10.118 -13.073
  778   2HD   LYS  36          2HD       LYS  36  -5.322   9.682 -12.062
  779   1HE   LYS  36          1HE       LYS  36  -5.869   7.779 -13.400
  780   2HE   LYS  36          2HE       LYS  36  -6.298   7.397 -11.736
  781   1HZ   LYS  36          1HZ       LYS  36  -8.633   7.885 -12.311
  782   2HZ   LYS  36          2HZ       LYS  36  -8.213   8.266 -13.845
  783   3HZ   LYS  36          3HZ       LYS  36  -8.043   6.738 -13.308
  784    H    ILE  37           H        ILE  37  -5.371   9.898  -6.968
  785    HA   ILE  37           HA       ILE  37  -5.543   7.450  -5.403
  786    HB   ILE  37           HB       ILE  37  -4.165  10.114  -4.865
  787   1HG1  ILE  37          1HG1      ILE  37  -2.989   7.612  -6.048
  788   2HG1  ILE  37          2HG1      ILE  37  -3.304   9.154  -6.858
  789   1HG2  ILE  37          1HG2      ILE  37  -4.440   8.964  -2.733
  790   2HG2  ILE  37          2HG2      ILE  37  -3.907   7.428  -3.450
  791   3HG2  ILE  37          3HG2      ILE  37  -2.770   8.757  -3.207
  792   1HD1  ILE  37          1HD1      ILE  37  -1.656  10.244  -5.295
  793   2HD1  ILE  37          2HD1      ILE  37  -1.192   8.604  -4.761
  794   3HD1  ILE  37          3HD1      ILE  37  -0.978   9.076  -6.446
  795    H    LEU  38           H        LEU  38  -6.543  10.872  -4.635
  796    HA   LEU  38           HA       LEU  38  -7.728  10.361  -2.142
  797   1HB   LEU  38          1HB       LEU  38  -8.299  12.307  -4.373
  798   2HB   LEU  38          2HB       LEU  38  -9.400  12.243  -3.025
  799    HG   LEU  38           HG       LEU  38  -6.414  12.721  -2.649
  800   1HD1  LEU  38          1HD1      LEU  38  -7.358  14.530  -4.029
  801   2HD1  LEU  38          2HD1      LEU  38  -8.681  14.750  -2.861
  802   3HD1  LEU  38          3HD1      LEU  38  -7.000  15.105  -2.400
  803   1HD2  LEU  38          1HD2      LEU  38  -8.895  12.979  -0.893
  804   2HD2  LEU  38          2HD2      LEU  38  -7.417  12.024  -0.601
  805   3HD2  LEU  38          3HD2      LEU  38  -7.381  13.790  -0.498
  806    H    GLU  39           H        GLU  39  -9.318   9.938  -5.385
  807    HA   GLU  39           HA       GLU  39 -11.781   9.079  -4.176
  808   1HB   GLU  39          1HB       GLU  39 -11.522  10.043  -6.490
  809   2HB   GLU  39          2HB       GLU  39 -10.707   8.557  -6.993
  810   1HG   GLU  39          1HG       GLU  39 -12.771   7.264  -6.484
  811   2HG   GLU  39          2HG       GLU  39 -13.568   8.744  -5.946
  812    H    ASP  40           H        ASP  40  -8.985   7.214  -5.379
  813    HA   ASP  40           HA       ASP  40 -10.021   4.596  -4.900
  814   1HB   ASP  40          1HB       ASP  40  -7.338   5.989  -5.155
  815   2HB   ASP  40          2HB       ASP  40  -7.374   4.379  -4.620
  816    H    GLU  41           H        GLU  41  -8.445   6.995  -2.730
  817    HA   GLU  41           HA       GLU  41  -8.192   5.014  -0.560
  818   1HB   GLU  41          1HB       GLU  41  -7.965   8.041  -0.482
  819   2HB   GLU  41          2HB       GLU  41  -7.686   6.977   0.890
  820   1HG   GLU  41          1HG       GLU  41  -5.930   7.434  -1.522
  821   2HG   GLU  41          2HG       GLU  41  -5.572   7.675   0.160
  822    H    GLU  42           H        GLU  42 -10.514   7.586  -1.414
  823    HA   GLU  42           HA       GLU  42 -12.240   7.227   0.831
  824   1HB   GLU  42          1HB       GLU  42 -12.216   9.062  -0.927
  825   2HB   GLU  42          2HB       GLU  42 -13.103   7.982  -1.989
  826   1HG   GLU  42          1HG       GLU  42 -14.004   8.805   0.813
  827   2HG   GLU  42          2HG       GLU  42 -14.395   9.730  -0.627
  828    H    LYS  43           H        LYS  43 -12.040   5.463  -2.268
  829    HA   LYS  43           HA       LYS  43 -14.181   3.622  -1.866
  830   1HB   LYS  43          1HB       LYS  43 -12.110   4.010  -3.780
  831   2HB   LYS  43          2HB       LYS  43 -11.835   2.413  -3.163
  832   1HG   LYS  43          1HG       LYS  43 -13.232   2.119  -5.011
  833   2HG   LYS  43          2HG       LYS  43 -14.353   1.982  -3.646
  834   1HD   LYS  43          1HD       LYS  43 -15.074   4.331  -4.003
  835   2HD   LYS  43          2HD       LYS  43 -13.861   4.518  -5.289
  836   1HE   LYS  43          1HE       LYS  43 -14.972   2.655  -6.553
  837   2HE   LYS  43          2HE       LYS  43 -16.229   2.594  -5.311
  838   1HZ   LYS  43          1HZ       LYS  43 -16.783   4.908  -5.870
  839   2HZ   LYS  43          2HZ       LYS  43 -15.622   4.950  -7.023
  840   3HZ   LYS  43          3HZ       LYS  43 -16.909   3.965  -7.196
  841    H    HIS  44           H        HIS  44 -10.678   3.284  -0.794
  842    HA   HIS  44           HA       HIS  44 -10.969   0.764   0.361
  843   1HB   HIS  44          1HB       HIS  44  -9.176   3.124   1.108
  844   2HB   HIS  44          2HB       HIS  44  -8.961   1.453   1.517
  845    HD2  HIS  44           2HD      HIS  44  -9.945   0.940  -1.822
  846    HE1  HIS  44           1HE      HIS  44  -5.913   2.084  -2.420
  847    HE2  HIS  44           2HE      HIS  44  -8.001   1.145  -3.522
  848    H    ILE  45           H        ILE  45 -11.502   4.019   1.768
  849    HA   ILE  45           HA       ILE  45 -12.023   3.097   4.433
  850    HB   ILE  45           HB       ILE  45 -12.347   5.667   2.895
  851   1HG1  ILE  45          1HG1      ILE  45 -11.197   6.512   5.042
  852   2HG1  ILE  45          2HG1      ILE  45 -11.054   4.826   5.523
  853   1HG2  ILE  45          1HG2      ILE  45 -14.500   5.607   4.021
  854   2HG2  ILE  45          2HG2      ILE  45 -13.713   5.195   5.568
  855   3HG2  ILE  45          3HG2      ILE  45 -13.446   6.778   4.802
  856   1HD1  ILE  45          1HD1      ILE  45  -9.638   4.407   3.499
  857   2HD1  ILE  45          2HD1      ILE  45  -9.763   6.152   3.126
  858   3HD1  ILE  45          3HD1      ILE  45  -8.969   5.613   4.608
  859    H    GLU  46           H        GLU  46 -14.308   3.482   1.603
  860    HA   GLU  46           HA       GLU  46 -16.658   2.875   3.086
  861   1HB   GLU  46          1HB       GLU  46 -15.888   2.178   0.215
  862   2HB   GLU  46          2HB       GLU  46 -17.451   1.885   0.937
  863   1HG   GLU  46          1HG       GLU  46 -17.610   4.346   1.451
  864   2HG   GLU  46          2HG       GLU  46 -16.183   4.567   0.424
  865    H    TRP  47           H        TRP  47 -14.283   0.670   1.537
  866    HA   TRP  47           HA       TRP  47 -15.719  -1.705   2.261
  867   1HB   TRP  47          1HB       TRP  47 -12.778  -1.415   1.591
  868   2HB   TRP  47          2HB       TRP  47 -13.784  -2.830   1.400
  869    HD1  TRP  47           1HD      TRP  47 -16.138  -0.895  -0.153
  870    HE1  TRP  47           1HE      TRP  47 -15.625  -0.139  -2.583
  871    HE3  TRP  47           3HE      TRP  47 -11.179  -1.982  -0.334
  872    HZ2  TRP  47           2HZ      TRP  47 -13.406  -0.311  -4.446
  873    HZ3  TRP  47           3HZ      TRP  47  -9.850  -1.723  -2.429
  874    HH2  TRP  47           2HH      TRP  47 -10.968  -0.864  -4.493
  875    H    LEU  48           H        LEU  48 -12.927  -0.030   3.697
  876    HA   LEU  48           HA       LEU  48 -12.425  -1.775   5.889
  877   1HB   LEU  48          1HB       LEU  48 -12.065   1.182   5.302
  878   2HB   LEU  48          2HB       LEU  48 -11.620   0.594   6.862
  879    HG   LEU  48           HG       LEU  48 -10.492  -0.563   4.286
  880   1HD1  LEU  48          1HD1      LEU  48  -9.859   1.809   4.499
  881   2HD1  LEU  48          2HD1      LEU  48  -9.305   1.526   6.160
  882   3HD1  LEU  48          3HD1      LEU  48  -8.464   0.759   4.789
  883   1HD2  LEU  48          1HD2      LEU  48  -9.531  -0.770   7.178
  884   2HD2  LEU  48          2HD2      LEU  48 -10.298  -2.075   6.248
  885   3HD2  LEU  48          3HD2      LEU  48  -8.725  -1.456   5.750
  886    H    GLU  49           H        GLU  49 -14.665   1.019   5.696
  887    HA   GLU  49           HA       GLU  49 -15.790   0.653   8.323
  888   1HB   GLU  49          1HB       GLU  49 -16.120   2.604   6.590
  889   2HB   GLU  49          2HB       GLU  49 -17.383   1.608   5.904
  890   1HG   GLU  49          1HG       GLU  49 -18.498   1.504   8.151
  891   2HG   GLU  49          2HG       GLU  49 -17.241   2.554   8.801
  892    H    THR  50           H        THR  50 -16.719  -0.650   5.137
  893    HA   THR  50           HA       THR  50 -18.983  -2.148   6.051
  894    HB   THR  50           HB       THR  50 -17.208  -2.178   3.648
  895    HG1  THR  50           1HG      THR  50 -19.119  -1.594   2.703
  896   1HG2  THR  50          1HG2      THR  50 -17.595  -4.544   3.849
  897   2HG2  THR  50          2HG2      THR  50 -19.340  -4.265   4.124
  898   3HG2  THR  50          3HG2      THR  50 -18.589  -3.871   2.551
  899    H    ILE  51           H        ILE  51 -15.603  -2.949   6.216
  900    HA   ILE  51           HA       ILE  51 -16.165  -5.663   7.222
  901    HB   ILE  51           HB       ILE  51 -13.619  -4.197   6.452
  902   1HG1  ILE  51          1HG1      ILE  51 -14.905  -4.912   4.514
  903   2HG1  ILE  51          2HG1      ILE  51 -13.463  -5.887   4.657
  904   1HG2  ILE  51          1HG2      ILE  51 -12.910  -5.654   8.226
  905   2HG2  ILE  51          2HG2      ILE  51 -13.838  -7.019   7.575
  906   3HG2  ILE  51          3HG2      ILE  51 -12.419  -6.388   6.702
  907   1HD1  ILE  51          1HD1      ILE  51 -14.911  -7.740   5.627
  908   2HD1  ILE  51          2HD1      ILE  51 -16.327  -6.719   5.293
  909   3HD1  ILE  51          3HD1      ILE  51 -15.305  -7.276   3.965
  910    H    ASN  52           H        ASN  52 -15.528  -2.646   8.573
  911    HA   ASN  52           HA       ASN  52 -14.668  -3.690  11.189
  912   1HB   ASN  52          1HB       ASN  52 -13.736  -1.586  10.261
  913   2HB   ASN  52          2HB       ASN  52 -15.340  -0.851  10.348
  914   1HD2  ASN  52          2HD2      ASN  52 -14.525   0.785  11.815
  915   2HD2  ASN  52          1HD2      ASN  52 -14.155   0.367  13.479
  916    H    GLY  53           H        GLY  53 -16.763  -5.064  10.983
  917   1HA   GLY  53          1HA       GLY  53 -18.633  -4.144  13.031
  918   2HA   GLY  53          2HA       GLY  53 -19.375  -4.261  11.437
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1   8.305  21.261  -5.001
    2   2H    MET   1          2H        MET   1   8.210  19.676  -4.586
    3   3H    MET   1          3H        MET   1   9.628  20.475  -4.435
    4    HA   MET   1           HA       MET   1   8.768  21.877  -2.703
    5   1HB   MET   1          1HB       MET   1   6.181  20.507  -3.450
    6   2HB   MET   1          2HB       MET   1   6.449  20.924  -1.760
    7   1HG   MET   1          1HG       MET   1   5.248  22.697  -2.818
    8   2HG   MET   1          2HG       MET   1   6.843  23.260  -2.329
    9   1HE   MET   1          1HE       MET   1   6.523  25.444  -3.713
   10   2HE   MET   1          2HE       MET   1   6.044  25.484  -5.425
   11   3HE   MET   1          3HE       MET   1   4.904  24.889  -4.198
   12    H    ASP   2           H        ASP   2   9.119  21.314  -0.574
   13    HA   ASP   2           HA       ASP   2  10.197  18.672  -0.026
   14   1HB   ASP   2          1HB       ASP   2  11.211  20.776   0.774
   15   2HB   ASP   2          2HB       ASP   2   9.780  21.106   1.749
   16    H    TYR   3           H        TYR   3   7.890  17.863  -0.667
   17    HA   TYR   3           HA       TYR   3   6.516  17.090   1.827
   18   1HB   TYR   3          1HB       TYR   3   4.392  17.801   1.257
   19   2HB   TYR   3          2HB       TYR   3   5.385  19.166   0.804
   20    HD1  TYR   3           1HD      TYR   3   2.481  18.236  -0.047
   21    HD2  TYR   3           2HD      TYR   3   6.326  18.095  -1.991
   22    HE1  TYR   3           1HE      TYR   3   1.382  18.270  -2.294
   23    HE2  TYR   3           2HE      TYR   3   5.226  18.034  -4.195
   24    HH   TYR   3           HH       TYR   3   3.249  18.046  -5.331
   25    H    LEU   4           H        LEU   4   7.301  16.300  -1.349
   26    HA   LEU   4           HA       LEU   4   5.348  14.368  -1.912
   27   1HB   LEU   4          1HB       LEU   4   6.653  13.759  -3.834
   28   2HB   LEU   4          2HB       LEU   4   6.623  15.494  -3.587
   29    HG   LEU   4           HG       LEU   4   8.934  14.966  -2.303
   30   1HD1  LEU   4          1HD1      LEU   4   8.885  12.501  -2.777
   31   2HD1  LEU   4          2HD1      LEU   4   8.825  12.864  -4.508
   32   3HD1  LEU   4          3HD1      LEU   4  10.255  13.301  -3.549
   33   1HD2  LEU   4          1HD2      LEU   4   8.655  15.204  -5.326
   34   2HD2  LEU   4          2HD2      LEU   4   8.669  16.550  -4.161
   35   3HD2  LEU   4          3HD2      LEU   4  10.121  15.564  -4.384
   36    H    ARG   5           H        ARG   5   8.420  13.933  -0.257
   37    HA   ARG   5           HA       ARG   5   8.412  11.021  -0.282
   38   1HB   ARG   5          1HB       ARG   5  10.338  12.878   0.110
   39   2HB   ARG   5          2HB       ARG   5   9.923  12.599   1.804
   40   1HG   ARG   5          1HG       ARG   5  10.354  10.138   1.439
   41   2HG   ARG   5          2HG       ARG   5  10.761  10.501  -0.250
   42   1HD   ARG   5          1HD       ARG   5  12.513  12.165   0.729
   43   2HD   ARG   5          2HD       ARG   5  12.238  11.353   2.265
   44    HE   ARG   5           HE       ARG   5  13.269   9.393   1.449
   45   1HH1  ARG   5          1HH2      ARG   5  13.186  11.778  -1.126
   46   2HH1  ARG   5          2HH2      ARG   5  14.347  10.907  -2.089
   47   1HH2  ARG   5          1HH1      ARG   5  14.737   8.337   0.157
   48   2HH2  ARG   5          2HH1      ARG   5  15.186   9.011  -1.381
   49    H    GLU   6           H        GLU   6   7.189  13.475   1.909
   50    HA   GLU   6           HA       GLU   6   6.527  11.787   4.130
   51   1HB   GLU   6          1HB       GLU   6   6.631  14.416   3.919
   52   2HB   GLU   6          2HB       GLU   6   4.986  14.274   3.314
   53   1HG   GLU   6          1HG       GLU   6   4.713  14.693   5.593
   54   2HG   GLU   6          2HG       GLU   6   4.462  12.956   5.477
   55    H    LEU   7           H        LEU   7   4.742  12.746   1.210
   56    HA   LEU   7           HA       LEU   7   2.253  11.469   1.762
   57   1HB   LEU   7          1HB       LEU   7   3.628  11.857  -0.946
   58   2HB   LEU   7          2HB       LEU   7   1.925  11.524  -0.687
   59    HG   LEU   7           HG       LEU   7   3.463  14.049  -0.085
   60   1HD1  LEU   7          1HD1      LEU   7   2.629  13.687  -2.384
   61   2HD1  LEU   7          2HD1      LEU   7   0.977  13.526  -1.748
   62   3HD1  LEU   7          3HD1      LEU   7   1.850  15.068  -1.592
   63   1HD2  LEU   7          1HD2      LEU   7   0.588  13.490   0.726
   64   2HD2  LEU   7          2HD2      LEU   7   1.968  13.708   1.835
   65   3HD2  LEU   7          3HD2      LEU   7   1.450  15.050   0.828
   66    H    TYR   8           H        TYR   8   4.992  10.230  -0.099
   67    HA   TYR   8           HA       TYR   8   4.125   7.583  -0.654
   68   1HB   TYR   8          1HB       TYR   8   6.292   9.314  -1.153
   69   2HB   TYR   8          2HB       TYR   8   7.053   8.185  -0.109
   70    HD1  TYR   8           1HD      TYR   8   7.435   8.994  -3.139
   71    HD2  TYR   8           2HD      TYR   8   5.769   5.563  -1.118
   72    HE1  TYR   8           1HE      TYR   8   8.146   7.532  -5.025
   73    HE2  TYR   8           2HE      TYR   8   6.555   4.103  -2.974
   74    HH   TYR   8           HH       TYR   8   8.280   5.385  -5.821
   75    H    LYS   9           H        LYS   9   6.027   8.751   2.175
   76    HA   LYS   9           HA       LYS   9   6.543   6.097   3.087
   77   1HB   LYS   9          1HB       LYS   9   7.869   8.116   3.810
   78   2HB   LYS   9          2HB       LYS   9   6.477   8.677   4.732
   79   1HG   LYS   9          1HG       LYS   9   7.970   7.679   6.290
   80   2HG   LYS   9          2HG       LYS   9   6.622   6.562   6.128
   81   1HD   LYS   9          1HD       LYS   9   8.101   5.300   4.396
   82   2HD   LYS   9          2HD       LYS   9   9.430   6.307   4.965
   83   1HE   LYS   9          1HE       LYS   9   7.732   4.384   6.629
   84   2HE   LYS   9          2HE       LYS   9   9.364   4.076   6.036
   85   1HZ   LYS   9          1HZ       LYS   9  10.150   5.929   7.423
   86   2HZ   LYS   9          2HZ       LYS   9   8.642   6.179   8.008
   87   3HZ   LYS   9          3HZ       LYS   9   9.426   4.787   8.333
   88    H    LEU  10           H        LEU  10   4.091   8.293   4.509
   89    HA   LEU  10           HA       LEU  10   2.833   6.279   5.959
   90   1HB   LEU  10          1HB       LEU  10   1.812   8.931   4.876
   91   2HB   LEU  10          2HB       LEU  10   0.866   7.865   5.917
   92    HG   LEU  10           HG       LEU  10   3.165   7.896   7.353
   93   1HD1  LEU  10          1HD1      LEU  10   4.451   9.427   6.044
   94   2HD1  LEU  10          2HD1      LEU  10   3.138  10.608   6.040
   95   3HD1  LEU  10          3HD1      LEU  10   3.997  10.227   7.544
   96   1HD2  LEU  10          1HD2      LEU  10   1.015  10.050   7.496
   97   2HD2  LEU  10          2HD2      LEU  10   0.917   8.424   8.216
   98   3HD2  LEU  10          3HD2      LEU  10   2.112   9.581   8.816
   99    H    GLU  11           H        GLU  11   2.372   7.138   2.548
  100    HA   GLU  11           HA       GLU  11   0.311   5.259   1.944
  101   1HB   GLU  11          1HB       GLU  11   2.426   6.799   0.540
  102   2HB   GLU  11          2HB       GLU  11   1.989   5.442  -0.356
  103   1HG   GLU  11          1HG       GLU  11   0.028   7.528   0.769
  104   2HG   GLU  11          2HG       GLU  11   0.717   7.578  -0.846
  105    H    GLN  12           H        GLN  12   3.916   4.641   2.208
  106    HA   GLN  12           HA       GLN  12   3.438   1.817   1.703
  107   1HB   GLN  12          1HB       GLN  12   5.864   3.481   2.363
  108   2HB   GLN  12          2HB       GLN  12   5.906   1.715   2.210
  109   1HG   GLN  12          1HG       GLN  12   4.915   1.859  -0.047
  110   2HG   GLN  12          2HG       GLN  12   4.906   3.609   0.052
  111   1HE2  GLN  12          2HE2      GLN  12   7.240   4.566   0.654
  112   2HE2  GLN  12          1HE2      GLN  12   8.560   3.819  -0.235
  113    H    GLN  13           H        GLN  13   3.532   3.713   4.599
  114    HA   GLN  13           HA       GLN  13   3.991   1.529   6.463
  115   1HB   GLN  13          1HB       GLN  13   2.412   4.141   6.682
  116   2HB   GLN  13          2HB       GLN  13   2.613   3.044   8.034
  117   1HG   GLN  13          1HG       GLN  13   5.115   4.005   6.644
  118   2HG   GLN  13          2HG       GLN  13   4.227   5.135   7.662
  119   1HE2  GLN  13          2HE2      GLN  13   4.105   4.758   9.966
  120   2HE2  GLN  13          1HE2      GLN  13   5.153   3.570  10.723
  121    H    ALA  14           H        ALA  14   1.027   2.641   4.782
  122    HA   ALA  14           HA       ALA  14  -0.689   0.702   6.124
  123   1HB   ALA  14          1HB       ALA  14  -1.565   2.716   4.958
  124   2HB   ALA  14          2HB       ALA  14  -0.951   2.092   3.408
  125   3HB   ALA  14          3HB       ALA  14  -2.234   1.222   4.278
  126    H    MET  15           H        MET  15   1.362   0.664   3.197
  127    HA   MET  15           HA       MET  15   0.557  -1.970   2.277
  128   1HB   MET  15          1HB       MET  15   3.159  -0.463   1.746
  129   2HB   MET  15          2HB       MET  15   2.610  -1.903   0.922
  130   1HG   MET  15          1HG       MET  15   0.423  -0.159   0.675
  131   2HG   MET  15          2HG       MET  15   1.818   0.900   0.527
  132   1HE   MET  15          1HE       MET  15  -0.185  -2.024  -0.742
  133   2HE   MET  15          2HE       MET  15   0.629  -2.589  -2.219
  134   3HE   MET  15          3HE       MET  15   1.348  -2.907  -0.625
  135    H    LYS  16           H        LYS  16   3.257  -0.963   4.442
  136    HA   LYS  16           HA       LYS  16   4.243  -3.643   4.863
  137   1HB   LYS  16          1HB       LYS  16   4.318  -1.018   6.407
  138   2HB   LYS  16          2HB       LYS  16   4.962  -2.475   7.143
  139   1HG   LYS  16          1HG       LYS  16   5.871  -1.582   4.377
  140   2HG   LYS  16          2HG       LYS  16   6.585  -0.893   5.830
  141   1HD   LYS  16          1HD       LYS  16   6.521  -3.896   5.295
  142   2HD   LYS  16          2HD       LYS  16   7.849  -2.836   4.799
  143   1HE   LYS  16          1HE       LYS  16   8.222  -2.138   7.132
  144   2HE   LYS  16          2HE       LYS  16   6.880  -3.148   7.678
  145   1HZ   LYS  16          1HZ       LYS  16   8.108  -5.101   6.920
  146   2HZ   LYS  16          2HZ       LYS  16   9.345  -4.178   6.377
  147   3HZ   LYS  16          3HZ       LYS  16   9.022  -4.256   7.974
  148    H    LEU  17           H        LEU  17   1.818  -1.730   6.676
  149    HA   LEU  17           HA       LEU  17   1.104  -3.819   8.461
  150   1HB   LEU  17          1HB       LEU  17   0.137  -1.187   7.754
  151   2HB   LEU  17          2HB       LEU  17  -1.247  -2.244   7.799
  152    HG   LEU  17           HG       LEU  17   0.855  -2.035  10.003
  153   1HD1  LEU  17          1HD1      LEU  17  -0.367   0.072   9.742
  154   2HD1  LEU  17          2HD1      LEU  17  -1.920  -0.791   9.852
  155   3HD1  LEU  17          3HD1      LEU  17  -0.821  -0.734  11.250
  156   1HD2  LEU  17          1HD2      LEU  17  -1.924  -3.307  10.024
  157   2HD2  LEU  17          2HD2      LEU  17  -0.387  -4.194  10.054
  158   3HD2  LEU  17          3HD2      LEU  17  -0.831  -3.164  11.416
  159    H    TYR  18           H        TYR  18  -0.255  -3.099   5.241
  160    HA   TYR  18           HA       TYR  18  -2.165  -5.146   5.063
  161   1HB   TYR  18          1HB       TYR  18  -0.572  -3.499   3.113
  162   2HB   TYR  18          2HB       TYR  18  -1.459  -4.836   2.500
  163    HD1  TYR  18           1HD      TYR  18  -3.998  -4.959   3.656
  164    HD2  TYR  18           2HD      TYR  18  -1.704  -1.463   2.650
  165    HE1  TYR  18           1HE      TYR  18  -6.072  -3.577   3.700
  166    HE2  TYR  18           2HE      TYR  18  -3.754  -0.068   2.785
  167    HH   TYR  18           HH       TYR  18  -5.981  -0.023   3.362
  168    H    ARG  19           H        ARG  19   1.356  -5.300   4.204
  169    HA   ARG  19           HA       ARG  19   1.161  -7.912   3.059
  170   1HB   ARG  19          1HB       ARG  19   3.124  -6.000   3.194
  171   2HB   ARG  19          2HB       ARG  19   3.763  -7.176   4.345
  172   1HG   ARG  19          1HG       ARG  19   3.597  -8.948   2.589
  173   2HG   ARG  19          2HG       ARG  19   2.836  -7.783   1.497
  174   1HD   ARG  19          1HD       ARG  19   5.047  -7.827   0.755
  175   2HD   ARG  19          2HD       ARG  19   4.945  -6.357   1.705
  176    HE   ARG  19           HE       ARG  19   6.338  -7.295   3.361
  177   1HH1  ARG  19          1HH2      ARG  19   5.699  -9.741   0.930
  178   2HH1  ARG  19          2HH2      ARG  19   7.023 -10.740   1.459
  179   1HH2  ARG  19          1HH1      ARG  19   8.009  -8.628   3.983
  180   2HH2  ARG  19          2HH1      ARG  19   8.284 -10.124   3.141
  181    H    GLU  20           H        GLU  20   1.533  -6.949   6.417
  182    HA   GLU  20           HA       GLU  20   1.907  -9.719   7.329
  183   1HB   GLU  20          1HB       GLU  20   2.637  -7.224   8.280
  184   2HB   GLU  20          2HB       GLU  20   1.242  -7.554   9.273
  185   1HG   GLU  20          1HG       GLU  20   3.703  -9.334   8.950
  186   2HG   GLU  20          2HG       GLU  20   3.421  -8.230  10.288
  187    H    ALA  21           H        ALA  21  -0.649  -7.250   7.387
  188    HA   ALA  21           HA       ALA  21  -2.662  -8.706   8.724
  189   1HB   ALA  21          1HB       ALA  21  -2.866  -6.323   8.137
  190   2HB   ALA  21          2HB       ALA  21  -2.960  -6.747   6.409
  191   3HB   ALA  21          3HB       ALA  21  -4.246  -7.249   7.518
  192    H    SER  22           H        SER  22  -1.785  -8.804   5.242
  193    HA   SER  22           HA       SER  22  -3.706 -10.759   4.450
  194   1HB   SER  22          1HB       SER  22  -2.347  -9.265   2.960
  195   2HB   SER  22          2HB       SER  22  -0.936 -10.285   3.280
  196    HG   SER  22           HG       SER  22  -2.096 -12.039   2.360
  197    H    GLU  23           H        GLU  23  -0.612 -11.193   6.167
  198    HA   GLU  23           HA       GLU  23  -0.393 -14.049   5.616
  199   1HB   GLU  23          1HB       GLU  23   1.479 -12.430   6.342
  200   2HB   GLU  23          2HB       GLU  23   0.788 -12.527   7.948
  201   1HG   GLU  23          1HG       GLU  23   2.554 -14.076   7.940
  202   2HG   GLU  23          2HG       GLU  23   1.086 -15.034   7.889
  203    H    LYS  24           H        LYS  24  -1.487 -12.099   8.411
  204    HA   LYS  24           HA       LYS  24  -2.468 -14.340   9.954
  205   1HB   LYS  24          1HB       LYS  24  -1.925 -11.911  10.741
  206   2HB   LYS  24          2HB       LYS  24  -3.520 -11.497  10.114
  207   1HG   LYS  24          1HG       LYS  24  -3.895 -11.887  12.401
  208   2HG   LYS  24          2HG       LYS  24  -4.431 -13.389  11.646
  209   1HD   LYS  24          1HD       LYS  24  -2.060 -14.302  12.140
  210   2HD   LYS  24          2HD       LYS  24  -1.807 -12.860  13.119
  211   1HE   LYS  24          1HE       LYS  24  -3.985 -14.965  13.522
  212   2HE   LYS  24          2HE       LYS  24  -2.480 -14.857  14.436
  213   1HZ   LYS  24          1HZ       LYS  24  -3.207 -12.677  15.260
  214   2HZ   LYS  24          2HZ       LYS  24  -4.624 -12.802  14.449
  215   3HZ   LYS  24          3HZ       LYS  24  -4.281 -13.836  15.660
  216    H    ALA  25           H        ALA  25  -4.151 -12.054   7.795
  217    HA   ALA  25           HA       ALA  25  -6.680 -13.514   7.916
  218   1HB   ALA  25          1HB       ALA  25  -6.506 -10.992   7.770
  219   2HB   ALA  25          2HB       ALA  25  -5.910 -11.196   6.097
  220   3HB   ALA  25          3HB       ALA  25  -7.517 -11.763   6.548
  221    H    ARG  26           H        ARG  26  -4.729 -15.308   7.029
  222    HA   ARG  26           HA       ARG  26  -4.526 -15.477   4.187
  223   1HB   ARG  26          1HB       ARG  26  -3.772 -17.781   4.572
  224   2HB   ARG  26          2HB       ARG  26  -2.937 -16.579   5.523
  225   1HG   ARG  26          1HG       ARG  26  -3.321 -18.647   6.765
  226   2HG   ARG  26          2HG       ARG  26  -4.067 -17.266   7.569
  227   1HD   ARG  26          1HD       ARG  26  -6.250 -17.967   7.038
  228   2HD   ARG  26          2HD       ARG  26  -5.684 -18.991   5.701
  229    HE   ARG  26           HE       ARG  26  -4.677 -19.923   8.242
  230   1HH1  ARG  26          1HH2      ARG  26  -7.594 -19.997   6.292
  231   2HH1  ARG  26          2HH2      ARG  26  -8.158 -21.470   7.028
  232   1HH2  ARG  26          1HH1      ARG  26  -5.455 -21.822   9.116
  233   2HH2  ARG  26          2HH1      ARG  26  -6.976 -22.468   8.577
  234    H    ASN  27           H        ASN  27  -7.247 -15.950   6.097
  235    HA   ASN  27           HA       ASN  27  -8.740 -17.881   4.615
  236   1HB   ASN  27          1HB       ASN  27  -9.165 -17.167   6.956
  237   2HB   ASN  27          2HB       ASN  27  -9.604 -15.553   6.401
  238   1HD2  ASN  27          2HD2      ASN  27 -11.022 -18.219   7.606
  239   2HD2  ASN  27          1HD2      ASN  27 -12.532 -18.146   6.710
  240    HA   PRO  28           HA       PRO  28  -9.402 -15.442   0.958
  241   1HB   PRO  28          1HB       PRO  28 -11.480 -16.764  -0.246
  242   2HB   PRO  28          2HB       PRO  28  -9.816 -17.414  -0.130
  243   1HG   PRO  28          1HG       PRO  28 -12.163 -17.986   1.707
  244   2HG   PRO  28          2HG       PRO  28 -11.070 -19.167   0.912
  245   1HD   PRO  28          1HD       PRO  28 -10.672 -18.384   3.466
  246   2HD   PRO  28          2HD       PRO  28  -9.278 -18.612   2.363
  247    H    GLU  29           H        GLU  29 -11.947 -15.671   3.369
  248    HA   GLU  29           HA       GLU  29 -13.871 -13.892   2.208
  249   1HB   GLU  29          1HB       GLU  29 -13.843 -15.371   4.409
  250   2HB   GLU  29          2HB       GLU  29 -13.210 -13.929   5.163
  251   1HG   GLU  29          1HG       GLU  29 -15.526 -13.836   5.547
  252   2HG   GLU  29          2HG       GLU  29 -15.266 -12.682   4.250
  253    H    LYS  30           H        LYS  30 -10.888 -13.324   3.832
  254    HA   LYS  30           HA       LYS  30 -11.130 -10.371   3.541
  255   1HB   LYS  30          1HB       LYS  30 -10.744 -11.439   5.856
  256   2HB   LYS  30          2HB       LYS  30  -9.179 -11.915   5.254
  257   1HG   LYS  30          1HG       LYS  30  -8.954  -9.891   6.584
  258   2HG   LYS  30          2HG       LYS  30  -8.567  -9.521   4.916
  259   1HD   LYS  30          1HD       LYS  30  -9.802  -7.718   5.869
  260   2HD   LYS  30          2HD       LYS  30 -10.826  -8.446   4.650
  261   1HE   LYS  30          1HE       LYS  30 -11.027  -9.178   7.607
  262   2HE   LYS  30          2HE       LYS  30 -11.808  -7.735   6.969
  263   1HZ   LYS  30          1HZ       LYS  30 -13.083  -9.139   5.439
  264   2HZ   LYS  30          2HZ       LYS  30 -12.394 -10.498   6.038
  265   3HZ   LYS  30          3HZ       LYS  30 -13.357  -9.584   6.980
  266    H    LYS  31           H        LYS  31  -8.919 -13.069   2.799
  267    HA   LYS  31           HA       LYS  31  -6.953 -11.484   1.486
  268   1HB   LYS  31          1HB       LYS  31  -6.809 -13.882   2.367
  269   2HB   LYS  31          2HB       LYS  31  -7.530 -14.391   0.842
  270   1HG   LYS  31          1HG       LYS  31  -5.644 -13.531  -0.415
  271   2HG   LYS  31          2HG       LYS  31  -4.995 -12.706   1.017
  272   1HD   LYS  31          1HD       LYS  31  -4.590 -14.848   2.109
  273   2HD   LYS  31          2HD       LYS  31  -5.290 -15.738   0.753
  274   1HE   LYS  31          1HE       LYS  31  -2.855 -13.900   0.551
  275   2HE   LYS  31          2HE       LYS  31  -2.746 -15.635   0.862
  276   1HZ   LYS  31          1HZ       LYS  31  -3.854 -16.035  -1.270
  277   2HZ   LYS  31          2HZ       LYS  31  -3.935 -14.430  -1.580
  278   3HZ   LYS  31          3HZ       LYS  31  -2.486 -15.176  -1.492
  279    H    SER  32           H        SER  32 -10.095 -11.948   0.383
  280    HA   SER  32           HA       SER  32  -9.260 -10.930  -2.311
  281   1HB   SER  32          1HB       SER  32 -11.938 -12.209  -1.621
  282   2HB   SER  32          2HB       SER  32 -11.330 -11.770  -3.225
  283    HG   SER  32           HG       SER  32 -10.525 -13.867  -1.509
  284    H    VAL  33           H        VAL  33  -9.939  -9.631   0.456
  285    HA   VAL  33           HA       VAL  33 -11.672  -7.426  -0.628
  286    HB   VAL  33           HB       VAL  33 -11.422  -8.606   2.149
  287   1HG1  VAL  33          1HG1      VAL  33 -11.314  -6.192   2.518
  288   2HG1  VAL  33          2HG1      VAL  33 -12.706  -5.943   1.435
  289   3HG1  VAL  33          3HG1      VAL  33 -12.891  -6.830   2.967
  290   1HG2  VAL  33          1HG2      VAL  33 -13.815  -7.976   0.367
  291   2HG2  VAL  33          2HG2      VAL  33 -13.103  -9.588   0.602
  292   3HG2  VAL  33          3HG2      VAL  33 -13.869  -8.758   1.963
  293    H    LEU  34           H        LEU  34  -8.853  -8.089   1.651
  294    HA   LEU  34           HA       LEU  34  -7.999  -5.325   1.337
  295   1HB   LEU  34          1HB       LEU  34  -6.475  -5.685   2.850
  296   2HB   LEU  34          2HB       LEU  34  -7.580  -6.957   3.335
  297    HG   LEU  34           HG       LEU  34  -5.180  -7.295   1.565
  298   1HD1  LEU  34          1HD1      LEU  34  -3.800  -7.445   3.378
  299   2HD1  LEU  34          2HD1      LEU  34  -5.124  -6.771   4.348
  300   3HD1  LEU  34          3HD1      LEU  34  -4.912  -8.510   4.253
  301   1HD2  LEU  34          1HD2      LEU  34  -6.748  -9.417   3.049
  302   2HD2  LEU  34          2HD2      LEU  34  -6.740  -9.146   1.288
  303   3HD2  LEU  34          3HD2      LEU  34  -5.269  -9.694   2.105
  304    H    GLN  35           H        GLN  35  -7.727  -8.136  -0.656
  305    HA   GLN  35           HA       GLN  35  -5.400  -7.504  -2.123
  306   1HB   GLN  35          1HB       GLN  35  -6.823  -9.615  -2.104
  307   2HB   GLN  35          2HB       GLN  35  -7.967  -8.783  -3.149
  308   1HG   GLN  35          1HG       GLN  35  -6.680 -10.092  -4.594
  309   2HG   GLN  35          2HG       GLN  35  -5.985  -8.493  -4.801
  310   1HE2  GLN  35          2HE2      GLN  35  -5.226 -11.757  -4.255
  311   2HE2  GLN  35          1HE2      GLN  35  -3.591 -11.511  -3.656
  312    H    LYS  36           H        LYS  36  -8.726  -6.220  -2.405
  313    HA   LYS  36           HA       LYS  36  -8.306  -4.979  -4.972
  314   1HB   LYS  36          1HB       LYS  36 -10.487  -5.671  -3.301
  315   2HB   LYS  36          2HB       LYS  36 -10.505  -3.926  -3.232
  316   1HG   LYS  36          1HG       LYS  36 -10.636  -5.642  -5.755
  317   2HG   LYS  36          2HG       LYS  36 -11.988  -4.888  -4.928
  318   1HD   LYS  36          1HD       LYS  36 -11.688  -3.352  -6.578
  319   2HD   LYS  36          2HD       LYS  36 -10.705  -2.644  -5.300
  320   1HE   LYS  36          1HE       LYS  36  -9.510  -2.449  -7.382
  321   2HE   LYS  36          2HE       LYS  36  -8.660  -3.606  -6.370
  322   1HZ   LYS  36          1HZ       LYS  36  -9.867  -5.383  -7.660
  323   2HZ   LYS  36          2HZ       LYS  36 -10.402  -4.227  -8.690
  324   3HZ   LYS  36          3HZ       LYS  36  -8.791  -4.528  -8.528
  325    H    ILE  37           H        ILE  37  -8.252  -3.794  -1.634
  326    HA   ILE  37           HA       ILE  37  -7.437  -1.049  -2.285
  327    HB   ILE  37           HB       ILE  37  -6.967  -2.792   0.170
  328   1HG1  ILE  37          1HG1      ILE  37  -9.110  -0.703  -0.127
  329   2HG1  ILE  37          2HG1      ILE  37  -9.342  -2.459  -0.223
  330   1HG2  ILE  37          1HG2      ILE  37  -5.363  -1.118   0.421
  331   2HG2  ILE  37          2HG2      ILE  37  -6.302   0.063  -0.499
  332   3HG2  ILE  37          3HG2      ILE  37  -6.741  -0.283   1.159
  333   1HD1  ILE  37          1HD1      ILE  37  -8.462  -2.651   2.125
  334   2HD1  ILE  37          2HD1      ILE  37  -8.569  -0.874   2.233
  335   3HD1  ILE  37          3HD1      ILE  37 -10.021  -1.827   1.940
  336    H    LEU  38           H        LEU  38  -5.564  -4.096  -1.516
  337    HA   LEU  38           HA       LEU  38  -3.016  -2.955  -1.806
  338   1HB   LEU  38          1HB       LEU  38  -4.134  -5.719  -2.262
  339   2HB   LEU  38          2HB       LEU  38  -2.487  -5.397  -2.742
  340    HG   LEU  38           HG       LEU  38  -3.525  -4.931   0.089
  341   1HD1  LEU  38          1HD1      LEU  38  -3.558  -7.329  -0.535
  342   2HD1  LEU  38          2HD1      LEU  38  -1.860  -7.217  -1.049
  343   3HD1  LEU  38          3HD1      LEU  38  -2.301  -6.978   0.660
  344   1HD2  LEU  38          1HD2      LEU  38  -0.825  -4.694  -1.277
  345   2HD2  LEU  38          2HD2      LEU  38  -1.635  -3.569  -0.154
  346   3HD2  LEU  38          3HD2      LEU  38  -0.918  -5.073   0.439
  347    H    GLU  39           H        GLU  39  -5.133  -4.124  -4.511
  348    HA   GLU  39           HA       GLU  39  -3.148  -3.554  -6.501
  349   1HB   GLU  39          1HB       GLU  39  -5.268  -4.949  -6.818
  350   2HB   GLU  39          2HB       GLU  39  -6.190  -3.438  -6.793
  351   1HG   GLU  39          1HG       GLU  39  -4.767  -2.669  -8.775
  352   2HG   GLU  39          2HG       GLU  39  -4.091  -4.298  -8.829
  353    H    ASP  40           H        ASP  40  -5.735  -1.496  -5.170
  354    HA   ASP  40           HA       ASP  40  -5.248   0.835  -6.732
  355   1HB   ASP  40          1HB       ASP  40  -6.536   0.076  -4.094
  356   2HB   ASP  40          2HB       ASP  40  -6.295   1.714  -4.431
  357    H    GLU  41           H        GLU  41  -3.684  -0.411  -3.748
  358    HA   GLU  41           HA       GLU  41  -2.340   2.180  -3.266
  359   1HB   GLU  41          1HB       GLU  41  -1.840  -0.514  -1.951
  360   2HB   GLU  41          2HB       GLU  41  -1.081   1.001  -1.487
  361   1HG   GLU  41          1HG       GLU  41  -4.008   0.293  -1.178
  362   2HG   GLU  41          2HG       GLU  41  -2.806   0.388   0.086
  363    H    GLU  42           H        GLU  42  -1.400  -0.983  -4.627
  364    HA   GLU  42           HA       GLU  42   1.333  -0.297  -5.164
  365   1HB   GLU  42          1HB       GLU  42   0.328  -2.582  -5.279
  366   2HB   GLU  42          2HB       GLU  42  -0.513  -2.116  -6.766
  367   1HG   GLU  42          1HG       GLU  42   1.648  -1.736  -7.890
  368   2HG   GLU  42          2HG       GLU  42   2.513  -2.039  -6.380
  369    H    LYS  43           H        LYS  43  -1.679   0.417  -6.929
  370    HA   LYS  43           HA       LYS  43  -0.445   1.675  -9.199
  371   1HB   LYS  43          1HB       LYS  43  -3.056   1.002  -8.498
  372   2HB   LYS  43          2HB       LYS  43  -3.083   2.747  -8.332
  373   1HG   LYS  43          1HG       LYS  43  -3.773   2.244 -10.540
  374   2HG   LYS  43          2HG       LYS  43  -2.133   2.885 -10.691
  375   1HD   LYS  43          1HD       LYS  43  -1.230   0.599 -10.928
  376   2HD   LYS  43          2HD       LYS  43  -2.831  -0.096 -10.679
  377   1HE   LYS  43          1HE       LYS  43  -2.116   1.798 -12.967
  378   2HE   LYS  43          2HE       LYS  43  -1.998   0.040 -13.079
  379   1HZ   LYS  43          1HZ       LYS  43  -4.384  -0.102 -12.626
  380   2HZ   LYS  43          2HZ       LYS  43  -4.516   1.527 -12.546
  381   3HZ   LYS  43          3HZ       LYS  43  -4.113   0.805 -13.951
  382    H    HIS  44           H        HIS  44  -1.437   3.110  -5.979
  383    HA   HIS  44           HA       HIS  44  -0.772   5.753  -6.643
  384   1HB   HIS  44          1HB       HIS  44  -0.660   4.240  -3.992
  385   2HB   HIS  44          2HB       HIS  44  -0.684   5.953  -4.247
  386    HD2  HIS  44           2HD      HIS  44  -3.117   5.205  -6.657
  387    HE1  HIS  44           1HE      HIS  44  -5.452   4.829  -3.137
  388    HE2  HIS  44           2HE      HIS  44  -5.503   4.910  -5.681
  389    H    ILE  45           H        ILE  45   1.218   3.161  -5.091
  390    HA   ILE  45           HA       ILE  45   3.615   4.714  -4.958
  391    HB   ILE  45           HB       ILE  45   2.886   1.784  -4.848
  392   1HG1  ILE  45          1HG1      ILE  45   4.190   1.980  -2.673
  393   2HG1  ILE  45          2HG1      ILE  45   4.365   3.702  -2.991
  394   1HG2  ILE  45          1HG2      ILE  45   4.910   1.657  -6.167
  395   2HG2  ILE  45          2HG2      ILE  45   5.751   2.765  -5.050
  396   3HG2  ILE  45          3HG2      ILE  45   5.247   1.142  -4.519
  397   1HD1  ILE  45          1HD1      ILE  45   1.907   3.981  -2.817
  398   2HD1  ILE  45          2HD1      ILE  45   1.755   2.225  -2.530
  399   3HD1  ILE  45          3HD1      ILE  45   2.605   3.244  -1.366
  400    H    GLU  46           H        GLU  46   2.369   2.756  -7.716
  401    HA   GLU  46           HA       GLU  46   4.591   3.158  -9.439
  402   1HB   GLU  46          1HB       GLU  46   1.694   2.547  -9.758
  403   2HB   GLU  46          2HB       GLU  46   2.419   3.330 -11.148
  404   1HG   GLU  46          1HG       GLU  46   3.560   0.838  -9.834
  405   2HG   GLU  46          2HG       GLU  46   2.398   0.813 -11.160
  406    H    TRP  47           H        TRP  47   1.782   5.351  -8.940
  407    HA   TRP  47           HA       TRP  47   2.719   7.278 -10.878
  408   1HB   TRP  47          1HB       TRP  47   0.789   7.650  -8.543
  409   2HB   TRP  47          2HB       TRP  47   0.891   8.621  -9.989
  410    HD1  TRP  47           1HD      TRP  47   0.878   5.708 -11.805
  411    HE1  TRP  47           1HE      TRP  47  -1.440   4.701 -12.256
  412    HE3  TRP  47           3HE      TRP  47  -1.756   8.075  -8.130
  413    HZ2  TRP  47           2HZ      TRP  47  -4.102   4.866 -11.118
  414    HZ3  TRP  47           3HZ      TRP  47  -4.179   7.626  -7.794
  415    HH2  TRP  47           2HH      TRP  47  -5.354   5.998  -9.276
  416    H    LEU  48           H        LEU  48   2.908   7.062  -7.353
  417    HA   LEU  48           HA       LEU  48   4.156   9.516  -6.726
  418   1HB   LEU  48          1HB       LEU  48   4.148   6.693  -5.613
  419   2HB   LEU  48          2HB       LEU  48   5.142   7.875  -4.837
  420    HG   LEU  48           HG       LEU  48   2.180   8.295  -5.299
  421   1HD1  LEU  48          1HD1      LEU  48   2.517   6.337  -3.867
  422   2HD1  LEU  48          2HD1      LEU  48   3.679   7.224  -2.870
  423   3HD1  LEU  48          3HD1      LEU  48   1.954   7.694  -2.884
  424   1HD2  LEU  48          1HD2      LEU  48   4.205   9.658  -3.464
  425   2HD2  LEU  48          2HD2      LEU  48   3.455  10.377  -4.903
  426   3HD2  LEU  48          3HD2      LEU  48   2.454   9.993  -3.500
  427    H    GLU  49           H        GLU  49   5.459   6.795  -8.352
  428    HA   GLU  49           HA       GLU  49   8.302   7.567  -7.819
  429   1HB   GLU  49          1HB       GLU  49   7.335   5.083  -8.012
  430   2HB   GLU  49          2HB       GLU  49   7.472   5.358  -9.729
  431   1HG   GLU  49          1HG       GLU  49   9.957   6.241  -8.563
  432   2HG   GLU  49          2HG       GLU  49   9.544   4.734  -7.771
  433    H    THR  50           H        THR  50   5.945   7.307 -10.474
  434    HA   THR  50           HA       THR  50   7.507   8.445 -12.560
  435    HB   THR  50           HB       THR  50   4.551   8.301 -11.910
  436    HG1  THR  50           1HG      THR  50   6.159   7.074 -13.899
  437   1HG2  THR  50          1HG2      THR  50   4.642  10.221 -13.311
  438   2HG2  THR  50          2HG2      THR  50   5.775   9.420 -14.436
  439   3HG2  THR  50          3HG2      THR  50   4.089   8.844 -14.274
  440    H    ILE  51           H        ILE  51   5.986   9.920  -9.826
  441    HA   ILE  51           HA       ILE  51   6.378  12.695 -10.764
  442    HB   ILE  51           HB       ILE  51   5.029  11.306  -8.438
  443   1HG1  ILE  51          1HG1      ILE  51   3.907  13.154 -10.605
  444   2HG1  ILE  51          2HG1      ILE  51   3.999  11.410 -10.786
  445   1HG2  ILE  51          1HG2      ILE  51   5.864  13.293  -7.395
  446   2HG2  ILE  51          2HG2      ILE  51   5.325  14.305  -8.761
  447   3HG2  ILE  51          3HG2      ILE  51   4.147  13.510  -7.682
  448   1HD1  ILE  51          1HD1      ILE  51   2.598  11.203  -8.653
  449   2HD1  ILE  51          2HD1      ILE  51   2.258  12.942  -8.850
  450   3HD1  ILE  51          3HD1      ILE  51   1.809  11.790 -10.122
  451    H    ASN  52           H        ASN  52   8.346  10.505  -9.393
  452    HA   ASN  52           HA       ASN  52   9.942  12.470  -7.784
  453   1HB   ASN  52          1HB       ASN  52   8.516  11.061  -6.317
  454   2HB   ASN  52          2HB       ASN  52   9.318   9.622  -6.952
  455   1HD2  ASN  52          2HD2      ASN  52   9.834   9.238  -4.632
  456   2HD2  ASN  52          1HD2      ASN  52  11.231  10.064  -3.961
  457    H    GLY  53           H        GLY  53  10.748  12.313 -10.198
  458   1HA   GLY  53          1HA       GLY  53  12.871  12.342 -11.167
  459   2HA   GLY  53          2HA       GLY  53  13.467  11.261  -9.912
  460   1H    MET   1          1H        MET   1 -12.709 -11.691  12.067
  461   2H    MET   1          2H        MET   1 -12.086 -11.537  13.574
  462   3H    MET   1          3H        MET   1 -11.088 -11.728  12.292
  463    HA   MET   1           HA       MET   1 -11.717  -9.623  11.375
  464   1HB   MET   1          1HB       MET   1 -13.055  -8.035  12.739
  465   2HB   MET   1          2HB       MET   1 -13.958  -9.344  12.004
  466   1HG   MET   1          1HG       MET   1 -13.115  -9.360  14.929
  467   2HG   MET   1          2HG       MET   1 -14.627  -8.691  14.346
  468   1HE   MET   1          1HE       MET   1 -14.045 -11.119  16.582
  469   2HE   MET   1          2HE       MET   1 -15.595 -10.280  16.333
  470   3HE   MET   1          3HE       MET   1 -15.522 -12.057  16.276
  471    H    ASP   2           H        ASP   2  -9.723  -8.894  11.434
  472    HA   ASP   2           HA       ASP   2  -8.720  -7.485  13.751
  473   1HB   ASP   2          1HB       ASP   2  -8.051  -9.990  14.043
  474   2HB   ASP   2          2HB       ASP   2  -6.988  -9.740  12.663
  475    H    TYR   3           H        TYR   3  -6.504  -6.489  13.109
  476    HA   TYR   3           HA       TYR   3  -5.641  -4.810  11.810
  477   1HB   TYR   3          1HB       TYR   3  -5.359  -7.236  10.035
  478   2HB   TYR   3          2HB       TYR   3  -4.714  -5.670   9.576
  479    HD1  TYR   3           1HD      TYR   3  -3.811  -8.673  11.144
  480    HD2  TYR   3           2HD      TYR   3  -3.329  -4.399  11.496
  481    HE1  TYR   3           1HE      TYR   3  -1.654  -8.993  12.343
  482    HE2  TYR   3           2HE      TYR   3  -1.159  -4.727  12.629
  483    HH   TYR   3           HH       TYR   3   0.200  -7.977  13.271
  484    H    LEU   4           H        LEU   4  -7.776  -3.892  11.983
  485    HA   LEU   4           HA       LEU   4  -8.350  -2.776   9.329
  486   1HB   LEU   4          1HB       LEU   4 -10.778  -2.905   9.580
  487   2HB   LEU   4          2HB       LEU   4 -10.039  -4.490   9.559
  488    HG   LEU   4           HG       LEU   4 -10.144  -3.826  12.305
  489   1HD1  LEU   4          1HD1      LEU   4 -11.720  -1.987  11.779
  490   2HD1  LEU   4          2HD1      LEU   4 -12.748  -3.133  10.914
  491   3HD1  LEU   4          3HD1      LEU   4 -12.524  -3.285  12.679
  492   1HD2  LEU   4          1HD2      LEU   4 -12.170  -5.558  10.878
  493   2HD2  LEU   4          2HD2      LEU   4 -10.519  -6.071  11.295
  494   3HD2  LEU   4          3HD2      LEU   4 -11.665  -5.622  12.570
  495    H    ARG   5           H        ARG   5  -9.517  -2.247  12.719
  496    HA   ARG   5           HA       ARG   5  -9.665   0.574  12.474
  497   1HB   ARG   5          1HB       ARG   5  -9.891   0.622  14.871
  498   2HB   ARG   5          2HB       ARG   5 -10.769  -0.743  14.218
  499   1HG   ARG   5          1HG       ARG   5  -9.837  -1.768  16.016
  500   2HG   ARG   5          2HG       ARG   5  -8.556  -2.105  14.857
  501   1HD   ARG   5          1HD       ARG   5  -7.311  -0.089  15.758
  502   2HD   ARG   5          2HD       ARG   5  -8.632   0.144  16.914
  503    HE   ARG   5           HE       ARG   5  -7.414  -2.529  16.966
  504   1HH1  ARG   5          1HH2      ARG   5  -7.198   0.670  18.389
  505   2HH1  ARG   5          2HH2      ARG   5  -6.361   0.079  19.797
  506   1HH2  ARG   5          1HH1      ARG   5  -6.328  -3.201  18.778
  507   2HH2  ARG   5          2HH1      ARG   5  -5.883  -2.052  20.002
  508    H    GLU   6           H        GLU   6  -6.905  -1.432  13.076
  509    HA   GLU   6           HA       GLU   6  -5.124   0.672  13.912
  510   1HB   GLU   6          1HB       GLU   6  -4.985  -1.922  14.254
  511   2HB   GLU   6          2HB       GLU   6  -4.319  -1.999  12.637
  512   1HG   GLU   6          1HG       GLU   6  -2.423  -0.617  13.258
  513   2HG   GLU   6          2HG       GLU   6  -3.182  -0.126  14.772
  514    H    LEU   7           H        LEU   7  -5.571  -0.971  10.760
  515    HA   LEU   7           HA       LEU   7  -3.708   0.545   9.278
  516   1HB   LEU   7          1HB       LEU   7  -6.190  -1.113   8.645
  517   2HB   LEU   7          2HB       LEU   7  -5.276  -0.293   7.382
  518    HG   LEU   7           HG       LEU   7  -3.263  -1.462   7.957
  519   1HD1  LEU   7          1HD1      LEU   7  -3.341  -1.962  10.289
  520   2HD1  LEU   7          2HD1      LEU   7  -4.807  -2.965  10.074
  521   3HD1  LEU   7          3HD1      LEU   7  -3.241  -3.470   9.392
  522   1HD2  LEU   7          1HD2      LEU   7  -5.553  -3.463   7.754
  523   2HD2  LEU   7          2HD2      LEU   7  -5.050  -2.426   6.423
  524   3HD2  LEU   7          3HD2      LEU   7  -3.914  -3.629   7.080
  525    H    TYR   8           H        TYR   8  -7.216   0.967   9.660
  526    HA   TYR   8           HA       TYR   8  -7.889   3.046   7.972
  527   1HB   TYR   8          1HB       TYR   8  -9.129   1.632   9.852
  528   2HB   TYR   8          2HB       TYR   8  -8.655   2.855  10.949
  529    HD1  TYR   8           1HD      TYR   8 -10.521   3.991  11.687
  530    HD2  TYR   8           2HD      TYR   8 -10.230   2.988   7.501
  531    HE1  TYR   8           1HE      TYR   8 -12.736   5.051  11.273
  532    HE2  TYR   8           2HE      TYR   8 -12.476   3.969   7.113
  533    HH   TYR   8           HH       TYR   8 -14.260   5.083   8.032
  534    H    LYS   9           H        LYS   9  -6.383   3.388  11.090
  535    HA   LYS   9           HA       LYS   9  -6.497   6.247  11.131
  536   1HB   LYS   9          1HB       LYS   9  -5.974   4.347  13.036
  537   2HB   LYS   9          2HB       LYS   9  -4.320   4.685  12.616
  538   1HG   LYS   9          1HG       LYS   9  -4.482   6.256  14.249
  539   2HG   LYS   9          2HG       LYS   9  -5.229   7.261  13.000
  540   1HD   LYS   9          1HD       LYS   9  -7.488   6.418  13.750
  541   2HD   LYS   9          2HD       LYS   9  -6.675   5.462  15.007
  542   1HE   LYS   9          1HE       LYS   9  -5.679   7.615  15.896
  543   2HE   LYS   9          2HE       LYS   9  -6.693   8.498  14.748
  544   1HZ   LYS   9          1HZ       LYS   9  -8.649   7.484  15.837
  545   2HZ   LYS   9          2HZ       LYS   9  -7.686   6.716  16.913
  546   3HZ   LYS   9          3HZ       LYS   9  -7.771   8.343  16.911
  547    H    LEU  10           H        LEU  10  -3.564   4.321  10.435
  548    HA   LEU  10           HA       LEU  10  -2.106   6.485   9.413
  549   1HB   LEU  10          1HB       LEU  10  -1.882   3.515   8.770
  550   2HB   LEU  10          2HB       LEU  10  -0.730   4.757   8.292
  551    HG   LEU  10           HG       LEU  10  -0.816   5.312  10.941
  552   1HD1  LEU  10          1HD1      LEU  10  -2.321   3.566  11.648
  553   2HD1  LEU  10          2HD1      LEU  10  -1.393   2.336  10.777
  554   3HD1  LEU  10          3HD1      LEU  10  -0.706   3.146  12.201
  555   1HD2  LEU  10          1HD2      LEU  10   0.859   3.124   9.636
  556   2HD2  LEU  10          2HD2      LEU  10   1.212   4.867   9.644
  557   3HD2  LEU  10          3HD2      LEU  10   1.254   3.956  11.160
  558    H    GLU  11           H        GLU  11  -4.404   4.287   7.841
  559    HA   GLU  11           HA       GLU  11  -4.210   5.217   5.161
  560   1HB   GLU  11          1HB       GLU  11  -6.162   3.775   6.889
  561   2HB   GLU  11          2HB       GLU  11  -6.866   4.409   5.493
  562   1HG   GLU  11          1HG       GLU  11  -4.374   2.624   5.514
  563   2HG   GLU  11          2HG       GLU  11  -6.017   2.033   5.333
  564    H    GLN  12           H        GLN  12  -6.185   6.668   7.946
  565    HA   GLN  12           HA       GLN  12  -7.008   8.802   6.137
  566   1HB   GLN  12          1HB       GLN  12  -7.382   8.202   9.076
  567   2HB   GLN  12          2HB       GLN  12  -8.007   9.667   8.293
  568   1HG   GLN  12          1HG       GLN  12  -9.287   8.379   6.701
  569   2HG   GLN  12          2HG       GLN  12  -8.623   6.866   7.273
  570   1HE2  GLN  12          2HE2      GLN  12  -9.077   6.169   9.457
  571   2HE2  GLN  12          1HE2      GLN  12 -10.632   6.601  10.168
  572    H    GLN  13           H        GLN  13  -4.289   8.421   8.257
  573    HA   GLN  13           HA       GLN  13  -3.628  11.245   8.450
  574   1HB   GLN  13          1HB       GLN  13  -1.963   8.689   8.548
  575   2HB   GLN  13          2HB       GLN  13  -1.209  10.271   8.643
  576   1HG   GLN  13          1HG       GLN  13  -3.422   9.529  10.583
  577   2HG   GLN  13          2HG       GLN  13  -1.760   9.008  10.837
  578   1HE2  GLN  13          2HE2      GLN  13  -0.386  10.440  11.908
  579   2HE2  GLN  13          1HE2      GLN  13  -0.738  12.149  12.098
  580    H    ALA  14           H        ALA  14  -3.122   8.874   5.840
  581    HA   ALA  14           HA       ALA  14  -1.516  10.707   4.214
  582   1HB   ALA  14          1HB       ALA  14  -1.459   8.241   3.902
  583   2HB   ALA  14          2HB       ALA  14  -3.186   8.244   3.473
  584   3HB   ALA  14          3HB       ALA  14  -2.004   9.066   2.430
  585    H    MET  15           H        MET  15  -5.016   9.896   4.438
  586    HA   MET  15           HA       MET  15  -5.929  11.705   2.360
  587   1HB   MET  15          1HB       MET  15  -7.397  10.818   4.895
  588   2HB   MET  15          2HB       MET  15  -8.105  11.532   3.462
  589   1HG   MET  15          1HG       MET  15  -6.674   9.340   2.442
  590   2HG   MET  15          2HG       MET  15  -7.280   8.752   3.982
  591   1HE   MET  15          1HE       MET  15  -8.837  11.302   1.366
  592   2HE   MET  15          2HE       MET  15  -7.930  10.043   0.514
  593   3HE   MET  15          3HE       MET  15  -9.698  10.135   0.336
  594    H    LYS  16           H        LYS  16  -5.431  12.313   5.905
  595    HA   LYS  16           HA       LYS  16  -6.217  15.084   5.780
  596   1HB   LYS  16          1HB       LYS  16  -4.633  13.327   7.650
  597   2HB   LYS  16          2HB       LYS  16  -4.485  15.067   7.850
  598   1HG   LYS  16          1HG       LYS  16  -7.212  13.721   7.722
  599   2HG   LYS  16          2HG       LYS  16  -6.306  13.869   9.235
  600   1HD   LYS  16          1HD       LYS  16  -6.259  16.295   9.070
  601   2HD   LYS  16          2HD       LYS  16  -7.036  16.261   7.477
  602   1HE   LYS  16          1HE       LYS  16  -9.068  15.280   8.440
  603   2HE   LYS  16          2HE       LYS  16  -8.305  15.190  10.033
  604   1HZ   LYS  16          1HZ       LYS  16  -8.173  17.614  10.053
  605   2HZ   LYS  16          2HZ       LYS  16  -8.837  17.724   8.564
  606   3HZ   LYS  16          3HZ       LYS  16  -9.721  17.163   9.815
  607    H    LEU  17           H        LEU  17  -3.029  13.527   5.351
  608    HA   LEU  17           HA       LEU  17  -1.613  15.938   4.765
  609   1HB   LEU  17          1HB       LEU  17  -1.220  13.012   4.525
  610   2HB   LEU  17          2HB       LEU  17  -0.419  13.859   3.257
  611    HG   LEU  17           HG       LEU  17  -0.137  14.542   6.224
  612   1HD1  LEU  17          1HD1      LEU  17   0.714  12.286   5.704
  613   2HD1  LEU  17          2HD1      LEU  17   1.748  12.966   4.425
  614   3HD1  LEU  17          3HD1      LEU  17   2.012  13.415   6.129
  615   1HD2  LEU  17          1HD2      LEU  17   1.581  15.390   3.844
  616   2HD2  LEU  17          2HD2      LEU  17   0.479  16.451   4.739
  617   3HD2  LEU  17          3HD2      LEU  17   1.890  15.771   5.550
  618    H    TYR  18           H        TYR  18  -3.395  13.732   2.577
  619    HA   TYR  18           HA       TYR  18  -2.892  15.103   0.183
  620   1HB   TYR  18          1HB       TYR  18  -4.833  13.037   1.137
  621   2HB   TYR  18          2HB       TYR  18  -5.175  13.809  -0.366
  622    HD1  TYR  18           1HD      TYR  18  -2.978  14.088  -1.952
  623    HD2  TYR  18           2HD      TYR  18  -3.690  10.946   0.888
  624    HE1  TYR  18           1HE      TYR  18  -1.239  12.694  -3.072
  625    HE2  TYR  18           2HE      TYR  18  -1.884   9.592  -0.147
  626    HH   TYR  18           HH       TYR  18  -0.222   9.529  -1.722
  627    H    ARG  19           H        ARG  19  -5.494  15.667   2.575
  628    HA   ARG  19           HA       ARG  19  -6.932  17.667   1.099
  629   1HB   ARG  19          1HB       ARG  19  -6.519  17.175   4.069
  630   2HB   ARG  19          2HB       ARG  19  -7.485  18.524   3.474
  631   1HG   ARG  19          1HG       ARG  19  -9.049  17.061   2.369
  632   2HG   ARG  19          2HG       ARG  19  -8.062  15.631   2.707
  633   1HD   ARG  19          1HD       ARG  19  -8.408  15.869   5.100
  634   2HD   ARG  19          2HD       ARG  19  -9.231  17.411   4.891
  635    HE   ARG  19           HE       ARG  19 -10.292  14.697   4.299
  636   1HH1  ARG  19          1HH2      ARG  19 -10.989  18.137   4.226
  637   2HH1  ARG  19          2HH2      ARG  19 -12.706  17.872   4.105
  638   1HH2  ARG  19          1HH1      ARG  19 -12.494  14.445   4.138
  639   2HH2  ARG  19          2HH1      ARG  19 -13.523  15.843   4.047
  640    H    GLU  20           H        GLU  20  -3.992  18.031   3.114
  641    HA   GLU  20           HA       GLU  20  -3.890  20.931   2.624
  642   1HB   GLU  20          1HB       GLU  20  -2.879  19.390   4.594
  643   2HB   GLU  20          2HB       GLU  20  -1.487  19.353   3.548
  644   1HG   GLU  20          1HG       GLU  20  -2.314  22.102   3.637
  645   2HG   GLU  20          2HG       GLU  20  -2.466  21.499   5.276
  646    H    ALA  21           H        ALA  21  -2.159  18.089   1.468
  647    HA   ALA  21           HA       ALA  21  -0.389  19.259  -0.373
  648   1HB   ALA  21          1HB       ALA  21  -0.506  16.843   0.296
  649   2HB   ALA  21          2HB       ALA  21  -1.920  16.671  -0.771
  650   3HB   ALA  21          3HB       ALA  21  -0.351  17.081  -1.454
  651    H    SER  22           H        SER  22  -3.872  18.526  -0.826
  652    HA   SER  22           HA       SER  22  -4.126  19.366  -3.523
  653   1HB   SER  22          1HB       SER  22  -5.844  18.154  -2.155
  654   2HB   SER  22          2HB       SER  22  -6.157  19.662  -1.279
  655    HG   SER  22           HG       SER  22  -6.568  19.099  -4.044
  656    H    GLU  23           H        GLU  23  -3.983  21.368  -0.526
  657    HA   GLU  23           HA       GLU  23  -4.627  23.852  -1.918
  658   1HB   GLU  23          1HB       GLU  23  -4.794  23.256   0.615
  659   2HB   GLU  23          2HB       GLU  23  -3.080  23.658   0.669
  660   1HG   GLU  23          1HG       GLU  23  -3.561  25.907  -0.254
  661   2HG   GLU  23          2HG       GLU  23  -5.275  25.501  -0.372
  662    H    LYS  24           H        LYS  24  -1.628  22.256  -0.857
  663    HA   LYS  24           HA       LYS  24   0.284  24.076  -2.026
  664   1HB   LYS  24          1HB       LYS  24   0.287  21.334  -0.904
  665   2HB   LYS  24          2HB       LYS  24   1.416  21.511  -2.232
  666   1HG   LYS  24          1HG       LYS  24   2.503  21.920  -0.116
  667   2HG   LYS  24          2HG       LYS  24   2.537  23.373  -1.120
  668   1HD   LYS  24          1HD       LYS  24   0.805  24.433   0.183
  669   2HD   LYS  24          2HD       LYS  24   0.442  22.945   1.062
  670   1HE   LYS  24          1HE       LYS  24   3.161  24.329   1.184
  671   2HE   LYS  24          2HE       LYS  24   1.828  24.737   2.269
  672   1HZ   LYS  24          1HZ       LYS  24   1.763  22.382   2.950
  673   2HZ   LYS  24          2HZ       LYS  24   3.101  22.066   2.064
  674   3HZ   LYS  24          3HZ       LYS  24   3.188  23.094   3.334
  675    H    ALA  25           H        ALA  25  -1.600  21.531  -3.498
  676    HA   ALA  25           HA       ALA  25  -0.344  22.005  -6.146
  677   1HB   ALA  25          1HB       ALA  25  -0.193  19.720  -5.115
  678   2HB   ALA  25          2HB       ALA  25  -1.974  19.616  -5.201
  679   3HB   ALA  25          3HB       ALA  25  -1.017  19.781  -6.675
  680    H    ARG  26           H        ARG  26  -2.347  23.858  -5.213
  681    HA   ARG  26           HA       ARG  26  -4.897  23.456  -6.280
  682   1HB   ARG  26          1HB       ARG  26  -5.208  25.805  -6.277
  683   2HB   ARG  26          2HB       ARG  26  -4.295  25.361  -4.851
  684   1HG   ARG  26          1HG       ARG  26  -2.947  26.474  -7.358
  685   2HG   ARG  26          2HG       ARG  26  -3.673  27.506  -6.132
  686   1HD   ARG  26          1HD       ARG  26  -2.205  26.564  -4.408
  687   2HD   ARG  26          2HD       ARG  26  -1.396  25.553  -5.620
  688    HE   ARG  26           HE       ARG  26  -0.948  27.839  -6.797
  689   1HH1  ARG  26          1HH2      ARG  26  -0.818  27.409  -3.319
  690   2HH1  ARG  26          2HH2      ARG  26   0.286  28.743  -3.111
  691   1HH2  ARG  26          1HH1      ARG  26   0.454  29.513  -6.458
  692   2HH2  ARG  26          2HH1      ARG  26   0.991  29.891  -4.848
  693    H    ASN  27           H        ASN  27  -2.053  23.767  -8.170
  694    HA   ASN  27           HA       ASN  27  -3.105  24.617 -10.670
  695   1HB   ASN  27          1HB       ASN  27  -0.700  24.457 -10.098
  696   2HB   ASN  27          2HB       ASN  27  -0.825  22.700  -9.998
  697   1HD2  ASN  27          2HD2      ASN  27  -0.136  25.315 -12.102
  698   2HD2  ASN  27          1HD2      ASN  27  -0.194  24.380 -13.589
  699    HA   PRO  28           HA       PRO  28  -5.879  21.298 -11.475
  700   1HB   PRO  28          1HB       PRO  28  -6.279  21.468 -14.193
  701   2HB   PRO  28          2HB       PRO  28  -6.921  22.636 -12.999
  702   1HG   PRO  28          1HG       PRO  28  -4.388  22.864 -14.652
  703   2HG   PRO  28          2HG       PRO  28  -5.674  24.094 -14.416
  704   1HD   PRO  28          1HD       PRO  28  -3.389  24.140 -12.967
  705   2HD   PRO  28          2HD       PRO  28  -4.958  24.542 -12.203
  706    H    GLU  29           H        GLU  29  -2.760  21.228 -13.142
  707    HA   GLU  29           HA       GLU  29  -2.960  18.653 -14.338
  708   1HB   GLU  29          1HB       GLU  29  -1.166  20.501 -14.632
  709   2HB   GLU  29          2HB       GLU  29  -0.421  19.849 -13.181
  710   1HG   GLU  29          1HG       GLU  29   0.721  18.844 -14.974
  711   2HG   GLU  29          2HG       GLU  29  -0.342  17.582 -14.365
  712    H    LYS  30           H        LYS  30  -1.511  19.524 -11.241
  713    HA   LYS  30           HA       LYS  30  -1.271  16.778 -10.299
  714   1HB   LYS  30          1HB       LYS  30  -0.859  19.466  -9.009
  715   2HB   LYS  30          2HB       LYS  30  -1.207  18.072  -7.982
  716   1HG   LYS  30          1HG       LYS  30   1.093  18.183  -8.000
  717   2HG   LYS  30          2HG       LYS  30   0.671  16.813  -9.027
  718   1HD   LYS  30          1HD       LYS  30   1.116  18.211 -11.049
  719   2HD   LYS  30          2HD       LYS  30   1.496  19.593  -9.988
  720   1HE   LYS  30          1HE       LYS  30   3.267  18.162  -8.881
  721   2HE   LYS  30          2HE       LYS  30   2.952  16.907 -10.083
  722   1HZ   LYS  30          1HZ       LYS  30   3.621  18.509 -11.812
  723   2HZ   LYS  30          2HZ       LYS  30   3.924  19.654 -10.682
  724   3HZ   LYS  30          3HZ       LYS  30   4.828  18.299 -10.732
  725    H    LYS  31           H        LYS  31  -3.734  19.286  -9.775
  726    HA   LYS  31           HA       LYS  31  -5.377  17.809  -8.005
  727   1HB   LYS  31          1HB       LYS  31  -5.418  20.287  -8.547
  728   2HB   LYS  31          2HB       LYS  31  -6.400  19.873  -9.962
  729   1HG   LYS  31          1HG       LYS  31  -8.170  19.004  -8.547
  730   2HG   LYS  31          2HG       LYS  31  -7.138  19.096  -7.107
  731   1HD   LYS  31          1HD       LYS  31  -7.132  21.549  -7.242
  732   2HD   LYS  31          2HD       LYS  31  -8.083  21.488  -8.747
  733   1HE   LYS  31          1HE       LYS  31  -9.921  20.334  -7.542
  734   2HE   LYS  31          2HE       LYS  31  -8.982  20.374  -6.046
  735   1HZ   LYS  31          1HZ       LYS  31  -9.080  22.804  -6.118
  736   2HZ   LYS  31          2HZ       LYS  31  -9.926  22.779  -7.519
  737   3HZ   LYS  31          3HZ       LYS  31 -10.592  22.193  -6.150
  738    H    SER  32           H        SER  32  -4.758  16.868 -11.154
  739    HA   SER  32           HA       SER  32  -7.053  14.963 -10.970
  740   1HB   SER  32          1HB       SER  32  -7.012  16.705 -12.913
  741   2HB   SER  32          2HB       SER  32  -5.719  15.701 -13.591
  742    HG   SER  32           HG       SER  32  -7.826  15.104 -14.340
  743    H    VAL  33           H        VAL  33  -4.177  14.972  -9.981
  744    HA   VAL  33           HA       VAL  33  -3.442  12.205 -10.884
  745    HB   VAL  33           HB       VAL  33  -1.685  14.603 -10.295
  746   1HG1  VAL  33          1HG1      VAL  33  -0.613  12.761  -9.123
  747   2HG1  VAL  33          2HG1      VAL  33  -0.800  11.707 -10.547
  748   3HG1  VAL  33          3HG1      VAL  33   0.263  13.132 -10.605
  749   1HG2  VAL  33          1HG2      VAL  33  -1.800  12.693 -12.669
  750   2HG2  VAL  33          2HG2      VAL  33  -2.510  14.318 -12.637
  751   3HG2  VAL  33          3HG2      VAL  33  -0.759  14.126 -12.511
  752    H    LEU  34           H        LEU  34  -3.229  14.569  -8.062
  753    HA   LEU  34           HA       LEU  34  -2.946  12.352  -6.189
  754   1HB   LEU  34          1HB       LEU  34  -2.549  13.860  -4.664
  755   2HB   LEU  34          2HB       LEU  34  -2.132  14.862  -6.039
  756    HG   LEU  34           HG       LEU  34  -4.771  14.797  -4.615
  757   1HD1  LEU  34          1HD1      LEU  34  -2.816  15.738  -3.241
  758   2HD1  LEU  34          2HD1      LEU  34  -2.651  16.998  -4.457
  759   3HD1  LEU  34          3HD1      LEU  34  -4.144  16.874  -3.495
  760   1HD2  LEU  34          1HD2      LEU  34  -3.764  16.920  -6.526
  761   2HD2  LEU  34          2HD2      LEU  34  -5.012  15.713  -6.908
  762   3HD2  LEU  34          3HD2      LEU  34  -5.319  16.932  -5.669
  763    H    GLN  35           H        GLN  35  -5.594  13.774  -7.924
  764    HA   GLN  35           HA       GLN  35  -7.701  13.138  -6.113
  765   1HB   GLN  35          1HB       GLN  35  -7.748  14.771  -7.938
  766   2HB   GLN  35          2HB       GLN  35  -7.752  13.483  -9.139
  767   1HG   GLN  35          1HG       GLN  35  -9.879  13.796  -6.967
  768   2HG   GLN  35          2HG       GLN  35  -9.979  14.633  -8.507
  769   1HE2  GLN  35          2HE2      GLN  35 -11.986  12.834  -7.591
  770   2HE2  GLN  35          1HE2      GLN  35 -11.993  11.481  -8.713
  771    H    LYS  36           H        LYS  36  -6.046  11.194  -8.608
  772    HA   LYS  36           HA       LYS  36  -7.899   8.955  -8.498
  773   1HB   LYS  36          1HB       LYS  36  -5.037   9.349  -9.500
  774   2HB   LYS  36          2HB       LYS  36  -5.765   7.747  -9.490
  775   1HG   LYS  36          1HG       LYS  36  -7.075  10.125 -10.862
  776   2HG   LYS  36          2HG       LYS  36  -5.937   9.048 -11.671
  777   1HD   LYS  36          1HD       LYS  36  -7.500   7.467 -12.025
  778   2HD   LYS  36          2HD       LYS  36  -7.946   7.425 -10.330
  779   1HE   LYS  36          1HE       LYS  36  -9.914   7.961 -11.534
  780   2HE   LYS  36          2HE       LYS  36  -9.418   9.420 -10.668
  781   1HZ   LYS  36          1HZ       LYS  36  -8.477  10.254 -12.759
  782   2HZ   LYS  36          2HZ       LYS  36  -8.901   8.886 -13.551
  783   3HZ   LYS  36          3HZ       LYS  36 -10.052   9.889 -12.974
  784    H    ILE  37           H        ILE  37  -4.905   9.689  -6.738
  785    HA   ILE  37           HA       ILE  37  -4.975   7.258  -5.100
  786    HB   ILE  37           HB       ILE  37  -3.791  10.025  -4.607
  787   1HG1  ILE  37          1HG1      ILE  37  -2.410   7.553  -5.627
  788   2HG1  ILE  37          2HG1      ILE  37  -2.779   9.036  -6.525
  789   1HG2  ILE  37          1HG2      ILE  37  -4.100   8.941  -2.453
  790   2HG2  ILE  37          2HG2      ILE  37  -3.471   7.405  -3.086
  791   3HG2  ILE  37          3HG2      ILE  37  -2.399   8.783  -2.842
  792   1HD1  ILE  37          1HD1      ILE  37  -1.283  10.293  -4.932
  793   2HD1  ILE  37          2HD1      ILE  37  -0.737   8.703  -4.325
  794   3HD1  ILE  37          3HD1      ILE  37  -0.483   9.139  -6.014
  795    H    LEU  38           H        LEU  38  -6.243  10.645  -4.541
  796    HA   LEU  38           HA       LEU  38  -7.514  10.099  -2.096
  797   1HB   LEU  38          1HB       LEU  38  -8.144  11.969  -4.381
  798   2HB   LEU  38          2HB       LEU  38  -9.241  11.871  -3.026
  799    HG   LEU  38           HG       LEU  38  -6.280  12.536  -2.700
  800   1HD1  LEU  38          1HD1      LEU  38  -7.420  14.266  -4.045
  801   2HD1  LEU  38          2HD1      LEU  38  -8.696  14.393  -2.810
  802   3HD1  LEU  38          3HD1      LEU  38  -7.023  14.864  -2.431
  803   1HD2  LEU  38          1HD2      LEU  38  -8.710  12.512  -0.869
  804   2HD2  LEU  38          2HD2      LEU  38  -7.098  11.786  -0.617
  805   3HD2  LEU  38          3HD2      LEU  38  -7.324  13.536  -0.514
  806    H    GLU  39           H        GLU  39  -8.882   9.424  -5.384
  807    HA   GLU  39           HA       GLU  39 -11.353   8.398  -4.337
  808   1HB   GLU  39          1HB       GLU  39  -9.822   8.134  -6.952
  809   2HB   GLU  39          2HB       GLU  39 -11.205   7.087  -6.683
  810   1HG   GLU  39          1HG       GLU  39 -11.440  10.096  -6.396
  811   2HG   GLU  39          2HG       GLU  39 -11.575   9.287  -7.958
  812    H    ASP  40           H        ASP  40  -8.342   6.678  -5.191
  813    HA   ASP  40           HA       ASP  40  -9.192   4.044  -4.499
  814   1HB   ASP  40          1HB       ASP  40  -6.623   5.636  -4.771
  815   2HB   ASP  40          2HB       ASP  40  -6.544   4.103  -4.055
  816    H    GLU  41           H        GLU  41  -7.934   6.742  -2.495
  817    HA   GLU  41           HA       GLU  41  -7.576   4.945  -0.179
  818   1HB   GLU  41          1HB       GLU  41  -7.478   7.976  -0.302
  819   2HB   GLU  41          2HB       GLU  41  -7.108   7.010   1.119
  820   1HG   GLU  41          1HG       GLU  41  -5.487   7.150  -1.438
  821   2HG   GLU  41          2HG       GLU  41  -5.085   7.844   0.113
  822    H    GLU  42           H        GLU  42  -9.995   7.374  -1.191
  823    HA   GLU  42           HA       GLU  42 -11.671   7.054   1.112
  824   1HB   GLU  42          1HB       GLU  42 -11.858   8.879  -0.575
  825   2HB   GLU  42          2HB       GLU  42 -12.530   7.716  -1.732
  826   1HG   GLU  42          1HG       GLU  42 -14.444   7.307  -0.266
  827   2HG   GLU  42          2HG       GLU  42 -13.714   8.261   1.027
  828    H    LYS  43           H        LYS  43 -11.380   5.128  -1.886
  829    HA   LYS  43           HA       LYS  43 -13.555   3.343  -1.289
  830   1HB   LYS  43          1HB       LYS  43 -11.811   3.648  -3.459
  831   2HB   LYS  43          2HB       LYS  43 -11.277   2.133  -2.763
  832   1HG   LYS  43          1HG       LYS  43 -12.949   1.542  -4.330
  833   2HG   LYS  43          2HG       LYS  43 -13.775   1.445  -2.766
  834   1HD   LYS  43          1HD       LYS  43 -14.559   3.874  -3.211
  835   2HD   LYS  43          2HD       LYS  43 -13.955   3.674  -4.851
  836   1HE   LYS  43          1HE       LYS  43 -16.079   1.939  -3.500
  837   2HE   LYS  43          2HE       LYS  43 -16.413   3.290  -4.583
  838   1HZ   LYS  43          1HZ       LYS  43 -15.259   2.086  -6.358
  839   2HZ   LYS  43          2HZ       LYS  43 -14.973   0.814  -5.370
  840   3HZ   LYS  43          3HZ       LYS  43 -16.501   1.202  -5.782
  841    H    HIS  44           H        HIS  44 -10.015   3.081  -0.373
  842    HA   HIS  44           HA       HIS  44 -10.213   0.640   0.964
  843   1HB   HIS  44          1HB       HIS  44  -8.520   3.109   1.580
  844   2HB   HIS  44          2HB       HIS  44  -8.254   1.467   2.070
  845    HD2  HIS  44           2HD      HIS  44  -9.128   0.703  -1.220
  846    HE1  HIS  44           1HE      HIS  44  -5.170   2.082  -1.843
  847    HE2  HIS  44           2HE      HIS  44  -7.172   0.928  -2.907
  848    H    ILE  45           H        ILE  45 -10.725   3.988   2.163
  849    HA   ILE  45           HA       ILE  45 -11.356   3.255   4.874
  850    HB   ILE  45           HB       ILE  45 -11.638   5.667   3.096
  851   1HG1  ILE  45          1HG1      ILE  45 -10.744   6.834   5.122
  852   2HG1  ILE  45          2HG1      ILE  45 -10.743   5.302   5.987
  853   1HG2  ILE  45          1HG2      ILE  45 -13.916   5.683   3.909
  854   2HG2  ILE  45          2HG2      ILE  45 -13.361   5.471   5.589
  855   3HG2  ILE  45          3HG2      ILE  45 -12.993   6.956   4.691
  856   1HD1  ILE  45          1HD1      ILE  45  -9.112   5.979   3.507
  857   2HD1  ILE  45          2HD1      ILE  45  -8.516   5.901   5.161
  858   3HD1  ILE  45          3HD1      ILE  45  -9.069   4.414   4.365
  859    H    GLU  46           H        GLU  46 -13.481   3.556   1.987
  860    HA   GLU  46           HA       GLU  46 -15.905   3.014   3.326
  861   1HB   GLU  46          1HB       GLU  46 -15.160   3.467   0.676
  862   2HB   GLU  46          2HB       GLU  46 -15.639   1.779   0.636
  863   1HG   GLU  46          1HG       GLU  46 -17.585   2.978   0.119
  864   2HG   GLU  46          2HG       GLU  46 -17.811   2.499   1.797
  865    H    TRP  47           H        TRP  47 -13.523   0.672   2.016
  866    HA   TRP  47           HA       TRP  47 -15.070  -1.648   2.761
  867   1HB   TRP  47          1HB       TRP  47 -12.072  -1.417   2.276
  868   2HB   TRP  47          2HB       TRP  47 -13.062  -2.851   2.159
  869    HD1  TRP  47           1HD      TRP  47 -15.293  -1.211   0.225
  870    HE1  TRP  47           1HE      TRP  47 -14.682  -0.902  -2.247
  871    HE3  TRP  47           3HE      TRP  47 -10.274  -2.121   0.514
  872    HZ2  TRP  47           2HZ      TRP  47 -12.289  -0.941  -3.879
  873    HZ3  TRP  47           3HZ      TRP  47  -8.834  -1.999  -1.517
  874    HH2  TRP  47           2HH      TRP  47  -9.833  -1.348  -3.706
  875    H    LEU  48           H        LEU  48 -12.349   0.092   4.262
  876    HA   LEU  48           HA       LEU  48 -11.896  -1.581   6.502
  877   1HB   LEU  48          1HB       LEU  48 -11.521   1.345   5.822
  878   2HB   LEU  48          2HB       LEU  48 -11.127   0.829   7.425
  879    HG   LEU  48           HG       LEU  48  -9.981  -0.572   4.982
  880   1HD1  LEU  48          1HD1      LEU  48  -9.359   1.864   4.924
  881   2HD1  LEU  48          2HD1      LEU  48  -8.611   1.658   6.519
  882   3HD1  LEU  48          3HD1      LEU  48  -7.992   0.762   5.121
  883   1HD2  LEU  48          1HD2      LEU  48  -9.003  -0.308   7.865
  884   2HD2  LEU  48          2HD2      LEU  48  -9.750  -1.758   7.164
  885   3HD2  LEU  48          3HD2      LEU  48  -8.175  -1.200   6.573
  886    H    GLU  49           H        GLU  49 -14.160   1.159   6.174
  887    HA   GLU  49           HA       GLU  49 -15.329   0.814   8.812
  888   1HB   GLU  49          1HB       GLU  49 -15.470   2.766   6.899
  889   2HB   GLU  49          2HB       GLU  49 -16.999   1.968   6.597
  890   1HG   GLU  49          1HG       GLU  49 -16.009   3.114   9.246
  891   2HG   GLU  49          2HG       GLU  49 -17.173   3.873   8.169
  892    H    THR  50           H        THR  50 -16.195  -0.443   5.556
  893    HA   THR  50           HA       THR  50 -18.590  -1.793   6.325
  894    HB   THR  50           HB       THR  50 -16.563  -2.356   4.136
  895    HG1  THR  50           1HG      THR  50 -17.567  -0.461   3.808
  896   1HG2  THR  50          1HG2      THR  50 -17.773  -4.388   4.411
  897   2HG2  THR  50          2HG2      THR  50 -19.324  -3.501   4.522
  898   3HG2  THR  50          3HG2      THR  50 -18.396  -3.531   2.991
  899    H    ILE  51           H        ILE  51 -15.263  -2.702   6.708
  900    HA   ILE  51           HA       ILE  51 -15.863  -5.415   7.651
  901    HB   ILE  51           HB       ILE  51 -13.386  -3.831   6.934
  902   1HG1  ILE  51          1HG1      ILE  51 -14.349  -6.540   5.910
  903   2HG1  ILE  51          2HG1      ILE  51 -14.985  -5.038   5.254
  904   1HG2  ILE  51          1HG2      ILE  51 -12.590  -5.059   8.814
  905   2HG2  ILE  51          2HG2      ILE  51 -13.338  -6.575   8.241
  906   3HG2  ILE  51          3HG2      ILE  51 -11.971  -5.837   7.375
  907   1HD1  ILE  51          1HD1      ILE  51 -12.737  -4.330   4.543
  908   2HD1  ILE  51          2HD1      ILE  51 -12.057  -5.838   5.179
  909   3HD1  ILE  51          3HD1      ILE  51 -13.216  -5.883   3.836
  910    H    ASN  52           H        ASN  52 -15.718  -2.448   9.132
  911    HA   ASN  52           HA       ASN  52 -14.752  -3.285  11.764
  912   1HB   ASN  52          1HB       ASN  52 -14.591  -0.941  10.888
  913   2HB   ASN  52          2HB       ASN  52 -16.355  -0.844  10.913
  914   1HD2  ASN  52          2HD2      ASN  52 -16.418   0.867  12.394
  915   2HD2  ASN  52          1HD2      ASN  52 -15.930   0.649  14.074
  916    H    GLY  53           H        GLY  53 -15.819  -4.221  13.364
  917   1HA   GLY  53          1HA       GLY  53 -18.269  -3.969  14.436
  918   2HA   GLY  53          2HA       GLY  53 -18.646  -5.032  13.078
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1  12.116  23.266   2.451
    2   2H    MET   1          2H        MET   1  10.501  23.010   2.565
    3   3H    MET   1          3H        MET   1  11.164  23.427   1.130
    4    HA   MET   1           HA       MET   1  12.371  21.377   0.988
    5   1HB   MET   1          1HB       MET   1  12.554  21.166   3.519
    6   2HB   MET   1          2HB       MET   1  10.902  20.536   3.523
    7   1HG   MET   1          1HG       MET   1  11.622  18.663   2.072
    8   2HG   MET   1          2HG       MET   1  13.246  19.354   1.976
    9   1HE   MET   1          1HE       MET   1  14.469  17.185   2.685
   10   2HE   MET   1          2HE       MET   1  13.965  16.165   4.049
   11   3HE   MET   1          3HE       MET   1  12.889  16.367   2.647
   12    H    ASP   2           H        ASP   2  11.451  19.742  -0.283
   13    HA   ASP   2           HA       ASP   2   8.770  20.133  -1.233
   14   1HB   ASP   2          1HB       ASP   2  10.929  19.172  -2.370
   15   2HB   ASP   2          2HB       ASP   2  10.411  17.631  -1.690
   16    H    TYR   3           H        TYR   3   7.151  18.301  -1.374
   17    HA   TYR   3           HA       TYR   3   6.705  17.244   1.395
   18   1HB   TYR   3          1HB       TYR   3   4.354  17.857   1.093
   19   2HB   TYR   3          2HB       TYR   3   5.388  19.245   0.858
   20    HD1  TYR   3           1HD      TYR   3   2.869  17.056  -0.720
   21    HD2  TYR   3           2HD      TYR   3   5.777  20.164  -1.469
   22    HE1  TYR   3           1HE      TYR   3   1.771  17.585  -2.881
   23    HE2  TYR   3           2HE      TYR   3   4.653  20.701  -3.603
   24    HH   TYR   3           HH       TYR   3   2.874  20.284  -4.966
   25    H    LEU   4           H        LEU   4   7.025  16.127  -1.716
   26    HA   LEU   4           HA       LEU   4   4.803  14.343  -1.868
   27   1HB   LEU   4          1HB       LEU   4   7.352  13.613  -3.316
   28   2HB   LEU   4          2HB       LEU   4   5.690  13.508  -3.870
   29    HG   LEU   4           HG       LEU   4   7.409  15.987  -3.603
   30   1HD1  LEU   4          1HD1      LEU   4   7.995  14.538  -5.502
   31   2HD1  LEU   4          2HD1      LEU   4   6.313  14.562  -6.066
   32   3HD1  LEU   4          3HD1      LEU   4   7.284  16.055  -6.067
   33   1HD2  LEU   4          1HD2      LEU   4   4.568  15.752  -4.714
   34   2HD2  LEU   4          2HD2      LEU   4   5.003  16.547  -3.197
   35   3HD2  LEU   4          3HD2      LEU   4   5.600  17.230  -4.696
   36    H    ARG   5           H        ARG   5   8.137  13.690  -1.002
   37    HA   ARG   5           HA       ARG   5   7.983  10.921  -0.404
   38   1HB   ARG   5          1HB       ARG   5  10.040  12.144  -0.704
   39   2HB   ARG   5          2HB       ARG   5   9.732  13.144   0.718
   40   1HG   ARG   5          1HG       ARG   5  10.116  11.323   2.216
   41   2HG   ARG   5          2HG       ARG   5  10.087  10.122   0.905
   42   1HD   ARG   5          1HD       ARG   5  12.151  10.844   0.013
   43   2HD   ARG   5          2HD       ARG   5  12.097  12.391   0.840
   44    HE   ARG   5           HE       ARG   5  12.811   9.753   2.034
   45   1HH1  ARG   5          1HH2      ARG   5  12.607  13.223   2.518
   46   2HH1  ARG   5          2HH2      ARG   5  13.620  13.175   3.934
   47   1HH2  ARG   5          1HH1      ARG   5  14.099   9.777   3.850
   48   2HH2  ARG   5          2HH1      ARG   5  14.430  11.277   4.662
   49    H    GLU   6           H        GLU   6   6.986  13.650   1.604
   50    HA   GLU   6           HA       GLU   6   6.592  12.190   4.047
   51   1HB   GLU   6          1HB       GLU   6   6.751  14.690   3.804
   52   2HB   GLU   6          2HB       GLU   6   5.140  14.695   3.092
   53   1HG   GLU   6          1HG       GLU   6   4.153  13.816   5.136
   54   2HG   GLU   6          2HG       GLU   6   5.747  13.546   5.843
   55    H    LEU   7           H        LEU   7   4.313  13.019   1.413
   56    HA   LEU   7           HA       LEU   7   2.105  11.474   2.383
   57   1HB   LEU   7          1HB       LEU   7   2.910  12.600  -0.340
   58   2HB   LEU   7          2HB       LEU   7   1.546  11.505  -0.169
   59    HG   LEU   7           HG       LEU   7   0.721  13.068   1.693
   60   1HD1  LEU   7          1HD1      LEU   7   2.640  14.529   1.998
   61   2HD1  LEU   7          2HD1      LEU   7   2.595  14.985   0.283
   62   3HD1  LEU   7          3HD1      LEU   7   1.282  15.467   1.379
   63   1HD2  LEU   7          1HD2      LEU   7   0.740  14.073  -1.183
   64   2HD2  LEU   7          2HD2      LEU   7  -0.330  12.804  -0.543
   65   3HD2  LEU   7          3HD2      LEU   7  -0.471  14.452   0.068
   66    H    TYR   8           H        TYR   8   4.513  10.649  -0.119
   67    HA   TYR   8           HA       TYR   8   3.759   8.057  -0.854
   68   1HB   TYR   8          1HB       TYR   8   5.751   9.823  -1.416
   69   2HB   TYR   8          2HB       TYR   8   6.678   8.844  -0.351
   70    HD1  TYR   8           1HD      TYR   8   7.067   9.643  -3.292
   71    HD2  TYR   8           2HD      TYR   8   5.632   6.041  -1.385
   72    HE1  TYR   8           1HE      TYR   8   7.949   8.287  -5.179
   73    HE2  TYR   8           2HE      TYR   8   6.534   4.700  -3.269
   74    HH   TYR   8           HH       TYR   8   7.637   4.727  -5.283
   75    H    LYS   9           H        LYS   9   5.960   8.902   1.848
   76    HA   LYS   9           HA       LYS   9   6.356   6.174   2.586
   77   1HB   LYS   9          1HB       LYS   9   7.815   8.181   3.173
   78   2HB   LYS   9          2HB       LYS   9   6.640   8.597   4.429
   79   1HG   LYS   9          1HG       LYS   9   7.070   6.411   5.539
   80   2HG   LYS   9          2HG       LYS   9   8.171   5.963   4.220
   81   1HD   LYS   9          1HD       LYS   9   9.618   7.944   4.814
   82   2HD   LYS   9          2HD       LYS   9   8.517   8.303   6.147
   83   1HE   LYS   9          1HE       LYS   9  10.367   7.159   7.098
   84   2HE   LYS   9          2HE       LYS   9   9.010   6.031   7.116
   85   1HZ   LYS   9          1HZ       LYS   9   9.971   4.963   5.136
   86   2HZ   LYS   9          2HZ       LYS   9  11.205   6.037   5.103
   87   3HZ   LYS   9          3HZ       LYS   9  11.072   4.984   6.338
   88    H    LEU  10           H        LEU  10   3.993   8.470   3.954
   89    HA   LEU  10           HA       LEU  10   2.882   6.534   5.704
   90   1HB   LEU  10          1HB       LEU  10   1.938   9.204   4.660
   91   2HB   LEU  10          2HB       LEU  10   0.888   8.218   5.677
   92    HG   LEU  10           HG       LEU  10   3.718   8.957   6.540
   93   1HD1  LEU  10          1HD1      LEU  10   2.491  11.019   6.189
   94   2HD1  LEU  10          2HD1      LEU  10   1.120  10.410   7.157
   95   3HD1  LEU  10          3HD1      LEU  10   2.698  10.724   7.920
   96   1HD2  LEU  10          1HD2      LEU  10   1.251   8.066   8.104
   97   2HD2  LEU  10          2HD2      LEU  10   2.688   7.069   7.785
   98   3HD2  LEU  10          3HD2      LEU  10   2.823   8.502   8.805
   99    H    GLU  11           H        GLU  11   2.086   7.460   2.363
  100    HA   GLU  11           HA       GLU  11  -0.008   5.641   1.817
  101   1HB   GLU  11          1HB       GLU  11   2.025   7.238   0.404
  102   2HB   GLU  11          2HB       GLU  11   1.775   5.815  -0.479
  103   1HG   GLU  11          1HG       GLU  11  -0.410   7.714   0.520
  104   2HG   GLU  11          2HG       GLU  11   0.360   7.811  -1.055
  105    H    GLN  12           H        GLN  12   3.581   4.990   1.833
  106    HA   GLN  12           HA       GLN  12   3.089   2.209   1.312
  107   1HB   GLN  12          1HB       GLN  12   5.522   3.852   2.028
  108   2HB   GLN  12          2HB       GLN  12   5.583   2.084   1.879
  109   1HG   GLN  12          1HG       GLN  12   4.639   2.195  -0.362
  110   2HG   GLN  12          2HG       GLN  12   4.578   3.950  -0.300
  111   1HE2  GLN  12          2HE2      GLN  12   6.331   1.643  -1.789
  112   2HE2  GLN  12          1HE2      GLN  12   7.918   2.392  -1.733
  113    H    GLN  13           H        GLN  13   3.243   3.977   4.306
  114    HA   GLN  13           HA       GLN  13   3.745   1.657   5.970
  115   1HB   GLN  13          1HB       GLN  13   2.362   4.321   6.508
  116   2HB   GLN  13          2HB       GLN  13   2.477   3.073   7.742
  117   1HG   GLN  13          1HG       GLN  13   4.942   4.188   6.350
  118   2HG   GLN  13          2HG       GLN  13   4.256   4.886   7.813
  119   1HE2  GLN  13          2HE2      GLN  13   4.439   3.700   9.834
  120   2HE2  GLN  13          1HE2      GLN  13   5.516   2.316   9.945
  121    H    ALA  14           H        ALA  14   0.722   2.857   4.481
  122    HA   ALA  14           HA       ALA  14  -0.917   0.801   5.820
  123   1HB   ALA  14          1HB       ALA  14  -1.921   2.909   4.999
  124   2HB   ALA  14          2HB       ALA  14  -1.382   2.552   3.341
  125   3HB   ALA  14          3HB       ALA  14  -2.593   1.516   4.126
  126    H    MET  15           H        MET  15   0.662   1.137   2.586
  127    HA   MET  15           HA       MET  15  -0.008  -1.431   1.563
  128   1HB   MET  15          1HB       MET  15   1.083   0.501   0.343
  129   2HB   MET  15          2HB       MET  15   2.565   0.170   1.234
  130   1HG   MET  15          1HG       MET  15   2.904  -0.660  -0.882
  131   2HG   MET  15          2HG       MET  15   2.706  -2.068   0.141
  132   1HE   MET  15          1HE       MET  15  -0.146  -3.946  -1.315
  133   2HE   MET  15          2HE       MET  15   1.232  -3.852  -0.201
  134   3HE   MET  15          3HE       MET  15  -0.301  -3.047   0.209
  135    H    LYS  16           H        LYS  16   2.787  -0.604   3.783
  136    HA   LYS  16           HA       LYS  16   3.870  -3.264   3.775
  137   1HB   LYS  16          1HB       LYS  16   4.798  -0.899   4.456
  138   2HB   LYS  16          2HB       LYS  16   4.093  -1.233   6.036
  139   1HG   LYS  16          1HG       LYS  16   6.002  -3.130   4.597
  140   2HG   LYS  16          2HG       LYS  16   6.603  -1.777   5.551
  141   1HD   LYS  16          1HD       LYS  16   5.882  -2.681   7.605
  142   2HD   LYS  16          2HD       LYS  16   4.716  -3.758   6.842
  143   1HE   LYS  16          1HE       LYS  16   6.464  -5.156   7.497
  144   2HE   LYS  16          2HE       LYS  16   6.568  -4.992   5.739
  145   1HZ   LYS  16          1HZ       LYS  16   8.380  -3.381   6.065
  146   2HZ   LYS  16          2HZ       LYS  16   8.268  -3.517   7.692
  147   3HZ   LYS  16          3HZ       LYS  16   8.759  -4.788   6.797
  148    H    LEU  17           H        LEU  17   1.535  -1.535   5.837
  149    HA   LEU  17           HA       LEU  17   1.033  -3.682   7.667
  150   1HB   LEU  17          1HB       LEU  17  -0.234  -1.097   6.822
  151   2HB   LEU  17          2HB       LEU  17  -1.280  -2.199   7.599
  152    HG   LEU  17           HG       LEU  17   1.363  -1.205   8.754
  153   1HD1  LEU  17          1HD1      LEU  17  -0.386   0.534   8.572
  154   2HD1  LEU  17          2HD1      LEU  17  -1.508  -0.498   9.485
  155   3HD1  LEU  17          3HD1      LEU  17  -0.029   0.115  10.255
  156   1HD2  LEU  17          1HD2      LEU  17  -0.834  -2.894  10.039
  157   2HD2  LEU  17          2HD2      LEU  17   0.849  -3.382   9.760
  158   3HD2  LEU  17          3HD2      LEU  17   0.492  -2.112  10.923
  159    H    TYR  18           H        TYR  18  -0.576  -2.843   4.554
  160    HA   TYR  18           HA       TYR  18  -2.385  -4.993   4.478
  161   1HB   TYR  18          1HB       TYR  18  -1.105  -3.092   2.538
  162   2HB   TYR  18          2HB       TYR  18  -1.883  -4.442   1.820
  163    HD1  TYR  18           1HD      TYR  18  -4.303  -4.957   3.255
  164    HD2  TYR  18           2HD      TYR  18  -2.450  -1.158   2.422
  165    HE1  TYR  18           1HE      TYR  18  -6.427  -3.795   3.832
  166    HE2  TYR  18           2HE      TYR  18  -4.590  -0.001   2.948
  167    HH   TYR  18           HH       TYR  18  -6.687  -0.218   3.805
  168    H    ARG  19           H        ARG  19   1.042  -5.000   3.448
  169    HA   ARG  19           HA       ARG  19   1.099  -7.623   2.342
  170   1HB   ARG  19          1HB       ARG  19   2.916  -5.814   2.324
  171   2HB   ARG  19          2HB       ARG  19   3.334  -6.336   3.963
  172   1HG   ARG  19          1HG       ARG  19   3.734  -8.665   3.043
  173   2HG   ARG  19          2HG       ARG  19   3.412  -8.016   1.428
  174   1HD   ARG  19          1HD       ARG  19   5.308  -6.236   2.446
  175   2HD   ARG  19          2HD       ARG  19   5.820  -7.756   3.162
  176    HE   ARG  19           HE       ARG  19   5.985  -6.923   0.379
  177   1HH1  ARG  19          1HH2      ARG  19   5.860  -9.846   2.319
  178   2HH1  ARG  19          2HH2      ARG  19   6.593 -10.804   1.063
  179   1HH2  ARG  19          1HH1      ARG  19   6.908  -8.198  -1.156
  180   2HH2  ARG  19          2HH1      ARG  19   7.172  -9.889  -0.851
  181    H    GLU  20           H        GLU  20   1.440  -6.620   5.743
  182    HA   GLU  20           HA       GLU  20   1.881  -9.401   6.615
  183   1HB   GLU  20          1HB       GLU  20   2.754  -6.856   7.405
  184   2HB   GLU  20          2HB       GLU  20   1.561  -7.228   8.615
  185   1HG   GLU  20          1HG       GLU  20   3.593  -8.007   9.524
  186   2HG   GLU  20          2HG       GLU  20   2.762  -9.464   8.988
  187    H    ALA  21           H        ALA  21  -0.654  -6.986   6.827
  188    HA   ALA  21           HA       ALA  21  -2.501  -8.377   8.509
  189   1HB   ALA  21          1HB       ALA  21  -2.829  -6.056   7.825
  190   2HB   ALA  21          2HB       ALA  21  -2.992  -6.551   6.121
  191   3HB   ALA  21          3HB       ALA  21  -4.215  -7.036   7.310
  192    H    SER  22           H        SER  22  -1.720  -8.818   5.028
  193    HA   SER  22           HA       SER  22  -3.625 -10.785   4.394
  194   1HB   SER  22          1HB       SER  22  -1.860  -9.651   2.912
  195   2HB   SER  22          2HB       SER  22  -0.745 -10.908   3.476
  196    HG   SER  22           HG       SER  22  -3.170 -11.180   2.009
  197    H    GLU  23           H        GLU  23  -0.686 -11.189   6.382
  198    HA   GLU  23           HA       GLU  23  -0.704 -14.086   6.535
  199   1HB   GLU  23          1HB       GLU  23   1.126 -12.365   7.148
  200   2HB   GLU  23          2HB       GLU  23   0.256 -12.197   8.655
  201   1HG   GLU  23          1HG       GLU  23   0.488 -14.641   9.083
  202   2HG   GLU  23          2HG       GLU  23   1.412 -14.791   7.584
  203    H    LYS  24           H        LYS  24  -2.190 -11.516   8.485
  204    HA   LYS  24           HA       LYS  24  -3.515 -13.332  10.397
  205   1HB   LYS  24          1HB       LYS  24  -4.001 -10.399   9.708
  206   2HB   LYS  24          2HB       LYS  24  -5.009 -11.320  10.807
  207   1HG   LYS  24          1HG       LYS  24  -3.630 -10.142  12.192
  208   2HG   LYS  24          2HG       LYS  24  -2.988 -11.772  12.250
  209   1HD   LYS  24          1HD       LYS  24  -1.773  -9.786  10.312
  210   2HD   LYS  24          2HD       LYS  24  -1.465  -9.572  12.035
  211   1HE   LYS  24          1HE       LYS  24  -0.508 -11.795  12.242
  212   2HE   LYS  24          2HE       LYS  24  -0.918 -12.178  10.572
  213   1HZ   LYS  24          1HZ       LYS  24   0.564 -10.348   9.880
  214   2HZ   LYS  24          2HZ       LYS  24   1.027 -10.110  11.446
  215   3HZ   LYS  24          3HZ       LYS  24   1.373 -11.527  10.683
  216    H    ALA  25           H        ALA  25  -4.645 -11.525   7.552
  217    HA   ALA  25           HA       ALA  25  -7.229 -12.775   7.340
  218   1HB   ALA  25          1HB       ALA  25  -6.726 -10.476   6.560
  219   2HB   ALA  25          2HB       ALA  25  -5.613 -11.135   5.342
  220   3HB   ALA  25          3HB       ALA  25  -7.342 -11.484   5.241
  221    H    ARG  26           H        ARG  26  -5.153 -14.776   7.441
  222    HA   ARG  26           HA       ARG  26  -4.572 -16.037   4.968
  223   1HB   ARG  26          1HB       ARG  26  -4.003 -17.936   6.357
  224   2HB   ARG  26          2HB       ARG  26  -3.499 -16.456   7.142
  225   1HG   ARG  26          1HG       ARG  26  -6.056 -16.804   8.225
  226   2HG   ARG  26          2HG       ARG  26  -5.526 -18.469   7.987
  227   1HD   ARG  26          1HD       ARG  26  -3.428 -17.896   9.262
  228   2HD   ARG  26          2HD       ARG  26  -4.079 -16.287   9.564
  229    HE   ARG  26           HE       ARG  26  -4.870 -18.806  10.832
  230   1HH1  ARG  26          1HH2      ARG  26  -5.969 -15.477  10.318
  231   2HH1  ARG  26          2HH2      ARG  26  -7.116 -15.605  11.619
  232   1HH2  ARG  26          1HH1      ARG  26  -6.359 -18.838  12.458
  233   2HH2  ARG  26          2HH1      ARG  26  -7.322 -17.431  12.793
  234    H    ASN  27           H        ASN  27  -7.604 -15.914   6.661
  235    HA   ASN  27           HA       ASN  27  -8.913 -18.124   5.328
  236   1HB   ASN  27          1HB       ASN  27  -9.694 -17.153   7.467
  237   2HB   ASN  27          2HB       ASN  27 -10.018 -15.612   6.672
  238   1HD2  ASN  27          2HD2      ASN  27 -11.479 -18.481   7.673
  239   2HD2  ASN  27          1HD2      ASN  27 -12.882 -18.391   6.618
  240    HA   PRO  28           HA       PRO  28  -8.858 -16.174   1.378
  241   1HB   PRO  28          1HB       PRO  28 -10.701 -17.626  -0.050
  242   2HB   PRO  28          2HB       PRO  28  -9.092 -18.233   0.443
  243   1HG   PRO  28          1HG       PRO  28 -11.750 -18.658   1.838
  244   2HG   PRO  28          2HG       PRO  28 -10.503 -19.882   1.430
  245   1HD   PRO  28          1HD       PRO  28 -10.672 -18.784   3.903
  246   2HD   PRO  28          2HD       PRO  28  -9.077 -19.131   3.163
  247    H    GLU  29           H        GLU  29 -11.858 -16.128   3.214
  248    HA   GLU  29           HA       GLU  29 -13.458 -14.630   1.346
  249   1HB   GLU  29          1HB       GLU  29 -14.162 -15.965   3.458
  250   2HB   GLU  29          2HB       GLU  29 -13.677 -14.550   4.376
  251   1HG   GLU  29          1HG       GLU  29 -16.017 -14.367   4.073
  252   2HG   GLU  29          2HG       GLU  29 -15.308 -13.180   2.988
  253    H    LYS  30           H        LYS  30 -11.501 -13.678   4.078
  254    HA   LYS  30           HA       LYS  30 -11.589 -10.784   3.574
  255   1HB   LYS  30          1HB       LYS  30 -11.232 -12.022   5.845
  256   2HB   LYS  30          2HB       LYS  30  -9.604 -12.348   5.282
  257   1HG   LYS  30          1HG       LYS  30  -9.397 -10.417   6.634
  258   2HG   LYS  30          2HG       LYS  30  -9.312  -9.822   4.989
  259   1HD   LYS  30          1HD       LYS  30 -10.727  -8.273   5.854
  260   2HD   LYS  30          2HD       LYS  30 -11.949  -9.416   5.329
  261   1HE   LYS  30          1HE       LYS  30 -10.770  -9.226   8.151
  262   2HE   LYS  30          2HE       LYS  30 -12.260  -8.445   7.637
  263   1HZ   LYS  30          1HZ       LYS  30 -13.190 -10.668   7.177
  264   2HZ   LYS  30          2HZ       LYS  30 -11.829 -11.378   7.760
  265   3HZ   LYS  30          3HZ       LYS  30 -12.775 -10.496   8.743
  266    H    LYS  31           H        LYS  31  -9.450 -13.428   2.645
  267    HA   LYS  31           HA       LYS  31  -7.204 -11.853   1.926
  268   1HB   LYS  31          1HB       LYS  31  -7.549 -14.463   2.162
  269   2HB   LYS  31          2HB       LYS  31  -7.829 -14.382   0.424
  270   1HG   LYS  31          1HG       LYS  31  -5.339 -13.530   1.969
  271   2HG   LYS  31          2HG       LYS  31  -5.532 -14.966   0.959
  272   1HD   LYS  31          1HD       LYS  31  -5.950 -13.377  -1.010
  273   2HD   LYS  31          2HD       LYS  31  -5.481 -12.063   0.080
  274   1HE   LYS  31          1HE       LYS  31  -3.542 -12.582  -1.184
  275   2HE   LYS  31          2HE       LYS  31  -3.269 -13.169   0.458
  276   1HZ   LYS  31          1HZ       LYS  31  -3.801 -15.417  -0.333
  277   2HZ   LYS  31          2HZ       LYS  31  -4.095 -14.865  -1.846
  278   3HZ   LYS  31          3HZ       LYS  31  -2.589 -14.794  -1.225
  279    H    SER  32           H        SER  32  -9.843 -13.010  -0.097
  280    HA   SER  32           HA       SER  32  -9.049 -11.362  -2.358
  281   1HB   SER  32          1HB       SER  32 -11.646 -12.884  -1.846
  282   2HB   SER  32          2HB       SER  32 -11.152 -12.192  -3.404
  283    HG   SER  32           HG       SER  32 -10.631 -14.432  -3.224
  284    H    VAL  33           H        VAL  33 -10.156 -10.174   0.397
  285    HA   VAL  33           HA       VAL  33 -11.661  -7.944  -0.944
  286    HB   VAL  33           HB       VAL  33 -11.777  -8.890   1.935
  287   1HG1  VAL  33          1HG1      VAL  33 -11.740  -6.442   2.010
  288   2HG1  VAL  33          2HG1      VAL  33 -12.931  -6.353   0.691
  289   3HG1  VAL  33          3HG1      VAL  33 -13.386  -7.009   2.277
  290   1HG2  VAL  33          1HG2      VAL  33 -13.934  -8.498  -0.194
  291   2HG2  VAL  33          2HG2      VAL  33 -13.238 -10.061   0.262
  292   3HG2  VAL  33          3HG2      VAL  33 -14.167  -9.139   1.450
  293    H    LEU  34           H        LEU  34  -9.151  -8.526   1.712
  294    HA   LEU  34           HA       LEU  34  -8.270  -5.786   1.365
  295   1HB   LEU  34          1HB       LEU  34  -6.939  -6.020   3.072
  296   2HB   LEU  34          2HB       LEU  34  -8.063  -7.308   3.472
  297    HG   LEU  34           HG       LEU  34  -5.472  -7.678   2.007
  298   1HD1  LEU  34          1HD1      LEU  34  -5.091  -6.759   4.328
  299   2HD1  LEU  34          2HD1      LEU  34  -5.975  -8.147   4.984
  300   3HD1  LEU  34          3HD1      LEU  34  -4.441  -8.387   4.116
  301   1HD2  LEU  34          1HD2      LEU  34  -7.165  -9.701   3.498
  302   2HD2  LEU  34          2HD2      LEU  34  -6.990  -9.552   1.740
  303   3HD2  LEU  34          3HD2      LEU  34  -5.600 -10.036   2.719
  304    H    GLN  35           H        GLN  35  -7.524  -8.710  -0.478
  305    HA   GLN  35           HA       GLN  35  -5.132  -7.713  -1.663
  306   1HB   GLN  35          1HB       GLN  35  -5.804 -10.036  -1.817
  307   2HB   GLN  35          2HB       GLN  35  -7.238  -9.600  -2.772
  308   1HG   GLN  35          1HG       GLN  35  -5.788  -8.850  -4.621
  309   2HG   GLN  35          2HG       GLN  35  -4.351  -9.111  -3.629
  310   1HE2  GLN  35          2HE2      GLN  35  -3.759 -10.445  -5.624
  311   2HE2  GLN  35          1HE2      GLN  35  -4.315 -12.110  -5.638
  312    H    LYS  36           H        LYS  36  -8.536  -6.909  -2.396
  313    HA   LYS  36           HA       LYS  36  -7.909  -5.682  -4.948
  314   1HB   LYS  36          1HB       LYS  36 -10.200  -6.513  -4.116
  315   2HB   LYS  36          2HB       LYS  36 -10.282  -5.059  -3.112
  316   1HG   LYS  36          1HG       LYS  36 -10.092  -3.660  -5.188
  317   2HG   LYS  36          2HG       LYS  36 -10.016  -5.148  -6.151
  318   1HD   LYS  36          1HD       LYS  36 -12.294  -5.780  -5.237
  319   2HD   LYS  36          2HD       LYS  36 -12.327  -4.237  -4.377
  320   1HE   LYS  36          1HE       LYS  36 -13.613  -3.918  -6.345
  321   2HE   LYS  36          2HE       LYS  36 -12.095  -3.050  -6.591
  322   1HZ   LYS  36          1HZ       LYS  36 -11.330  -4.929  -7.956
  323   2HZ   LYS  36          2HZ       LYS  36 -12.721  -5.747  -7.690
  324   3HZ   LYS  36          3HZ       LYS  36 -12.738  -4.362  -8.547
  325    H    ILE  37           H        ILE  37  -8.118  -4.398  -1.662
  326    HA   ILE  37           HA       ILE  37  -7.303  -1.665  -2.348
  327    HB   ILE  37           HB       ILE  37  -6.909  -3.344   0.166
  328   1HG1  ILE  37          1HG1      ILE  37  -8.974  -1.230  -0.356
  329   2HG1  ILE  37          2HG1      ILE  37  -9.218  -2.989  -0.279
  330   1HG2  ILE  37          1HG2      ILE  37  -5.215  -1.703   0.317
  331   2HG2  ILE  37          2HG2      ILE  37  -6.194  -0.482  -0.502
  332   3HG2  ILE  37          3HG2      ILE  37  -6.547  -0.911   1.163
  333   1HD1  ILE  37          1HD1      ILE  37  -8.408  -2.892   2.128
  334   2HD1  ILE  37          2HD1      ILE  37  -8.590  -1.118   2.003
  335   3HD1  ILE  37          3HD1      ILE  37  -9.988  -2.164   1.782
  336    H    LEU  38           H        LEU  38  -5.330  -4.608  -1.310
  337    HA   LEU  38           HA       LEU  38  -2.921  -3.216  -1.649
  338   1HB   LEU  38          1HB       LEU  38  -1.975  -4.961  -0.808
  339   2HB   LEU  38          2HB       LEU  38  -3.576  -5.608  -0.662
  340    HG   LEU  38           HG       LEU  38  -3.207  -6.564  -3.002
  341   1HD1  LEU  38          1HD1      LEU  38  -1.051  -5.478  -3.629
  342   2HD1  LEU  38          2HD1      LEU  38  -0.281  -6.187  -2.204
  343   3HD1  LEU  38          3HD1      LEU  38  -0.856  -7.220  -3.526
  344   1HD2  LEU  38          1HD2      LEU  38  -1.477  -7.644  -0.714
  345   2HD2  LEU  38          2HD2      LEU  38  -3.221  -7.877  -0.806
  346   3HD2  LEU  38          3HD2      LEU  38  -2.175  -8.598  -2.041
  347    H    GLU  39           H        GLU  39  -4.785  -4.790  -4.253
  348    HA   GLU  39           HA       GLU  39  -2.797  -4.295  -6.274
  349   1HB   GLU  39          1HB       GLU  39  -5.334  -5.545  -6.115
  350   2HB   GLU  39          2HB       GLU  39  -5.591  -4.220  -7.229
  351   1HG   GLU  39          1HG       GLU  39  -3.391  -6.323  -7.443
  352   2HG   GLU  39          2HG       GLU  39  -4.936  -6.395  -8.280
  353    H    ASP  40           H        ASP  40  -5.534  -2.265  -5.149
  354    HA   ASP  40           HA       ASP  40  -5.129  -0.045  -6.940
  355   1HB   ASP  40          1HB       ASP  40  -6.438  -0.632  -4.254
  356   2HB   ASP  40          2HB       ASP  40  -6.218   0.973  -4.687
  357    H    GLU  41           H        GLU  41  -3.684  -1.033  -3.859
  358    HA   GLU  41           HA       GLU  41  -2.745   1.647  -3.276
  359   1HB   GLU  41          1HB       GLU  41  -3.717  -0.183  -1.721
  360   2HB   GLU  41          2HB       GLU  41  -2.123  -0.939  -1.790
  361   1HG   GLU  41          1HG       GLU  41  -2.442   0.311   0.204
  362   2HG   GLU  41          2HG       GLU  41  -1.238   1.165  -0.800
  363    H    GLU  42           H        GLU  42  -1.263  -1.386  -4.395
  364    HA   GLU  42           HA       GLU  42   1.438  -0.445  -4.642
  365   1HB   GLU  42          1HB       GLU  42   0.608  -2.824  -4.866
  366   2HB   GLU  42          2HB       GLU  42  -0.087  -2.399  -6.431
  367   1HG   GLU  42          1HG       GLU  42   2.158  -1.821  -7.293
  368   2HG   GLU  42          2HG       GLU  42   2.866  -2.088  -5.699
  369    H    LYS  43           H        LYS  43  -1.450   0.018  -6.673
  370    HA   LYS  43           HA       LYS  43  -0.099   1.053  -8.974
  371   1HB   LYS  43          1HB       LYS  43  -2.654   0.252  -8.479
  372   2HB   LYS  43          2HB       LYS  43  -2.895   1.978  -8.333
  373   1HG   LYS  43          1HG       LYS  43  -3.360   1.454 -10.592
  374   2HG   LYS  43          2HG       LYS  43  -1.763   2.213 -10.624
  375   1HD   LYS  43          1HD       LYS  43  -0.706  -0.053 -10.753
  376   2HD   LYS  43          2HD       LYS  43  -2.317  -0.792 -10.690
  377   1HE   LYS  43          1HE       LYS  43  -2.928   0.400 -12.789
  378   2HE   LYS  43          2HE       LYS  43  -1.314   1.123 -12.847
  379   1HZ   LYS  43          1HZ       LYS  43  -0.387  -1.126 -13.039
  380   2HZ   LYS  43          2HZ       LYS  43  -1.878  -1.793 -12.981
  381   3HZ   LYS  43          3HZ       LYS  43  -1.450  -0.858 -14.247
  382    H    HIS  44           H        HIS  44  -1.395   2.792  -6.086
  383    HA   HIS  44           HA       HIS  44  -0.931   5.416  -6.946
  384   1HB   HIS  44          1HB       HIS  44  -0.692   4.069  -4.211
  385   2HB   HIS  44          2HB       HIS  44  -0.851   5.770  -4.538
  386    HD2  HIS  44           2HD      HIS  44  -3.210   4.690  -6.919
  387    HE1  HIS  44           1HE      HIS  44  -5.510   4.428  -3.361
  388    HE2  HIS  44           2HE      HIS  44  -5.584   4.346  -5.910
  389    H    ILE  45           H        ILE  45   1.258   3.069  -5.359
  390    HA   ILE  45           HA       ILE  45   3.498   4.851  -5.110
  391    HB   ILE  45           HB       ILE  45   2.990   1.900  -4.848
  392   1HG1  ILE  45          1HG1      ILE  45   4.151   2.282  -2.678
  393   2HG1  ILE  45          2HG1      ILE  45   4.371   3.980  -3.096
  394   1HG2  ILE  45          1HG2      ILE  45   5.053   1.816  -6.126
  395   2HG2  ILE  45          2HG2      ILE  45   5.801   3.032  -5.059
  396   3HG2  ILE  45          3HG2      ILE  45   5.372   1.419  -4.443
  397   1HD1  ILE  45          1HD1      ILE  45   1.903   4.297  -3.046
  398   2HD1  ILE  45          2HD1      ILE  45   1.720   2.569  -2.644
  399   3HD1  ILE  45          3HD1      ILE  45   2.526   3.662  -1.520
  400    H    GLU  46           H        GLU  46   2.502   2.726  -7.869
  401    HA   GLU  46           HA       GLU  46   4.830   3.258  -9.451
  402   1HB   GLU  46          1HB       GLU  46   1.949   2.564 -10.119
  403   2HB   GLU  46          2HB       GLU  46   3.135   2.860 -11.362
  404   1HG   GLU  46          1HG       GLU  46   3.483   0.755  -9.204
  405   2HG   GLU  46          2HG       GLU  46   2.729   0.452 -10.769
  406    H    TRP  47           H        TRP  47   1.751   5.090  -9.146
  407    HA   TRP  47           HA       TRP  47   2.444   7.051 -11.138
  408   1HB   TRP  47          1HB       TRP  47   0.559   7.306  -8.762
  409   2HB   TRP  47          2HB       TRP  47   0.543   8.240 -10.236
  410    HD1  TRP  47           1HD      TRP  47   0.801   5.203 -11.887
  411    HE1  TRP  47           1HE      TRP  47  -1.452   4.025 -12.307
  412    HE3  TRP  47           3HE      TRP  47  -1.995   7.626  -8.423
  413    HZ2  TRP  47           2HZ      TRP  47  -4.137   4.084 -11.168
  414    HZ3  TRP  47           3HZ      TRP  47  -4.382   7.063  -8.036
  415    HH2  TRP  47           2HH      TRP  47  -5.465   5.269  -9.411
  416    H    LEU  48           H        LEU  48   2.707   6.966  -7.590
  417    HA   LEU  48           HA       LEU  48   3.886   9.502  -7.119
  418   1HB   LEU  48          1HB       LEU  48   3.951   6.783  -5.801
  419   2HB   LEU  48          2HB       LEU  48   4.912   8.055  -5.134
  420    HG   LEU  48           HG       LEU  48   1.925   8.347  -5.582
  421   1HD1  LEU  48          1HD1      LEU  48   2.305   6.508  -4.015
  422   2HD1  LEU  48          2HD1      LEU  48   3.435   7.501  -3.075
  423   3HD1  LEU  48          3HD1      LEU  48   1.705   7.921  -3.141
  424   1HD2  LEU  48          1HD2      LEU  48   3.886   9.891  -3.823
  425   2HD2  LEU  48          2HD2      LEU  48   3.138  10.494  -5.316
  426   3HD2  LEU  48          3HD2      LEU  48   2.131  10.159  -3.906
  427    H    GLU  49           H        GLU  49   5.440   6.402  -8.004
  428    HA   GLU  49           HA       GLU  49   8.100   7.432  -8.155
  429   1HB   GLU  49          1HB       GLU  49   7.025   4.962  -8.387
  430   2HB   GLU  49          2HB       GLU  49   7.248   5.277 -10.087
  431   1HG   GLU  49          1HG       GLU  49   9.417   5.476  -7.946
  432   2HG   GLU  49          2HG       GLU  49   9.128   4.057  -8.943
  433    H    THR  50           H        THR  50   5.634   7.130 -10.869
  434    HA   THR  50           HA       THR  50   7.187   8.357 -12.850
  435    HB   THR  50           HB       THR  50   4.191   8.311 -12.331
  436    HG1  THR  50           1HG      THR  50   4.297   6.593 -13.772
  437   1HG2  THR  50          1HG2      THR  50   4.558  10.048 -13.960
  438   2HG2  THR  50          2HG2      THR  50   5.697   9.011 -14.866
  439   3HG2  THR  50          3HG2      THR  50   3.960   8.601 -14.785
  440    H    ILE  51           H        ILE  51   5.562   9.833 -10.170
  441    HA   ILE  51           HA       ILE  51   5.957  12.581 -11.185
  442    HB   ILE  51           HB       ILE  51   4.461  11.334  -8.866
  443   1HG1  ILE  51          1HG1      ILE  51   3.391  11.182 -11.093
  444   2HG1  ILE  51          2HG1      ILE  51   2.457  12.110  -9.939
  445   1HG2  ILE  51          1HG2      ILE  51   5.203  13.352  -7.874
  446   2HG2  ILE  51          2HG2      ILE  51   4.790  14.308  -9.316
  447   3HG2  ILE  51          3HG2      ILE  51   3.509  13.567  -8.317
  448   1HD1  ILE  51          1HD1      ILE  51   3.174  14.221 -11.040
  449   2HD1  ILE  51          2HD1      ILE  51   4.144  13.281 -12.199
  450   3HD1  ILE  51          3HD1      ILE  51   2.384  13.113 -12.170
  451    H    ASN  52           H        ASN  52   7.802  10.485  -9.400
  452    HA   ASN  52           HA       ASN  52   9.227  12.706  -7.963
  453   1HB   ASN  52          1HB       ASN  52   7.806  11.136  -6.579
  454   2HB   ASN  52          2HB       ASN  52   8.964   9.861  -6.955
  455   1HD2  ASN  52          2HD2      ASN  52  11.354  10.574  -6.413
  456   2HD2  ASN  52          1HD2      ASN  52  11.523  11.405  -4.861
  457    H    GLY  53           H        GLY  53  10.140  12.572 -10.312
  458   1HA   GLY  53          1HA       GLY  53  12.318  10.802 -10.942
  459   2HA   GLY  53          2HA       GLY  53  12.079  12.434 -11.569
  460   1H    MET   1          1H        MET   1  -5.488 -10.606  14.875
  461   2H    MET   1          2H        MET   1  -4.295 -10.187  15.922
  462   3H    MET   1          3H        MET   1  -5.141 -11.568  16.150
  463    HA   MET   1           HA       MET   1  -7.177 -10.342  16.534
  464   1HB   MET   1          1HB       MET   1  -4.849  -9.655  18.375
  465   2HB   MET   1          2HB       MET   1  -6.528  -9.230  18.709
  466   1HG   MET   1          1HG       MET   1  -6.060 -11.217  19.900
  467   2HG   MET   1          2HG       MET   1  -7.171 -11.621  18.597
  468   1HE   MET   1          1HE       MET   1  -5.626 -13.775  20.365
  469   2HE   MET   1          2HE       MET   1  -6.747 -14.189  19.046
  470   3HE   MET   1          3HE       MET   1  -5.135 -14.934  19.110
  471    H    ASP   2           H        ASP   2  -4.597  -7.843  17.024
  472    HA   ASP   2           HA       ASP   2  -6.501  -5.790  16.183
  473   1HB   ASP   2          1HB       ASP   2  -4.919  -4.270  17.222
  474   2HB   ASP   2          2HB       ASP   2  -5.429  -5.559  18.299
  475    H    TYR   3           H        TYR   3  -6.490  -6.397  13.902
  476    HA   TYR   3           HA       TYR   3  -4.334  -5.008  12.374
  477   1HB   TYR   3          1HB       TYR   3  -3.949  -6.746  10.926
  478   2HB   TYR   3          2HB       TYR   3  -3.952  -7.506  12.497
  479    HD1  TYR   3           1HD      TYR   3  -5.220  -7.630   9.176
  480    HD2  TYR   3           2HD      TYR   3  -6.231  -8.669  13.229
  481    HE1  TYR   3           1HE      TYR   3  -6.868  -9.280   8.332
  482    HE2  TYR   3           2HE      TYR   3  -7.895 -10.329  12.385
  483    HH   TYR   3           HH       TYR   3  -8.430 -10.863   8.883
  484    H    LEU   4           H        LEU   4  -6.905  -3.994  13.080
  485    HA   LEU   4           HA       LEU   4  -7.792  -3.372  10.333
  486   1HB   LEU   4          1HB       LEU   4 -10.142  -3.510  10.884
  487   2HB   LEU   4          2HB       LEU   4  -9.325  -5.036  11.135
  488    HG   LEU   4           HG       LEU   4  -9.156  -3.904  13.661
  489   1HD1  LEU   4          1HD1      LEU   4 -10.705  -2.050  12.959
  490   2HD1  LEU   4          2HD1      LEU   4 -11.931  -3.272  12.582
  491   3HD1  LEU   4          3HD1      LEU   4 -11.370  -3.066  14.252
  492   1HD2  LEU   4          1HD2      LEU   4 -11.376  -5.693  12.605
  493   2HD2  LEU   4          2HD2      LEU   4  -9.778  -6.225  13.178
  494   3HD2  LEU   4          3HD2      LEU   4 -10.918  -5.485  14.312
  495    H    ARG   5           H        ARG   5  -8.163  -2.136  13.723
  496    HA   ARG   5           HA       ARG   5  -8.583   0.599  12.945
  497   1HB   ARG   5          1HB       ARG   5  -7.767  -0.869  15.427
  498   2HB   ARG   5          2HB       ARG   5  -6.994   0.690  15.272
  499   1HG   ARG   5          1HG       ARG   5  -8.878   1.082  16.553
  500   2HG   ARG   5          2HG       ARG   5  -9.244   1.768  14.969
  501   1HD   ARG   5          1HD       ARG   5 -10.704  -0.113  14.442
  502   2HD   ARG   5          2HD       ARG   5 -10.159  -0.988  15.884
  503    HE   ARG   5           HE       ARG   5 -11.564   1.654  16.101
  504   1HH1  ARG   5          1HH2      ARG   5 -11.563  -1.739  17.012
  505   2HH1  ARG   5          2HH2      ARG   5 -12.751  -1.484  18.258
  506   1HH2  ARG   5          1HH1      ARG   5 -13.050   1.893  17.720
  507   2HH2  ARG   5          2HH1      ARG   5 -13.568   0.510  18.635
  508    H    GLU   6           H        GLU   6  -5.610  -1.226  13.462
  509    HA   GLU   6           HA       GLU   6  -3.738   0.825  13.272
  510   1HB   GLU   6          1HB       GLU   6  -3.456  -1.669  13.936
  511   2HB   GLU   6          2HB       GLU   6  -3.334  -2.013  12.222
  512   1HG   GLU   6          1HG       GLU   6  -1.109  -1.854  13.040
  513   2HG   GLU   6          2HG       GLU   6  -1.375  -0.382  12.119
  514    H    LEU   7           H        LEU   7  -4.930  -1.199  10.580
  515    HA   LEU   7           HA       LEU   7  -3.527   0.084   8.474
  516   1HB   LEU   7          1HB       LEU   7  -6.069  -1.600   8.689
  517   2HB   LEU   7          2HB       LEU   7  -5.531  -0.916   7.155
  518    HG   LEU   7           HG       LEU   7  -3.364  -2.003   7.399
  519   1HD1  LEU   7          1HD1      LEU   7  -4.536  -3.388   9.818
  520   2HD1  LEU   7          2HD1      LEU   7  -3.120  -3.979   8.928
  521   3HD1  LEU   7          3HD1      LEU   7  -3.047  -2.420   9.736
  522   1HD2  LEU   7          1HD2      LEU   7  -5.279  -3.019   6.149
  523   2HD2  LEU   7          2HD2      LEU   7  -4.109  -4.205   6.730
  524   3HD2  LEU   7          3HD2      LEU   7  -5.656  -3.990   7.588
  525    H    TYR   8           H        TYR   8  -6.913   0.507   9.514
  526    HA   TYR   8           HA       TYR   8  -7.742   2.538   7.749
  527   1HB   TYR   8          1HB       TYR   8  -8.784   1.036   9.828
  528   2HB   TYR   8          2HB       TYR   8  -8.608   2.513  10.682
  529    HD1  TYR   8           1HD      TYR   8  -9.489   4.349   8.198
  530    HD2  TYR   8           2HD      TYR   8 -11.096   0.855  10.159
  531    HE1  TYR   8           1HE      TYR   8 -11.801   5.094   7.664
  532    HE2  TYR   8           2HE      TYR   8 -13.400   1.600   9.592
  533    HH   TYR   8           HH       TYR   8 -14.685   3.285   8.694
  534    H    LYS   9           H        LYS   9  -6.281   2.993  11.012
  535    HA   LYS   9           HA       LYS   9  -6.555   5.828  10.816
  536   1HB   LYS   9          1HB       LYS   9  -5.967   4.119  12.899
  537   2HB   LYS   9          2HB       LYS   9  -4.376   4.807  12.606
  538   1HG   LYS   9          1HG       LYS   9  -5.414   6.184  14.250
  539   2HG   LYS   9          2HG       LYS   9  -5.500   7.122  12.752
  540   1HD   LYS   9          1HD       LYS   9  -7.880   6.347  12.450
  541   2HD   LYS   9          2HD       LYS   9  -7.747   5.430  13.961
  542   1HE   LYS   9          1HE       LYS   9  -7.299   7.544  15.192
  543   2HE   LYS   9          2HE       LYS   9  -7.424   8.451  13.679
  544   1HZ   LYS   9          1HZ       LYS   9  -9.739   7.689  13.497
  545   2HZ   LYS   9          2HZ       LYS   9  -9.623   6.868  14.906
  546   3HZ   LYS   9          3HZ       LYS   9  -9.520   8.495  14.899
  547    H    LEU  10           H        LEU  10  -3.716   3.872   9.963
  548    HA   LEU  10           HA       LEU  10  -2.198   6.139   9.160
  549   1HB   LEU  10          1HB       LEU  10  -1.987   3.165   8.743
  550   2HB   LEU  10          2HB       LEU  10  -0.943   4.236   7.811
  551    HG   LEU  10           HG       LEU  10  -1.132   4.499  10.840
  552   1HD1  LEU  10          1HD1      LEU  10  -0.484   2.224  10.441
  553   2HD1  LEU  10          2HD1      LEU  10   0.738   2.714   9.240
  554   3HD1  LEU  10          3HD1      LEU  10   0.939   3.134  10.961
  555   1HD2  LEU  10          1HD2      LEU  10   1.036   5.238   8.819
  556   2HD2  LEU  10          2HD2      LEU  10  -0.068   6.379   9.615
  557   3HD2  LEU  10          3HD2      LEU  10   1.116   5.493  10.576
  558    H    GLU  11           H        GLU  11  -4.357   3.926   7.414
  559    HA   GLU  11           HA       GLU  11  -4.340   5.098   4.830
  560   1HB   GLU  11          1HB       GLU  11  -6.143   3.451   6.525
  561   2HB   GLU  11          2HB       GLU  11  -7.015   4.230   5.330
  562   1HG   GLU  11          1HG       GLU  11  -4.544   2.474   4.870
  563   2HG   GLU  11          2HG       GLU  11  -6.196   1.897   4.817
  564    H    GLN  12           H        GLN  12  -6.146   6.226   7.785
  565    HA   GLN  12           HA       GLN  12  -7.162   8.485   6.340
  566   1HB   GLN  12          1HB       GLN  12  -7.304   7.556   9.197
  567   2HB   GLN  12          2HB       GLN  12  -7.963   9.118   8.674
  568   1HG   GLN  12          1HG       GLN  12  -9.293   8.009   6.934
  569   2HG   GLN  12          2HG       GLN  12  -8.731   6.438   7.455
  570   1HE2  GLN  12          2HE2      GLN  12 -11.504   7.980   7.516
  571   2HE2  GLN  12          1HE2      GLN  12 -12.047   7.652   9.152
  572    H    GLN  13           H        GLN  13  -4.337   8.108   8.351
  573    HA   GLN  13           HA       GLN  13  -3.848  10.986   8.573
  574   1HB   GLN  13          1HB       GLN  13  -2.045   8.539   8.846
  575   2HB   GLN  13          2HB       GLN  13  -1.420  10.190   8.945
  576   1HG   GLN  13          1HG       GLN  13  -2.892  10.704  10.837
  577   2HG   GLN  13          2HG       GLN  13  -3.627   9.109  10.743
  578   1HE2  GLN  13          2HE2      GLN  13  -2.883   7.890  12.478
  579   2HE2  GLN  13          1HE2      GLN  13  -1.208   7.877  13.017
  580    H    ALA  14           H        ALA  14  -2.937   8.529   6.115
  581    HA   ALA  14           HA       ALA  14  -1.515  10.461   4.443
  582   1HB   ALA  14          1HB       ALA  14  -1.201   8.003   4.243
  583   2HB   ALA  14          2HB       ALA  14  -2.906   7.812   3.777
  584   3HB   ALA  14          3HB       ALA  14  -1.786   8.703   2.721
  585    H    MET  15           H        MET  15  -4.913   9.417   4.772
  586    HA   MET  15           HA       MET  15  -5.933  10.884   2.485
  587   1HB   MET  15          1HB       MET  15  -7.179   9.063   3.718
  588   2HB   MET  15          2HB       MET  15  -7.299  10.146   5.100
  589   1HG   MET  15          1HG       MET  15  -9.352  10.352   4.311
  590   2HG   MET  15          2HG       MET  15  -8.620  11.728   3.515
  591   1HE   MET  15          1HE       MET  15  -8.745  10.855  -0.175
  592   2HE   MET  15          2HE       MET  15  -8.332  12.024   1.094
  593   3HE   MET  15          3HE       MET  15  -7.269  10.625   0.781
  594    H    LYS  16           H        LYS  16  -5.628  11.902   5.959
  595    HA   LYS  16           HA       LYS  16  -6.656  14.565   5.489
  596   1HB   LYS  16          1HB       LYS  16  -5.016  13.268   7.673
  597   2HB   LYS  16          2HB       LYS  16  -5.319  15.016   7.650
  598   1HG   LYS  16          1HG       LYS  16  -7.780  14.576   7.464
  599   2HG   LYS  16          2HG       LYS  16  -7.468  12.843   7.666
  600   1HD   LYS  16          1HD       LYS  16  -6.545  13.239   9.901
  601   2HD   LYS  16          2HD       LYS  16  -6.673  15.002   9.672
  602   1HE   LYS  16          1HE       LYS  16  -9.138  14.778   9.399
  603   2HE   LYS  16          2HE       LYS  16  -9.012  13.041   9.695
  604   1HZ   LYS  16          1HZ       LYS  16  -8.151  13.557  11.922
  605   2HZ   LYS  16          2HZ       LYS  16  -8.253  15.163  11.638
  606   3HZ   LYS  16          3HZ       LYS  16  -9.609  14.262  11.717
  607    H    LEU  17           H        LEU  17  -3.326  13.268   5.471
  608    HA   LEU  17           HA       LEU  17  -2.001  15.689   4.789
  609   1HB   LEU  17          1HB       LEU  17  -1.544  12.737   4.578
  610   2HB   LEU  17          2HB       LEU  17  -0.622  13.675   3.478
  611    HG   LEU  17           HG       LEU  17  -0.674  14.133   6.495
  612   1HD1  LEU  17          1HD1      LEU  17   0.314  11.964   5.853
  613   2HD1  LEU  17          2HD1      LEU  17   1.427  12.792   4.739
  614   3HD1  LEU  17          3HD1      LEU  17   1.534  13.080   6.491
  615   1HD2  LEU  17          1HD2      LEU  17   1.176  15.263   4.341
  616   2HD2  LEU  17          2HD2      LEU  17   0.011  16.192   5.306
  617   3HD2  LEU  17          3HD2      LEU  17   1.402  15.450   6.092
  618    H    TYR  18           H        TYR  18  -3.503  13.243   2.660
  619    HA   TYR  18           HA       TYR  18  -3.116  14.573   0.200
  620   1HB   TYR  18          1HB       TYR  18  -4.863  12.395   1.248
  621   2HB   TYR  18          2HB       TYR  18  -5.454  13.136  -0.183
  622    HD1  TYR  18           1HD      TYR  18  -3.364  13.648  -1.972
  623    HD2  TYR  18           2HD      TYR  18  -3.628  10.431   0.873
  624    HE1  TYR  18           1HE      TYR  18  -1.516  12.439  -3.158
  625    HE2  TYR  18           2HE      TYR  18  -1.808   9.235  -0.306
  626    HH   TYR  18           HH       TYR  18  -0.242   9.324  -1.998
  627    H    ARG  19           H        ARG  19  -5.858  14.960   2.468
  628    HA   ARG  19           HA       ARG  19  -7.402  16.744   0.894
  629   1HB   ARG  19          1HB       ARG  19  -8.069  15.569   3.045
  630   2HB   ARG  19          2HB       ARG  19  -7.090  16.733   3.930
  631   1HG   ARG  19          1HG       ARG  19  -9.360  17.415   4.092
  632   2HG   ARG  19          2HG       ARG  19  -8.550  18.584   3.051
  633   1HD   ARG  19          1HD       ARG  19  -9.499  17.498   1.050
  634   2HD   ARG  19          2HD       ARG  19 -10.228  16.235   2.041
  635    HE   ARG  19           HE       ARG  19 -11.166  18.987   1.646
  636   1HH1  ARG  19          1HH2      ARG  19 -11.518  16.201   3.754
  637   2HH1  ARG  19          2HH2      ARG  19 -13.061  16.744   4.352
  638   1HH2  ARG  19          1HH1      ARG  19 -13.137  19.602   2.449
  639   2HH2  ARG  19          2HH1      ARG  19 -13.947  18.614   3.629
  640    H    GLU  20           H        GLU  20  -4.717  17.509   3.112
  641    HA   GLU  20           HA       GLU  20  -4.886  20.403   2.582
  642   1HB   GLU  20          1HB       GLU  20  -3.933  18.920   4.646
  643   2HB   GLU  20          2HB       GLU  20  -2.432  19.120   3.768
  644   1HG   GLU  20          1HG       GLU  20  -2.733  21.588   3.772
  645   2HG   GLU  20          2HG       GLU  20  -4.266  21.405   4.626
  646    H    ALA  21           H        ALA  21  -2.747  17.774   1.587
  647    HA   ALA  21           HA       ALA  21  -1.013  19.262  -0.093
  648   1HB   ALA  21          1HB       ALA  21  -0.624  16.921   0.489
  649   2HB   ALA  21          2HB       ALA  21  -2.028  16.425  -0.491
  650   3HB   ALA  21          3HB       ALA  21  -0.606  17.148  -1.269
  651    H    SER  22           H        SER  22  -4.358  18.134  -0.800
  652    HA   SER  22           HA       SER  22  -4.483  18.967  -3.518
  653   1HB   SER  22          1HB       SER  22  -6.215  17.678  -2.233
  654   2HB   SER  22          2HB       SER  22  -6.711  19.204  -1.473
  655    HG   SER  22           HG       SER  22  -7.944  18.663  -3.358
  656    H    GLU  23           H        GLU  23  -4.599  21.009  -0.554
  657    HA   GLU  23           HA       GLU  23  -5.167  23.454  -2.083
  658   1HB   GLU  23          1HB       GLU  23  -5.592  22.952   0.452
  659   2HB   GLU  23          2HB       GLU  23  -3.886  23.307   0.649
  660   1HG   GLU  23          1HG       GLU  23  -5.021  25.321   1.125
  661   2HG   GLU  23          2HG       GLU  23  -4.277  25.554  -0.450
  662    H    LYS  24           H        LYS  24  -2.296  21.916  -0.637
  663    HA   LYS  24           HA       LYS  24  -0.390  23.901  -1.411
  664   1HB   LYS  24          1HB       LYS  24  -0.303  21.829   0.274
  665   2HB   LYS  24          2HB       LYS  24   0.441  21.013  -1.109
  666   1HG   LYS  24          1HG       LYS  24   2.138  22.871  -1.216
  667   2HG   LYS  24          2HG       LYS  24   1.349  23.630   0.181
  668   1HD   LYS  24          1HD       LYS  24   1.777  21.430   1.440
  669   2HD   LYS  24          2HD       LYS  24   2.829  20.970   0.101
  670   1HE   LYS  24          1HE       LYS  24   3.111  23.416   1.913
  671   2HE   LYS  24          2HE       LYS  24   4.074  21.943   2.011
  672   1HZ   LYS  24          1HZ       LYS  24   4.932  22.451  -0.230
  673   2HZ   LYS  24          2HZ       LYS  24   4.081  23.849  -0.268
  674   3HZ   LYS  24          3HZ       LYS  24   5.276  23.654   0.820
  675    H    ALA  25           H        ALA  25  -1.658  21.215  -3.215
  676    HA   ALA  25           HA       ALA  25   0.243  21.479  -5.450
  677   1HB   ALA  25          1HB       ALA  25  -0.289  19.264  -4.398
  678   2HB   ALA  25          2HB       ALA  25  -1.989  19.469  -4.885
  679   3HB   ALA  25          3HB       ALA  25  -0.735  19.318  -6.115
  680    H    ARG  26           H        ARG  26  -1.733  23.664  -5.094
  681    HA   ARG  26           HA       ARG  26  -4.106  23.310  -6.501
  682   1HB   ARG  26          1HB       ARG  26  -4.240  25.800  -6.518
  683   2HB   ARG  26          2HB       ARG  26  -3.953  25.052  -4.966
  684   1HG   ARG  26          1HG       ARG  26  -2.700  27.132  -5.261
  685   2HG   ARG  26          2HG       ARG  26  -1.627  25.769  -4.941
  686   1HD   ARG  26          1HD       ARG  26  -0.844  25.703  -7.179
  687   2HD   ARG  26          2HD       ARG  26  -2.223  26.655  -7.762
  688    HE   ARG  26           HE       ARG  26  -0.561  28.115  -5.870
  689   1HH1  ARG  26          1HH2      ARG  26  -0.785  27.293  -9.275
  690   2HH1  ARG  26          2HH2      ARG  26   0.148  28.681  -9.761
  691   1HH2  ARG  26          1HH1      ARG  26   0.612  29.873  -6.575
  692   2HH2  ARG  26          2HH1      ARG  26   0.915  30.092  -8.272
  693    H    ASN  27           H        ASN  27  -1.138  23.429  -8.085
  694    HA   ASN  27           HA       ASN  27  -1.891  24.547 -10.629
  695   1HB   ASN  27          1HB       ASN  27   0.436  24.109  -9.887
  696   2HB   ASN  27          2HB       ASN  27   0.126  22.373  -9.878
  697   1HD2  ASN  27          2HD2      ASN  27   1.836  24.463 -11.586
  698   2HD2  ASN  27          1HD2      ASN  27   1.570  23.829 -13.203
  699    HA   PRO  28           HA       PRO  28  -5.028  21.514 -11.415
  700   1HB   PRO  28          1HB       PRO  28  -5.458  21.794 -14.129
  701   2HB   PRO  28          2HB       PRO  28  -6.017  22.947 -12.881
  702   1HG   PRO  28          1HG       PRO  28  -3.510  23.106 -14.578
  703   2HG   PRO  28          2HG       PRO  28  -4.713  24.396 -14.251
  704   1HD   PRO  28          1HD       PRO  28  -2.390  24.242 -12.867
  705   2HD   PRO  28          2HD       PRO  28  -3.913  24.700 -12.039
  706    H    GLU  29           H        GLU  29  -2.007  21.305 -13.252
  707    HA   GLU  29           HA       GLU  29  -2.312  18.726 -14.394
  708   1HB   GLU  29          1HB       GLU  29  -0.457  20.534 -14.688
  709   2HB   GLU  29          2HB       GLU  29   0.269  19.846 -13.246
  710   1HG   GLU  29          1HG       GLU  29   1.384  18.825 -15.042
  711   2HG   GLU  29          2HG       GLU  29   0.280  17.588 -14.456
  712    H    LYS  30           H        LYS  30  -0.981  19.663 -11.281
  713    HA   LYS  30           HA       LYS  30  -0.692  16.922 -10.281
  714   1HB   LYS  30          1HB       LYS  30   0.792  19.027  -9.872
  715   2HB   LYS  30          2HB       LYS  30  -0.414  19.495  -8.670
  716   1HG   LYS  30          1HG       LYS  30   0.030  17.420  -7.394
  717   2HG   LYS  30          2HG       LYS  30   1.054  16.813  -8.710
  718   1HD   LYS  30          1HD       LYS  30   2.511  18.905  -8.370
  719   2HD   LYS  30          2HD       LYS  30   1.610  19.156  -6.856
  720   1HE   LYS  30          1HE       LYS  30   2.252  16.848  -6.144
  721   2HE   LYS  30          2HE       LYS  30   3.129  16.636  -7.670
  722   1HZ   LYS  30          1HZ       LYS  30   4.521  18.571  -7.003
  723   2HZ   LYS  30          2HZ       LYS  30   3.761  18.608  -5.546
  724   3HZ   LYS  30          3HZ       LYS  30   4.675  17.313  -5.974
  725    H    LYS  31           H        LYS  31  -2.889  19.646  -9.571
  726    HA   LYS  31           HA       LYS  31  -4.407  18.337  -7.602
  727   1HB   LYS  31          1HB       LYS  31  -4.459  20.774  -8.226
  728   2HB   LYS  31          2HB       LYS  31  -5.566  20.349  -9.540
  729   1HG   LYS  31          1HG       LYS  31  -7.237  19.573  -7.990
  730   2HG   LYS  31          2HG       LYS  31  -6.076  19.511  -6.651
  731   1HD   LYS  31          1HD       LYS  31  -5.878  21.962  -6.675
  732   2HD   LYS  31          2HD       LYS  31  -7.066  22.058  -7.997
  733   1HE   LYS  31          1HE       LYS  31  -8.770  21.005  -6.562
  734   2HE   LYS  31          2HE       LYS  31  -7.577  20.760  -5.278
  735   1HZ   LYS  31          1HZ       LYS  31  -7.391  23.158  -5.047
  736   2HZ   LYS  31          2HZ       LYS  31  -8.454  23.422  -6.265
  737   3HZ   LYS  31          3HZ       LYS  31  -8.953  22.727  -4.877
  738    H    SER  32           H        SER  32  -4.494  17.788 -11.021
  739    HA   SER  32           HA       SER  32  -6.816  15.956 -10.739
  740   1HB   SER  32          1HB       SER  32  -5.271  16.650 -13.271
  741   2HB   SER  32          2HB       SER  32  -6.850  15.855 -13.158
  742    HG   SER  32           HG       SER  32  -6.139  18.539 -12.666
  743    H    VAL  33           H        VAL  33  -3.703  15.536 -10.067
  744    HA   VAL  33           HA       VAL  33  -3.663  12.673 -10.996
  745    HB   VAL  33           HB       VAL  33  -1.393  14.582 -10.389
  746   1HG1  VAL  33          1HG1      VAL  33  -0.757  12.505  -9.262
  747   2HG1  VAL  33          2HG1      VAL  33  -1.235  11.549 -10.686
  748   3HG1  VAL  33          3HG1      VAL  33   0.150  12.659 -10.766
  749   1HG2  VAL  33          1HG2      VAL  33  -1.969  12.749 -12.765
  750   2HG2  VAL  33          2HG2      VAL  33  -2.360  14.475 -12.718
  751   3HG2  VAL  33          3HG2      VAL  33  -0.671  13.957 -12.637
  752    H    LEU  34           H        LEU  34  -2.936  14.792  -8.076
  753    HA   LEU  34           HA       LEU  34  -2.997  12.438  -6.380
  754   1HB   LEU  34          1HB       LEU  34  -2.406  13.696  -4.714
  755   2HB   LEU  34          2HB       LEU  34  -1.816  14.736  -5.995
  756    HG   LEU  34           HG       LEU  34  -4.473  15.004  -4.622
  757   1HD1  LEU  34          1HD1      LEU  34  -2.460  15.319  -3.057
  758   2HD1  LEU  34          2HD1      LEU  34  -1.954  16.663  -4.085
  759   3HD1  LEU  34          3HD1      LEU  34  -3.499  16.738  -3.209
  760   1HD2  LEU  34          1HD2      LEU  34  -2.935  17.045  -6.243
  761   2HD2  LEU  34          2HD2      LEU  34  -4.402  16.176  -6.760
  762   3HD2  LEU  34          3HD2      LEU  34  -4.483  17.323  -5.413
  763    H    GLN  35           H        GLN  35  -5.568  14.293  -7.831
  764    HA   GLN  35           HA       GLN  35  -7.646  13.707  -5.994
  765   1HB   GLN  35          1HB       GLN  35  -7.884  15.318  -7.769
  766   2HB   GLN  35          2HB       GLN  35  -7.704  14.063  -9.012
  767   1HG   GLN  35          1HG       GLN  35  -9.853  13.051  -8.273
  768   2HG   GLN  35          2HG       GLN  35  -9.958  14.231  -6.962
  769   1HE2  GLN  35          2HE2      GLN  35 -12.010  15.041  -7.759
  770   2HE2  GLN  35          1HE2      GLN  35 -12.069  16.006  -9.226
  771    H    LYS  36           H        LYS  36  -6.358  11.651  -8.673
  772    HA   LYS  36           HA       LYS  36  -8.432   9.642  -8.316
  773   1HB   LYS  36          1HB       LYS  36  -5.770   9.730  -9.793
  774   2HB   LYS  36          2HB       LYS  36  -6.624   8.196  -9.591
  775   1HG   LYS  36          1HG       LYS  36  -8.626   9.069 -10.651
  776   2HG   LYS  36          2HG       LYS  36  -7.892  10.672 -10.828
  777   1HD   LYS  36          1HD       LYS  36  -6.241   9.827 -12.383
  778   2HD   LYS  36          2HD       LYS  36  -6.721   8.147 -12.077
  779   1HE   LYS  36          1HE       LYS  36  -8.948   8.565 -13.014
  780   2HE   LYS  36          2HE       LYS  36  -8.564  10.270 -13.257
  781   1HZ   LYS  36          1HZ       LYS  36  -6.862   9.607 -14.853
  782   2HZ   LYS  36          2HZ       LYS  36  -7.160   8.023 -14.602
  783   3HZ   LYS  36          3HZ       LYS  36  -8.290   8.965 -15.299
  784    H    ILE  37           H        ILE  37  -5.235  10.005  -6.852
  785    HA   ILE  37           HA       ILE  37  -5.370   7.501  -5.337
  786    HB   ILE  37           HB       ILE  37  -3.964  10.150  -4.789
  787   1HG1  ILE  37          1HG1      ILE  37  -2.815   7.624  -5.947
  788   2HG1  ILE  37          2HG1      ILE  37  -3.138   9.157  -6.778
  789   1HG2  ILE  37          1HG2      ILE  37  -4.196   9.085  -2.648
  790   2HG2  ILE  37          2HG2      ILE  37  -3.869   7.485  -3.334
  791   3HG2  ILE  37          3HG2      ILE  37  -2.571   8.662  -3.158
  792   1HD1  ILE  37          1HD1      ILE  37  -1.478  10.271  -5.246
  793   2HD1  ILE  37          2HD1      ILE  37  -1.000   8.640  -4.701
  794   3HD1  ILE  37          3HD1      ILE  37  -0.807   9.095  -6.392
  795    H    LEU  38           H        LEU  38  -6.291  10.937  -4.474
  796    HA   LEU  38           HA       LEU  38  -7.294  10.121  -1.965
  797   1HB   LEU  38          1HB       LEU  38  -7.620  12.249  -1.506
  798   2HB   LEU  38          2HB       LEU  38  -6.666  12.461  -2.940
  799    HG   LEU  38           HG       LEU  38  -8.976  12.471  -4.146
  800   1HD1  LEU  38          1HD1      LEU  38 -10.437  11.955  -2.197
  801   2HD1  LEU  38          2HD1      LEU  38  -9.802  13.372  -1.348
  802   3HD1  LEU  38          3HD1      LEU  38 -10.778  13.565  -2.818
  803   1HD2  LEU  38          1HD2      LEU  38  -8.134  14.830  -2.390
  804   2HD2  LEU  38          2HD2      LEU  38  -7.382  14.416  -3.937
  805   3HD2  LEU  38          3HD2      LEU  38  -9.077  14.931  -3.894
  806    H    GLU  39           H        GLU  39  -9.017  10.132  -5.091
  807    HA   GLU  39           HA       GLU  39 -11.543   9.390  -3.910
  808   1HB   GLU  39          1HB       GLU  39 -11.264  10.390  -6.181
  809   2HB   GLU  39          2HB       GLU  39 -10.431   8.927  -6.722
  810   1HG   GLU  39          1HG       GLU  39 -12.485   7.602  -6.353
  811   2HG   GLU  39          2HG       GLU  39 -13.307   9.029  -5.714
  812    H    ASP  40           H        ASP  40  -8.814   7.421  -5.147
  813    HA   ASP  40           HA       ASP  40  -9.986   4.851  -4.688
  814   1HB   ASP  40          1HB       ASP  40  -7.253   6.097  -5.043
  815   2HB   ASP  40          2HB       ASP  40  -7.312   4.545  -4.369
  816    H    GLU  41           H        GLU  41  -8.304   7.166  -2.504
  817    HA   GLU  41           HA       GLU  41  -8.135   5.175  -0.348
  818   1HB   GLU  41          1HB       GLU  41  -7.916   8.195  -0.118
  819   2HB   GLU  41          2HB       GLU  41  -7.572   7.030   1.149
  820   1HG   GLU  41          1HG       GLU  41  -5.939   7.654  -1.302
  821   2HG   GLU  41          2HG       GLU  41  -5.507   7.817   0.376
  822    H    GLU  42           H        GLU  42 -10.411   7.811  -1.157
  823    HA   GLU  42           HA       GLU  42 -12.146   7.436   1.074
  824   1HB   GLU  42          1HB       GLU  42 -12.256   9.310  -0.561
  825   2HB   GLU  42          2HB       GLU  42 -12.908   8.200  -1.773
  826   1HG   GLU  42          1HG       GLU  42 -14.879   7.774  -0.362
  827   2HG   GLU  42          2HG       GLU  42 -14.191   8.751   0.937
  828    H    LYS  43           H        LYS  43 -11.914   5.619  -1.991
  829    HA   LYS  43           HA       LYS  43 -14.127   3.854  -1.396
  830   1HB   LYS  43          1HB       LYS  43 -12.528   4.316  -3.646
  831   2HB   LYS  43          2HB       LYS  43 -11.996   2.729  -3.126
  832   1HG   LYS  43          1HG       LYS  43 -13.784   2.353  -4.639
  833   2HG   LYS  43          2HG       LYS  43 -14.489   2.084  -3.038
  834   1HD   LYS  43          1HD       LYS  43 -15.332   4.496  -3.111
  835   2HD   LYS  43          2HD       LYS  43 -14.770   4.588  -4.777
  836   1HE   LYS  43          1HE       LYS  43 -16.816   2.584  -3.704
  837   2HE   LYS  43          2HE       LYS  43 -17.225   4.114  -4.481
  838   1HZ   LYS  43          1HZ       LYS  43 -16.122   3.326  -6.503
  839   2HZ   LYS  43          2HZ       LYS  43 -15.761   1.892  -5.803
  840   3HZ   LYS  43          3HZ       LYS  43 -17.315   2.304  -6.070
  841    H    HIS  44           H        HIS  44 -10.563   3.506  -0.649
  842    HA   HIS  44           HA       HIS  44 -10.766   0.937   0.486
  843   1HB   HIS  44          1HB       HIS  44  -8.976   3.342   1.094
  844   2HB   HIS  44          2HB       HIS  44  -8.742   1.702   1.604
  845    HD2  HIS  44           2HD      HIS  44  -9.840   1.072  -1.711
  846    HE1  HIS  44           1HE      HIS  44  -5.749   1.926  -2.393
  847    HE2  HIS  44           2HE      HIS  44  -7.898   1.065  -3.428
  848    H    ILE  45           H        ILE  45 -11.116   4.195   1.948
  849    HA   ILE  45           HA       ILE  45 -11.706   3.294   4.598
  850    HB   ILE  45           HB       ILE  45 -11.954   5.866   3.051
  851   1HG1  ILE  45          1HG1      ILE  45 -10.786   6.703   5.183
  852   2HG1  ILE  45          2HG1      ILE  45 -10.688   5.022   5.695
  853   1HG2  ILE  45          1HG2      ILE  45 -14.105   5.894   4.157
  854   2HG2  ILE  45          2HG2      ILE  45 -13.351   5.460   5.715
  855   3HG2  ILE  45          3HG2      ILE  45 -13.019   7.030   4.942
  856   1HD1  ILE  45          1HD1      ILE  45  -9.382   6.259   3.248
  857   2HD1  ILE  45          2HD1      ILE  45  -8.592   5.790   4.750
  858   3HD1  ILE  45          3HD1      ILE  45  -9.268   4.531   3.698
  859    H    GLU  46           H        GLU  46 -13.993   3.886   1.841
  860    HA   GLU  46           HA       GLU  46 -16.380   3.306   3.247
  861   1HB   GLU  46          1HB       GLU  46 -15.450   2.908   0.395
  862   2HB   GLU  46          2HB       GLU  46 -16.973   2.228   0.899
  863   1HG   GLU  46          1HG       GLU  46 -16.288   5.165   1.191
  864   2HG   GLU  46          2HG       GLU  46 -17.072   4.463  -0.226
  865    H    TRP  47           H        TRP  47 -14.111   1.004   1.672
  866    HA   TRP  47           HA       TRP  47 -15.705  -1.285   2.362
  867   1HB   TRP  47          1HB       TRP  47 -12.759  -1.134   1.643
  868   2HB   TRP  47          2HB       TRP  47 -13.797  -2.527   1.524
  869    HD1  TRP  47           1HD      TRP  47 -16.130  -0.623  -0.143
  870    HE1  TRP  47           1HE      TRP  47 -15.643  -0.146  -2.616
  871    HE3  TRP  47           3HE      TRP  47 -11.200  -1.806  -0.226
  872    HZ2  TRP  47           2HZ      TRP  47 -13.375  -0.333  -4.437
  873    HZ3  TRP  47           3HZ      TRP  47  -9.857  -1.708  -2.322
  874    HH2  TRP  47           2HH      TRP  47 -10.946  -0.930  -4.439
  875    H    LEU  48           H        LEU  48 -12.841   0.236   3.827
  876    HA   LEU  48           HA       LEU  48 -12.311  -1.575   5.940
  877   1HB   LEU  48          1HB       LEU  48 -11.967   1.387   5.455
  878   2HB   LEU  48          2HB       LEU  48 -11.573   0.777   7.023
  879    HG   LEU  48           HG       LEU  48 -10.366  -0.362   4.482
  880   1HD1  LEU  48          1HD1      LEU  48  -9.736   1.997   4.659
  881   2HD1  LEU  48          2HD1      LEU  48  -9.306   1.785   6.366
  882   3HD1  LEU  48          3HD1      LEU  48  -8.352   0.988   5.093
  883   1HD2  LEU  48          1HD2      LEU  48  -9.502  -0.533   7.409
  884   2HD2  LEU  48          2HD2      LEU  48 -10.198  -1.860   6.454
  885   3HD2  LEU  48          3HD2      LEU  48  -8.616  -1.208   6.025
  886    H    GLU  49           H        GLU  49 -14.573   1.190   5.883
  887    HA   GLU  49           HA       GLU  49 -15.636   0.755   8.538
  888   1HB   GLU  49          1HB       GLU  49 -15.980   2.771   6.860
  889   2HB   GLU  49          2HB       GLU  49 -17.278   1.809   6.192
  890   1HG   GLU  49          1HG       GLU  49 -18.296   1.642   8.496
  891   2HG   GLU  49          2HG       GLU  49 -17.033   2.714   9.094
  892    H    THR  50           H        THR  50 -16.622  -0.437   5.370
  893    HA   THR  50           HA       THR  50 -18.947  -1.891   6.206
  894    HB   THR  50           HB       THR  50 -17.117  -1.981   3.813
  895    HG1  THR  50           1HG      THR  50 -19.879  -1.397   4.107
  896   1HG2  THR  50          1HG2      THR  50 -17.831  -4.254   3.909
  897   2HG2  THR  50          2HG2      THR  50 -19.521  -3.760   4.224
  898   3HG2  THR  50          3HG2      THR  50 -18.743  -3.405   2.651
  899    H    ILE  51           H        ILE  51 -15.583  -2.774   6.211
  900    HA   ILE  51           HA       ILE  51 -16.102  -5.514   7.122
  901    HB   ILE  51           HB       ILE  51 -13.625  -3.903   6.449
  902   1HG1  ILE  51          1HG1      ILE  51 -14.984  -4.752   4.546
  903   2HG1  ILE  51          2HG1      ILE  51 -13.355  -5.391   4.582
  904   1HG2  ILE  51          1HG2      ILE  51 -12.802  -5.288   8.202
  905   2HG2  ILE  51          2HG2      ILE  51 -13.638  -6.719   7.564
  906   3HG2  ILE  51          3HG2      ILE  51 -12.270  -5.993   6.675
  907   1HD1  ILE  51          1HD1      ILE  51 -14.193  -7.562   5.417
  908   2HD1  ILE  51          2HD1      ILE  51 -15.852  -6.913   5.467
  909   3HD1  ILE  51          3HD1      ILE  51 -15.013  -7.088   3.923
  910    H    ASN  52           H        ASN  52 -15.862  -2.568   8.674
  911    HA   ASN  52           HA       ASN  52 -15.094  -3.825  11.275
  912   1HB   ASN  52          1HB       ASN  52 -13.663  -1.974  10.474
  913   2HB   ASN  52          2HB       ASN  52 -15.065  -0.899  10.480
  914   1HD2  ASN  52          2HD2      ASN  52 -13.695   0.396  11.995
  915   2HD2  ASN  52          1HD2      ASN  52 -13.700  -0.070  13.689
  916    H    GLY  53           H        GLY  53 -17.286  -4.792  11.138
  917   1HA   GLY  53          1HA       GLY  53 -19.181  -3.274  12.823
  918   2HA   GLY  53          2HA       GLY  53 -19.787  -3.802  11.252
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1   8.477  23.195  -2.989
    2   2H    MET   1          2H        MET   1   6.869  22.974  -3.151
    3   3H    MET   1          3H        MET   1   7.444  24.318  -2.402
    4    HA   MET   1           HA       MET   1   8.343  23.016  -0.598
    5   1HB   MET   1          1HB       MET   1   5.393  22.437  -1.121
    6   2HB   MET   1          2HB       MET   1   6.226  22.173   0.414
    7   1HG   MET   1          1HG       MET   1   6.821  24.631   0.444
    8   2HG   MET   1          2HG       MET   1   5.782  24.834  -0.969
    9   1HE   MET   1          1HE       MET   1   5.464  22.873   2.547
   10   2HE   MET   1          2HE       MET   1   6.054  24.524   2.852
   11   3HE   MET   1          3HE       MET   1   4.426  24.050   3.379
   12    H    ASP   2           H        ASP   2   7.992  20.805   0.563
   13    HA   ASP   2           HA       ASP   2   9.029  18.758  -1.331
   14   1HB   ASP   2          1HB       ASP   2  10.672  18.298   0.343
   15   2HB   ASP   2          2HB       ASP   2  10.648  20.030   0.053
   16    H    TYR   3           H        TYR   3   6.231  18.989  -0.029
   17    HA   TYR   3           HA       TYR   3   5.901  17.103   1.998
   18   1HB   TYR   3          1HB       TYR   3   3.475  17.243   1.416
   19   2HB   TYR   3          2HB       TYR   3   4.253  18.808   1.547
   20    HD1  TYR   3           1HD      TYR   3   2.747  16.364  -0.811
   21    HD2  TYR   3           2HD      TYR   3   4.569  20.254  -0.403
   22    HE1  TYR   3           1HE      TYR   3   2.044  16.942  -3.128
   23    HE2  TYR   3           2HE      TYR   3   3.882  20.814  -2.733
   24    HH   TYR   3           HH       TYR   3   2.069  18.521  -4.790
   25    H    LEU   4           H        LEU   4   6.205  16.419  -1.290
   26    HA   LEU   4           HA       LEU   4   4.565  14.128  -1.499
   27   1HB   LEU   4          1HB       LEU   4   5.494  13.743  -3.647
   28   2HB   LEU   4          2HB       LEU   4   5.305  15.467  -3.372
   29    HG   LEU   4           HG       LEU   4   7.882  15.203  -2.589
   30   1HD1  LEU   4          1HD1      LEU   4   9.094  13.725  -4.121
   31   2HD1  LEU   4          2HD1      LEU   4   7.980  12.751  -3.157
   32   3HD1  LEU   4          3HD1      LEU   4   7.571  13.153  -4.834
   33   1HD2  LEU   4          1HD2      LEU   4   6.958  15.466  -5.480
   34   2HD2  LEU   4          2HD2      LEU   4   7.064  16.782  -4.288
   35   3HD2  LEU   4          3HD2      LEU   4   8.538  15.975  -4.843
   36    H    ARG   5           H        ARG   5   7.964  14.174  -0.511
   37    HA   ARG   5           HA       ARG   5   8.283  11.284  -0.596
   38   1HB   ARG   5          1HB       ARG   5  10.120  13.075  -0.655
   39   2HB   ARG   5          2HB       ARG   5   9.888  13.256   1.090
   40   1HG   ARG   5          1HG       ARG   5  10.406  10.796   1.354
   41   2HG   ARG   5          2HG       ARG   5  10.670  10.705  -0.400
   42   1HD   ARG   5          1HD       ARG   5  12.457  12.477  -0.144
   43   2HD   ARG   5          2HD       ARG   5  12.236  12.365   1.615
   44    HE   ARG   5           HE       ARG   5  12.742   9.776   0.383
   45   1HH1  ARG   5          1HH2      ARG   5  14.433  12.608   1.570
   46   2HH1  ARG   5          2HH2      ARG   5  15.929  11.738   1.774
   47   1HH2  ARG   5          1HH1      ARG   5  14.687   8.739   0.640
   48   2HH2  ARG   5          2HH1      ARG   5  16.062   9.608   1.254
   49    H    GLU   6           H        GLU   6   7.398  13.584   1.926
   50    HA   GLU   6           HA       GLU   6   7.126  11.772   4.125
   51   1HB   GLU   6          1HB       GLU   6   7.156  14.368   4.065
   52   2HB   GLU   6          2HB       GLU   6   5.448  14.276   3.644
   53   1HG   GLU   6          1HG       GLU   6   4.988  13.033   5.737
   54   2HG   GLU   6          2HG       GLU   6   6.707  13.021   6.123
   55    H    LEU   7           H        LEU   7   4.907  12.775   1.551
   56    HA   LEU   7           HA       LEU   7   2.593  11.297   2.353
   57   1HB   LEU   7          1HB       LEU   7   1.857  12.842   0.966
   58   2HB   LEU   7          2HB       LEU   7   3.442  13.149   0.311
   59    HG   LEU   7           HG       LEU   7   3.184  11.242  -1.209
   60   1HD1  LEU   7          1HD1      LEU   7   1.266  10.153   0.117
   61   2HD1  LEU   7          2HD1      LEU   7   0.239  11.436  -0.535
   62   3HD1  LEU   7          3HD1      LEU   7   1.078  10.295  -1.629
   63   1HD2  LEU   7          1HD2      LEU   7   1.105  13.468  -1.434
   64   2HD2  LEU   7          2HD2      LEU   7   2.741  13.480  -2.115
   65   3HD2  LEU   7          3HD2      LEU   7   1.544  12.368  -2.759
   66    H    TYR   8           H        TYR   8   5.038  10.455  -0.126
   67    HA   TYR   8           HA       TYR   8   4.132   7.895  -0.876
   68   1HB   TYR   8          1HB       TYR   8   6.162   9.603  -1.486
   69   2HB   TYR   8          2HB       TYR   8   7.086   8.607  -0.437
   70    HD1  TYR   8           1HD      TYR   8   7.687   9.332  -3.244
   71    HD2  TYR   8           2HD      TYR   8   5.671   5.879  -1.608
   72    HE1  TYR   8           1HE      TYR   8   8.516   7.937  -5.137
   73    HE2  TYR   8           2HE      TYR   8   6.579   4.492  -3.456
   74    HH   TYR   8           HH       TYR   8   7.825   4.440  -5.366
   75    H    LYS   9           H        LYS   9   6.340   8.694   1.797
   76    HA   LYS   9           HA       LYS   9   6.737   5.964   2.567
   77   1HB   LYS   9          1HB       LYS   9   8.204   7.959   3.133
   78   2HB   LYS   9          2HB       LYS   9   7.011   8.441   4.347
   79   1HG   LYS   9          1HG       LYS   9   7.394   6.338   5.584
   80   2HG   LYS   9          2HG       LYS   9   8.471   5.756   4.298
   81   1HD   LYS   9          1HD       LYS   9  10.006   7.674   4.730
   82   2HD   LYS   9          2HD       LYS   9   8.950   8.207   6.057
   83   1HE   LYS   9          1HE       LYS   9   9.325   6.058   7.228
   84   2HE   LYS   9          2HE       LYS   9  10.326   5.486   5.887
   85   1HZ   LYS   9          1HZ       LYS   9  11.891   7.292   6.365
   86   2HZ   LYS   9          2HZ       LYS   9  10.969   7.826   7.605
   87   3HZ   LYS   9          3HZ       LYS   9  11.691   6.367   7.691
   88    H    LEU  10           H        LEU  10   4.456   8.311   3.997
   89    HA   LEU  10           HA       LEU  10   3.242   6.440   5.719
   90   1HB   LEU  10          1HB       LEU  10   2.347   9.056   4.497
   91   2HB   LEU  10          2HB       LEU  10   1.251   8.128   5.520
   92    HG   LEU  10           HG       LEU  10   4.045   8.896   6.474
   93   1HD1  LEU  10          1HD1      LEU  10   2.960  10.963   5.969
   94   2HD1  LEU  10          2HD1      LEU  10   1.447  10.451   6.765
   95   3HD1  LEU  10          3HD1      LEU  10   2.923  10.748   7.718
   96   1HD2  LEU  10          1HD2      LEU  10   1.483   8.159   7.955
   97   2HD2  LEU  10          2HD2      LEU  10   2.908   7.112   7.765
   98   3HD2  LEU  10          3HD2      LEU  10   3.030   8.597   8.707
   99    H    GLU  11           H        GLU  11   2.541   7.267   2.338
  100    HA   GLU  11           HA       GLU  11   0.412   5.461   1.845
  101   1HB   GLU  11          1HB       GLU  11   2.444   7.050   0.372
  102   2HB   GLU  11          2HB       GLU  11   2.089   5.683  -0.536
  103   1HG   GLU  11          1HG       GLU  11   0.021   7.658   0.578
  104   2HG   GLU  11          2HG       GLU  11   0.767   7.786  -1.005
  105    H    GLN  12           H        GLN  12   3.972   4.676   1.888
  106    HA   GLN  12           HA       GLN  12   3.292   1.905   1.301
  107   1HB   GLN  12          1HB       GLN  12   5.840   3.410   1.946
  108   2HB   GLN  12          2HB       GLN  12   5.784   1.642   1.753
  109   1HG   GLN  12          1HG       GLN  12   4.741   1.867  -0.434
  110   2HG   GLN  12          2HG       GLN  12   4.785   3.625  -0.315
  111   1HE2  GLN  12          2HE2      GLN  12   7.048   4.623   0.013
  112   2HE2  GLN  12          1HE2      GLN  12   8.367   3.841  -0.849
  113    H    GLN  13           H        GLN  13   3.634   3.682   4.257
  114    HA   GLN  13           HA       GLN  13   4.164   1.384   5.917
  115   1HB   GLN  13          1HB       GLN  13   2.864   4.083   6.466
  116   2HB   GLN  13          2HB       GLN  13   3.050   2.870   7.731
  117   1HG   GLN  13          1HG       GLN  13   5.440   3.856   6.138
  118   2HG   GLN  13          2HG       GLN  13   4.852   4.679   7.579
  119   1HE2  GLN  13          2HE2      GLN  13   5.273   3.744   9.653
  120   2HE2  GLN  13          1HE2      GLN  13   6.249   2.293   9.816
  121    H    ALA  14           H        ALA  14   1.069   2.505   4.482
  122    HA   ALA  14           HA       ALA  14  -0.455   0.499   6.055
  123   1HB   ALA  14          1HB       ALA  14  -1.531   2.559   5.163
  124   2HB   ALA  14          2HB       ALA  14  -1.132   2.063   3.501
  125   3HB   ALA  14          3HB       ALA  14  -2.263   1.096   4.474
  126    H    MET  15           H        MET  15   1.147   0.562   2.838
  127    HA   MET  15           HA       MET  15   0.274  -2.081   1.970
  128   1HB   MET  15          1HB       MET  15   2.852  -0.487   1.391
  129   2HB   MET  15          2HB       MET  15   2.401  -1.979   0.611
  130   1HG   MET  15          1HG       MET  15   0.125  -0.432   0.263
  131   2HG   MET  15          2HG       MET  15   1.417   0.767   0.163
  132   1HE   MET  15          1HE       MET  15   1.291  -3.094  -0.872
  133   2HE   MET  15          2HE       MET  15  -0.283  -2.328  -1.120
  134   3HE   MET  15          3HE       MET  15   0.656  -2.894  -2.520
  135    H    LYS  16           H        LYS  16   3.170  -1.010   3.881
  136    HA   LYS  16           HA       LYS  16   4.346  -3.622   4.071
  137   1HB   LYS  16          1HB       LYS  16   5.304  -1.219   4.579
  138   2HB   LYS  16          2HB       LYS  16   4.512  -1.384   6.136
  139   1HG   LYS  16          1HG       LYS  16   6.541  -2.177   6.766
  140   2HG   LYS  16          2HG       LYS  16   5.923  -3.710   6.165
  141   1HD   LYS  16          1HD       LYS  16   7.713  -1.731   4.679
  142   2HD   LYS  16          2HD       LYS  16   8.211  -3.271   5.386
  143   1HE   LYS  16          1HE       LYS  16   6.724  -4.482   3.798
  144   2HE   LYS  16          2HE       LYS  16   6.249  -2.936   3.075
  145   1HZ   LYS  16          1HZ       LYS  16   8.579  -2.589   2.447
  146   2HZ   LYS  16          2HZ       LYS  16   9.017  -4.017   3.110
  147   3HZ   LYS  16          3HZ       LYS  16   8.034  -3.988   1.808
  148    H    LEU  17           H        LEU  17   2.099  -1.890   6.173
  149    HA   LEU  17           HA       LEU  17   1.631  -3.980   8.075
  150   1HB   LEU  17          1HB       LEU  17   0.371  -1.428   7.129
  151   2HB   LEU  17          2HB       LEU  17  -0.705  -2.496   7.913
  152    HG   LEU  17           HG       LEU  17   1.930  -1.533   9.110
  153   1HD1  LEU  17          1HD1      LEU  17   0.243   0.236   8.764
  154   2HD1  LEU  17          2HD1      LEU  17  -0.933  -0.685   9.715
  155   3HD1  LEU  17          3HD1      LEU  17   0.551  -0.075  10.483
  156   1HD2  LEU  17          1HD2      LEU  17  -0.378  -3.073  10.391
  157   2HD2  LEU  17          2HD2      LEU  17   1.279  -3.662  10.162
  158   3HD2  LEU  17          3HD2      LEU  17   0.970  -2.332  11.275
  159    H    TYR  18           H        TYR  18  -0.056  -3.202   4.980
  160    HA   TYR  18           HA       TYR  18  -1.903  -5.316   5.084
  161   1HB   TYR  18          1HB       TYR  18  -0.816  -3.531   2.959
  162   2HB   TYR  18          2HB       TYR  18  -1.624  -4.962   2.436
  163    HD1  TYR  18           1HD      TYR  18  -3.871  -5.432   3.988
  164    HD2  TYR  18           2HD      TYR  18  -2.269  -1.644   2.756
  165    HE1  TYR  18           1HE      TYR  18  -6.114  -4.383   4.339
  166    HE2  TYR  18           2HE      TYR  18  -4.521  -0.606   3.092
  167    HH   TYR  18           HH       TYR  18  -6.594  -0.850   3.879
  168    H    ARG  19           H        ARG  19   1.464  -5.376   3.932
  169    HA   ARG  19           HA       ARG  19   1.547  -7.927   2.743
  170   1HB   ARG  19          1HB       ARG  19   3.320  -5.947   3.180
  171   2HB   ARG  19          2HB       ARG  19   3.830  -6.989   4.490
  172   1HG   ARG  19          1HG       ARG  19   3.743  -7.713   1.520
  173   2HG   ARG  19          2HG       ARG  19   5.146  -7.173   2.422
  174   1HD   ARG  19          1HD       ARG  19   5.593  -9.363   2.480
  175   2HD   ARG  19          2HD       ARG  19   4.629  -9.280   3.961
  176    HE   ARG  19           HE       ARG  19   2.786  -9.830   1.942
  177   1HH1  ARG  19          1HH2      ARG  19   5.642 -11.486   3.110
  178   2HH1  ARG  19          2HH2      ARG  19   5.072 -13.041   2.570
  179   1HH2  ARG  19          1HH1      ARG  19   2.125 -11.838   1.266
  180   2HH2  ARG  19          2HH1      ARG  19   3.132 -13.226   1.556
  181    H    GLU  20           H        GLU  20   1.715  -7.091   6.183
  182    HA   GLU  20           HA       GLU  20   1.969  -9.914   7.030
  183   1HB   GLU  20          1HB       GLU  20   2.888  -7.558   8.066
  184   2HB   GLU  20          2HB       GLU  20   1.374  -7.646   8.926
  185   1HG   GLU  20          1HG       GLU  20   2.905  -8.656  10.380
  186   2HG   GLU  20          2HG       GLU  20   2.037 -10.011   9.669
  187    H    ALA  21           H        ALA  21  -0.450  -7.340   7.177
  188    HA   ALA  21           HA       ALA  21  -2.535  -8.732   8.492
  189   1HB   ALA  21          1HB       ALA  21  -2.590  -6.317   7.901
  190   2HB   ALA  21          2HB       ALA  21  -2.818  -6.778   6.191
  191   3HB   ALA  21          3HB       ALA  21  -4.055  -7.178   7.372
  192    H    SER  22           H        SER  22  -1.446  -9.055   5.108
  193    HA   SER  22           HA       SER  22  -3.463 -10.768   4.116
  194   1HB   SER  22          1HB       SER  22  -1.591  -9.732   2.814
  195   2HB   SER  22          2HB       SER  22  -0.477 -10.887   3.565
  196    HG   SER  22           HG       SER  22  -2.656 -11.417   1.806
  197    H    GLU  23           H        GLU  23  -0.686 -11.603   6.290
  198    HA   GLU  23           HA       GLU  23  -1.238 -14.471   6.189
  199   1HB   GLU  23          1HB       GLU  23   0.913 -13.201   6.921
  200   2HB   GLU  23          2HB       GLU  23   0.104 -13.006   8.470
  201   1HG   GLU  23          1HG       GLU  23  -0.161 -15.460   8.669
  202   2HG   GLU  23          2HG       GLU  23   0.585 -15.679   7.086
  203    H    LYS  24           H        LYS  24  -2.131 -11.837   8.402
  204    HA   LYS  24           HA       LYS  24  -3.670 -13.461  10.238
  205   1HB   LYS  24          1HB       LYS  24  -3.716 -10.472   9.664
  206   2HB   LYS  24          2HB       LYS  24  -4.672 -11.247  10.933
  207   1HG   LYS  24          1HG       LYS  24  -2.631 -12.126  12.000
  208   2HG   LYS  24          2HG       LYS  24  -1.626 -11.370  10.748
  209   1HD   LYS  24          1HD       LYS  24  -2.373  -9.149  11.418
  210   2HD   LYS  24          2HD       LYS  24  -3.506  -9.852  12.601
  211   1HE   LYS  24          1HE       LYS  24  -1.657 -10.786  13.895
  212   2HE   LYS  24          2HE       LYS  24  -0.484 -10.210  12.707
  213   1HZ   LYS  24          1HZ       LYS  24  -0.667  -8.722  14.643
  214   2HZ   LYS  24          2HZ       LYS  24  -1.068  -7.936  13.277
  215   3HZ   LYS  24          3HZ       LYS  24  -2.235  -8.404  14.320
  216    H    ALA  25           H        ALA  25  -4.675 -11.674   7.349
  217    HA   ALA  25           HA       ALA  25  -7.493 -12.339   7.608
  218   1HB   ALA  25          1HB       ALA  25  -5.942 -11.064   5.314
  219   2HB   ALA  25          2HB       ALA  25  -7.696 -11.009   5.564
  220   3HB   ALA  25          3HB       ALA  25  -6.621 -10.174   6.695
  221    H    ARG  26           H        ARG  26  -5.541 -14.645   7.199
  222    HA   ARG  26           HA       ARG  26  -5.353 -15.665   4.675
  223   1HB   ARG  26          1HB       ARG  26  -4.985 -17.832   5.696
  224   2HB   ARG  26          2HB       ARG  26  -4.236 -16.572   6.645
  225   1HG   ARG  26          1HG       ARG  26  -6.958 -17.063   7.631
  226   2HG   ARG  26          2HG       ARG  26  -6.092 -18.582   7.513
  227   1HD   ARG  26          1HD       ARG  26  -4.981 -16.129   8.937
  228   2HD   ARG  26          2HD       ARG  26  -6.011 -17.336   9.720
  229    HE   ARG  26           HE       ARG  26  -3.780 -18.611   8.414
  230   1HH1  ARG  26          1HH2      ARG  26  -4.510 -16.793  11.318
  231   2HH1  ARG  26          2HH2      ARG  26  -3.261 -17.585  12.240
  232   1HH2  ARG  26          1HH1      ARG  26  -2.212 -19.594   9.655
  233   2HH2  ARG  26          2HH1      ARG  26  -1.994 -19.121  11.314
  234    H    ASN  27           H        ASN  27  -8.377 -15.581   6.333
  235    HA   ASN  27           HA       ASN  27  -9.745 -17.736   4.982
  236   1HB   ASN  27          1HB       ASN  27 -10.337 -16.737   7.208
  237   2HB   ASN  27          2HB       ASN  27 -10.794 -15.239   6.400
  238   1HD2  ASN  27          2HD2      ASN  27 -12.984 -15.076   5.991
  239   2HD2  ASN  27          1HD2      ASN  27 -14.050 -16.463   5.834
  240    HA   PRO  28           HA       PRO  28  -9.883 -15.819   1.050
  241   1HB   PRO  28          1HB       PRO  28 -11.970 -17.082  -0.242
  242   2HB   PRO  28          2HB       PRO  28 -10.360 -17.790   0.078
  243   1HG   PRO  28          1HG       PRO  28 -12.899 -18.123   1.690
  244   2HG   PRO  28          2HG       PRO  28 -11.734 -19.386   1.174
  245   1HD   PRO  28          1HD       PRO  28 -11.677 -18.333   3.660
  246   2HD   PRO  28          2HD       PRO  28 -10.151 -18.713   2.801
  247    H    GLU  29           H        GLU  29 -12.938 -15.725   2.805
  248    HA   GLU  29           HA       GLU  29 -14.397 -13.814   1.384
  249   1HB   GLU  29          1HB       GLU  29 -14.724 -15.224   3.669
  250   2HB   GLU  29          2HB       GLU  29 -14.305 -13.695   4.394
  251   1HG   GLU  29          1HG       GLU  29 -16.678 -13.765   4.295
  252   2HG   GLU  29          2HG       GLU  29 -16.169 -12.603   3.077
  253    H    LYS  30           H        LYS  30 -11.662 -13.301   3.421
  254    HA   LYS  30           HA       LYS  30 -11.735 -10.342   3.015
  255   1HB   LYS  30          1HB       LYS  30 -12.019 -11.226   5.371
  256   2HB   LYS  30          2HB       LYS  30 -10.360 -11.836   5.280
  257   1HG   LYS  30          1HG       LYS  30  -9.534  -9.522   4.896
  258   2HG   LYS  30          2HG       LYS  30 -11.189  -8.909   4.932
  259   1HD   LYS  30          1HD       LYS  30  -9.779 -10.305   7.255
  260   2HD   LYS  30          2HD       LYS  30  -9.926  -8.562   7.058
  261   1HE   LYS  30          1HE       LYS  30 -11.914  -8.540   8.044
  262   2HE   LYS  30          2HE       LYS  30 -12.577  -9.581   6.788
  263   1HZ   LYS  30          1HZ       LYS  30 -11.841 -11.511   8.115
  264   2HZ   LYS  30          2HZ       LYS  30 -11.228 -10.524   9.268
  265   3HZ   LYS  30          3HZ       LYS  30 -12.836 -10.565   8.994
  266    H    LYS  31           H        LYS  31  -9.613 -13.178   2.803
  267    HA   LYS  31           HA       LYS  31  -7.291 -11.826   1.932
  268   1HB   LYS  31          1HB       LYS  31  -7.480 -14.233   2.540
  269   2HB   LYS  31          2HB       LYS  31  -8.266 -14.540   1.001
  270   1HG   LYS  31          1HG       LYS  31  -5.594 -13.154   0.932
  271   2HG   LYS  31          2HG       LYS  31  -5.627 -14.847   1.437
  272   1HD   LYS  31          1HD       LYS  31  -6.735 -15.527  -0.629
  273   2HD   LYS  31          2HD       LYS  31  -6.888 -13.854  -1.149
  274   1HE   LYS  31          1HE       LYS  31  -5.059 -14.800  -2.357
  275   2HE   LYS  31          2HE       LYS  31  -4.410 -13.626  -1.210
  276   1HZ   LYS  31          1HZ       LYS  31  -3.783 -15.486   0.237
  277   2HZ   LYS  31          2HZ       LYS  31  -4.432 -16.575  -0.800
  278   3HZ   LYS  31          3HZ       LYS  31  -3.128 -15.703  -1.239
  279    H    SER  32           H        SER  32 -10.211 -12.460   0.152
  280    HA   SER  32           HA       SER  32  -9.067 -11.245  -2.303
  281   1HB   SER  32          1HB       SER  32 -10.490 -13.388  -2.256
  282   2HB   SER  32          2HB       SER  32 -11.882 -12.342  -1.935
  283    HG   SER  32           HG       SER  32 -11.354 -11.230  -3.901
  284    H    VAL  33           H        VAL  33 -10.082  -9.826   0.362
  285    HA   VAL  33           HA       VAL  33 -11.412  -7.545  -1.082
  286    HB   VAL  33           HB       VAL  33 -11.550  -8.295   1.858
  287   1HG1  VAL  33          1HG1      VAL  33 -11.446  -5.853   1.711
  288   2HG1  VAL  33          2HG1      VAL  33 -12.660  -5.849   0.411
  289   3HG1  VAL  33          3HG1      VAL  33 -13.102  -6.349   2.057
  290   1HG2  VAL  33          1HG2      VAL  33 -13.712  -8.055  -0.288
  291   2HG2  VAL  33          2HG2      VAL  33 -13.065  -9.581   0.344
  292   3HG2  VAL  33          3HG2      VAL  33 -13.961  -8.500   1.416
  293    H    LEU  34           H        LEU  34  -8.901  -8.310   1.500
  294    HA   LEU  34           HA       LEU  34  -7.821  -5.633   1.227
  295   1HB   LEU  34          1HB       LEU  34  -6.445  -6.103   2.872
  296   2HB   LEU  34          2HB       LEU  34  -7.688  -7.287   3.249
  297    HG   LEU  34           HG       LEU  34  -5.161  -7.771   1.716
  298   1HD1  LEU  34          1HD1      LEU  34  -4.156  -8.664   3.699
  299   2HD1  LEU  34          2HD1      LEU  34  -4.943  -7.185   4.252
  300   3HD1  LEU  34          3HD1      LEU  34  -5.713  -8.725   4.564
  301   1HD2  LEU  34          1HD2      LEU  34  -7.021  -9.809   2.964
  302   2HD2  LEU  34          2HD2      LEU  34  -6.847  -9.489   1.224
  303   3HD2  LEU  34          3HD2      LEU  34  -5.491 -10.169   2.130
  304    H    GLN  35           H        GLN  35  -7.395  -8.511  -0.704
  305    HA   GLN  35           HA       GLN  35  -4.944  -7.824  -1.970
  306   1HB   GLN  35          1HB       GLN  35  -5.837 -10.004  -2.078
  307   2HB   GLN  35          2HB       GLN  35  -7.346  -9.477  -2.814
  308   1HG   GLN  35          1HG       GLN  35  -4.793  -8.934  -4.339
  309   2HG   GLN  35          2HG       GLN  35  -5.287 -10.605  -4.144
  310   1HE2  GLN  35          2HE2      GLN  35  -5.920 -11.077  -6.278
  311   2HE2  GLN  35          1HE2      GLN  35  -7.275 -10.255  -7.039
  312    H    LYS  36           H        LYS  36  -8.262  -6.641  -2.568
  313    HA   LYS  36           HA       LYS  36  -7.578  -5.425  -5.115
  314   1HB   LYS  36          1HB       LYS  36  -9.888  -6.211  -4.288
  315   2HB   LYS  36          2HB       LYS  36  -9.949  -4.741  -3.304
  316   1HG   LYS  36          1HG       LYS  36  -9.739  -3.368  -5.378
  317   2HG   LYS  36          2HG       LYS  36  -9.618  -4.853  -6.340
  318   1HD   LYS  36          1HD       LYS  36 -11.889  -5.530  -5.545
  319   2HD   LYS  36          2HD       LYS  36 -12.015  -4.000  -4.650
  320   1HE   LYS  36          1HE       LYS  36 -11.758  -2.738  -6.772
  321   2HE   LYS  36          2HE       LYS  36 -11.587  -4.255  -7.664
  322   1HZ   LYS  36          1HZ       LYS  36 -13.854  -4.839  -6.981
  323   2HZ   LYS  36          2HZ       LYS  36 -14.018  -3.433  -6.163
  324   3HZ   LYS  36          3HZ       LYS  36 -13.860  -3.423  -7.788
  325    H    ILE  37           H        ILE  37  -7.713  -4.209  -1.802
  326    HA   ILE  37           HA       ILE  37  -6.869  -1.466  -2.426
  327    HB   ILE  37           HB       ILE  37  -6.513  -3.239   0.032
  328   1HG1  ILE  37          1HG1      ILE  37  -8.550  -1.091  -0.484
  329   2HG1  ILE  37          2HG1      ILE  37  -8.803  -2.846  -0.407
  330   1HG2  ILE  37          1HG2      ILE  37  -4.766  -1.536   0.106
  331   2HG2  ILE  37          2HG2      ILE  37  -5.924  -0.276  -0.359
  332   3HG2  ILE  37          3HG2      ILE  37  -6.016  -1.037   1.231
  333   1HD1  ILE  37          1HD1      ILE  37  -8.113  -2.805   1.990
  334   2HD1  ILE  37          2HD1      ILE  37  -8.130  -1.016   1.904
  335   3HD1  ILE  37          3HD1      ILE  37  -9.610  -1.930   1.630
  336    H    LEU  38           H        LEU  38  -4.980  -4.450  -1.453
  337    HA   LEU  38           HA       LEU  38  -2.434  -3.361  -1.722
  338   1HB   LEU  38          1HB       LEU  38  -3.559  -6.110  -2.246
  339   2HB   LEU  38          2HB       LEU  38  -1.885  -5.799  -2.634
  340    HG   LEU  38           HG       LEU  38  -3.040  -5.308   0.145
  341   1HD1  LEU  38          1HD1      LEU  38  -3.244  -7.691  -0.432
  342   2HD1  LEU  38          2HD1      LEU  38  -1.536  -7.731  -0.929
  343   3HD1  LEU  38          3HD1      LEU  38  -1.977  -7.441   0.771
  344   1HD2  LEU  38          1HD2      LEU  38  -0.243  -5.359  -1.059
  345   2HD2  LEU  38          2HD2      LEU  38  -1.015  -4.105  -0.051
  346   3HD2  LEU  38          3HD2      LEU  38  -0.500  -5.634   0.663
  347    H    GLU  39           H        GLU  39  -4.441  -4.573  -4.480
  348    HA   GLU  39           HA       GLU  39  -2.395  -4.015  -6.413
  349   1HB   GLU  39          1HB       GLU  39  -4.983  -5.219  -6.401
  350   2HB   GLU  39          2HB       GLU  39  -5.146  -3.831  -7.458
  351   1HG   GLU  39          1HG       GLU  39  -4.535  -5.614  -8.860
  352   2HG   GLU  39          2HG       GLU  39  -3.070  -4.652  -8.697
  353    H    ASP  40           H        ASP  40  -5.019  -1.964  -5.201
  354    HA   ASP  40           HA       ASP  40  -4.677   0.272  -7.012
  355   1HB   ASP  40          1HB       ASP  40  -6.019  -0.419  -4.375
  356   2HB   ASP  40          2HB       ASP  40  -5.832   1.216  -4.739
  357    H    GLU  41           H        GLU  41  -3.118  -0.708  -3.993
  358    HA   GLU  41           HA       GLU  41  -2.220   1.961  -3.318
  359   1HB   GLU  41          1HB       GLU  41  -3.077  -0.226  -1.942
  360   2HB   GLU  41          2HB       GLU  41  -1.386  -0.580  -1.894
  361   1HG   GLU  41          1HG       GLU  41  -2.520   0.376   0.103
  362   2HG   GLU  41          2HG       GLU  41  -1.106   1.311  -0.404
  363    H    GLU  42           H        GLU  42  -0.845  -1.119  -4.488
  364    HA   GLU  42           HA       GLU  42   1.818  -0.181  -4.982
  365   1HB   GLU  42          1HB       GLU  42   1.060  -2.557  -5.029
  366   2HB   GLU  42          2HB       GLU  42   0.197  -2.234  -6.541
  367   1HG   GLU  42          1HG       GLU  42   2.329  -1.657  -7.647
  368   2HG   GLU  42          2HG       GLU  42   3.196  -1.844  -6.121
  369    H    LYS  43           H        LYS  43  -1.215   0.229  -6.825
  370    HA   LYS  43           HA       LYS  43  -0.021   1.330  -9.197
  371   1HB   LYS  43          1HB       LYS  43  -2.622   0.653  -8.436
  372   2HB   LYS  43          2HB       LYS  43  -2.694   2.402  -8.463
  373   1HG   LYS  43          1HG       LYS  43  -3.367   1.653 -10.593
  374   2HG   LYS  43          2HG       LYS  43  -1.738   2.300 -10.825
  375   1HD   LYS  43          1HD       LYS  43  -0.795   0.029 -10.828
  376   2HD   LYS  43          2HD       LYS  43  -2.365  -0.674 -10.441
  377   1HE   LYS  43          1HE       LYS  43  -1.784   0.932 -12.973
  378   2HE   LYS  43          2HE       LYS  43  -1.618  -0.821 -12.867
  379   1HZ   LYS  43          1HZ       LYS  43  -3.982  -0.966 -12.310
  380   2HZ   LYS  43          2HZ       LYS  43  -4.159   0.657 -12.430
  381   3HZ   LYS  43          3HZ       LYS  43  -3.784  -0.226 -13.748
  382    H    HIS  44           H        HIS  44  -1.200   3.011  -6.167
  383    HA   HIS  44           HA       HIS  44  -0.555   5.612  -6.978
  384   1HB   HIS  44          1HB       HIS  44  -0.424   4.278  -4.231
  385   2HB   HIS  44          2HB       HIS  44  -0.554   5.970  -4.600
  386    HD2  HIS  44           2HD      HIS  44  -2.904   4.951  -6.979
  387    HE1  HIS  44           1HE      HIS  44  -5.235   4.553  -3.455
  388    HE2  HIS  44           2HE      HIS  44  -5.280   4.570  -6.006
  389    H    ILE  45           H        ILE  45   1.414   3.096  -5.352
  390    HA   ILE  45           HA       ILE  45   3.778   4.675  -5.038
  391    HB   ILE  45           HB       ILE  45   3.030   1.776  -4.885
  392   1HG1  ILE  45          1HG1      ILE  45   4.307   1.987  -2.726
  393   2HG1  ILE  45          2HG1      ILE  45   4.587   3.684  -3.095
  394   1HG2  ILE  45          1HG2      ILE  45   5.055   1.526  -6.200
  395   2HG2  ILE  45          2HG2      ILE  45   5.939   2.621  -5.105
  396   3HG2  ILE  45          3HG2      ILE  45   5.353   1.041  -4.536
  397   1HD1  ILE  45          1HD1      ILE  45   2.073   4.030  -3.032
  398   2HD1  ILE  45          2HD1      ILE  45   1.947   2.334  -2.480
  399   3HD1  ILE  45          3HD1      ILE  45   2.799   3.523  -1.506
  400    H    GLU  46           H        GLU  46   2.767   2.661  -7.878
  401    HA   GLU  46           HA       GLU  46   5.124   3.123  -9.414
  402   1HB   GLU  46          1HB       GLU  46   2.214   2.617 -10.123
  403   2HB   GLU  46          2HB       GLU  46   3.424   2.866 -11.356
  404   1HG   GLU  46          1HG       GLU  46   3.647   0.700  -9.239
  405   2HG   GLU  46          2HG       GLU  46   2.868   0.472 -10.803
  406    H    TRP  47           H        TRP  47   2.160   5.131  -9.111
  407    HA   TRP  47           HA       TRP  47   3.044   7.090 -11.038
  408   1HB   TRP  47          1HB       TRP  47   1.019   7.388  -8.780
  409   2HB   TRP  47          2HB       TRP  47   1.122   8.330 -10.244
  410    HD1  TRP  47           1HD      TRP  47   1.339   5.341 -11.956
  411    HE1  TRP  47           1HE      TRP  47  -0.880   4.117 -12.388
  412    HE3  TRP  47           3HE      TRP  47  -1.609   7.788  -8.599
  413    HZ2  TRP  47           2HZ      TRP  47  -3.617   4.259 -11.456
  414    HZ3  TRP  47           3HZ      TRP  47  -4.033   7.263  -8.376
  415    HH2  TRP  47           2HH      TRP  47  -5.040   5.474  -9.798
  416    H    LEU  48           H        LEU  48   3.135   6.905  -7.482
  417    HA   LEU  48           HA       LEU  48   4.316   9.397  -6.865
  418   1HB   LEU  48          1HB       LEU  48   4.286   6.633  -5.646
  419   2HB   LEU  48          2HB       LEU  48   5.233   7.860  -4.882
  420    HG   LEU  48           HG       LEU  48   2.290   8.257  -5.495
  421   1HD1  LEU  48          1HD1      LEU  48   2.513   6.330  -3.996
  422   2HD1  LEU  48          2HD1      LEU  48   3.599   7.244  -2.938
  423   3HD1  LEU  48          3HD1      LEU  48   1.889   7.719  -3.104
  424   1HD2  LEU  48          1HD2      LEU  48   4.175   9.644  -3.534
  425   2HD2  LEU  48          2HD2      LEU  48   3.561  10.341  -5.047
  426   3HD2  LEU  48          3HD2      LEU  48   2.441   9.983  -3.732
  427    H    GLU  49           H        GLU  49   5.898   6.348  -7.817
  428    HA   GLU  49           HA       GLU  49   8.580   7.337  -7.751
  429   1HB   GLU  49          1HB       GLU  49   7.494   4.903  -8.163
  430   2HB   GLU  49          2HB       GLU  49   7.724   5.314  -9.841
  431   1HG   GLU  49          1HG       GLU  49   9.899   5.334  -7.696
  432   2HG   GLU  49          2HG       GLU  49   9.581   3.991  -8.784
  433    H    THR  50           H        THR  50   6.229   7.279 -10.502
  434    HA   THR  50           HA       THR  50   8.050   8.629 -12.276
  435    HB   THR  50           HB       THR  50   5.685   7.351 -12.635
  436    HG1  THR  50           1HG      THR  50   6.862   9.207 -14.419
  437   1HG2  THR  50          1HG2      THR  50   4.243   9.311 -12.094
  438   2HG2  THR  50          2HG2      THR  50   5.043  10.238 -13.377
  439   3HG2  THR  50          3HG2      THR  50   4.106   8.784 -13.769
  440    H    ILE  51           H        ILE  51   6.188   9.842  -9.682
  441    HA   ILE  51           HA       ILE  51   6.437  12.658 -10.480
  442    HB   ILE  51           HB       ILE  51   5.115  11.166  -8.200
  443   1HG1  ILE  51          1HG1      ILE  51   3.884  13.026 -10.282
  444   2HG1  ILE  51          2HG1      ILE  51   4.081  11.305 -10.551
  445   1HG2  ILE  51          1HG2      ILE  51   5.886  13.207  -7.132
  446   2HG2  ILE  51          2HG2      ILE  51   5.225  14.194  -8.459
  447   3HG2  ILE  51          3HG2      ILE  51   4.153  13.294  -7.362
  448   1HD1  ILE  51          1HD1      ILE  51   2.704  10.865  -8.470
  449   2HD1  ILE  51          2HD1      ILE  51   2.315  12.603  -8.454
  450   3HD1  ILE  51          3HD1      ILE  51   1.849  11.598  -9.835
  451    H    ASN  52           H        ASN  52   8.402  10.478  -8.864
  452    HA   ASN  52           HA       ASN  52   9.777  12.632  -7.307
  453   1HB   ASN  52          1HB       ASN  52   8.570  10.809  -6.060
  454   2HB   ASN  52          2HB       ASN  52   9.732   9.658  -6.725
  455   1HD2  ASN  52          2HD2      ASN  52  10.409   9.142  -4.527
  456   2HD2  ASN  52          1HD2      ASN  52  11.406  10.279  -3.637
  457    H    GLY  53           H        GLY  53  10.365  11.877 -10.160
  458   1HA   GLY  53          1HA       GLY  53  12.884  12.751 -10.369
  459   2HA   GLY  53          2HA       GLY  53  13.216  11.048 -10.069
  460   1H    MET   1          1H        MET   1  -8.533 -11.022  15.487
  461   2H    MET   1          2H        MET   1  -6.921 -11.184  15.234
  462   3H    MET   1          3H        MET   1  -7.752 -12.343  16.037
  463    HA   MET   1           HA       MET   1  -8.228 -10.885  17.857
  464   1HB   MET   1          1HB       MET   1  -5.257 -11.003  17.197
  465   2HB   MET   1          2HB       MET   1  -5.934 -10.493  18.750
  466   1HG   MET   1          1HG       MET   1  -7.061 -12.697  18.976
  467   2HG   MET   1          2HG       MET   1  -6.305 -13.226  17.468
  468   1HE   MET   1          1HE       MET   1  -6.158 -14.889  20.127
  469   2HE   MET   1          2HE       MET   1  -5.364 -15.385  18.614
  470   3HE   MET   1          3HE       MET   1  -4.449 -15.375  20.137
  471    H    ASP   2           H        ASP   2  -5.525  -8.984  16.393
  472    HA   ASP   2           HA       ASP   2  -7.341  -6.662  16.043
  473   1HB   ASP   2          1HB       ASP   2  -6.581  -6.529  18.369
  474   2HB   ASP   2          2HB       ASP   2  -4.900  -6.692  17.857
  475    H    TYR   3           H        TYR   3  -6.985  -5.940  14.096
  476    HA   TYR   3           HA       TYR   3  -4.460  -5.097  13.017
  477   1HB   TYR   3          1HB       TYR   3  -4.186  -6.669  11.211
  478   2HB   TYR   3          2HB       TYR   3  -4.157  -7.541  12.705
  479    HD1  TYR   3           1HD      TYR   3  -6.394  -8.790  13.433
  480    HD2  TYR   3           2HD      TYR   3  -5.574  -7.359   9.456
  481    HE1  TYR   3           1HE      TYR   3  -8.080 -10.376  12.510
  482    HE2  TYR   3           2HE      TYR   3  -7.251  -8.944   8.536
  483    HH   TYR   3           HH       TYR   3  -9.099 -11.189  10.632
  484    H    LEU   4           H        LEU   4  -7.067  -3.875  13.397
  485    HA   LEU   4           HA       LEU   4  -7.846  -3.371  10.577
  486   1HB   LEU   4          1HB       LEU   4 -10.208  -3.323  11.188
  487   2HB   LEU   4          2HB       LEU   4  -9.461  -4.896  11.321
  488    HG   LEU   4           HG       LEU   4  -9.281  -3.572  13.900
  489   1HD1  LEU   4          1HD1      LEU   4 -11.249  -2.271  13.159
  490   2HD1  LEU   4          2HD1      LEU   4 -12.104  -3.782  12.787
  491   3HD1  LEU   4          3HD1      LEU   4 -11.656  -3.398  14.463
  492   1HD2  LEU   4          1HD2      LEU   4 -10.925  -5.977  13.029
  493   2HD2  LEU   4          2HD2      LEU   4  -9.217  -6.022  13.513
  494   3HD2  LEU   4          3HD2      LEU   4 -10.457  -5.553  14.691
  495    H    ARG   5           H        ARG   5  -8.529  -1.853  13.812
  496    HA   ARG   5           HA       ARG   5  -8.755   0.787  12.659
  497   1HB   ARG   5          1HB       ARG   5  -8.125  -0.178  15.481
  498   2HB   ARG   5          2HB       ARG   5  -8.152   1.534  15.040
  499   1HG   ARG   5          1HG       ARG   5 -10.489   1.258  14.177
  500   2HG   ARG   5          2HG       ARG   5 -10.498  -0.398  14.810
  501   1HD   ARG   5          1HD       ARG   5 -10.170   0.398  17.081
  502   2HD   ARG   5          2HD       ARG   5  -9.892   2.049  16.537
  503    HE   ARG   5           HE       ARG   5 -12.460   0.715  16.915
  504   1HH1  ARG   5          1HH2      ARG   5 -10.972   3.394  15.201
  505   2HH1  ARG   5          2HH2      ARG   5 -12.466   4.285  15.122
  506   1HH2  ARG   5          1HH1      ARG   5 -14.318   1.925  16.791
  507   2HH2  ARG   5          2HH1      ARG   5 -14.301   3.471  15.995
  508    H    GLU   6           H        GLU   6  -5.972  -1.050  13.743
  509    HA   GLU   6           HA       GLU   6  -3.946   0.870  13.685
  510   1HB   GLU   6          1HB       GLU   6  -3.862  -1.628  14.342
  511   2HB   GLU   6          2HB       GLU   6  -3.728  -1.992  12.636
  512   1HG   GLU   6          1HG       GLU   6  -1.520  -2.012  13.478
  513   2HG   GLU   6          2HG       GLU   6  -1.644  -0.503  12.585
  514    H    LEU   7           H        LEU   7  -5.119  -1.070  10.927
  515    HA   LEU   7           HA       LEU   7  -3.523   0.178   8.917
  516   1HB   LEU   7          1HB       LEU   7  -5.988  -1.630   8.985
  517   2HB   LEU   7          2HB       LEU   7  -5.381  -0.961   7.473
  518    HG   LEU   7           HG       LEU   7  -3.144  -1.865   7.989
  519   1HD1  LEU   7          1HD1      LEU   7  -3.056  -2.298  10.327
  520   2HD1  LEU   7          2HD1      LEU   7  -4.537  -3.261  10.271
  521   3HD1  LEU   7          3HD1      LEU   7  -3.037  -3.879   9.551
  522   1HD2  LEU   7          1HD2      LEU   7  -5.340  -3.961   7.855
  523   2HD2  LEU   7          2HD2      LEU   7  -4.727  -2.992   6.496
  524   3HD2  LEU   7          3HD2      LEU   7  -3.658  -4.146   7.290
  525    H    TYR   8           H        TYR   8  -6.970   0.601   9.754
  526    HA   TYR   8           HA       TYR   8  -7.764   2.589   7.913
  527   1HB   TYR   8          1HB       TYR   8  -8.805   1.211  10.092
  528   2HB   TYR   8          2HB       TYR   8  -8.644   2.768  10.811
  529    HD1  TYR   8           1HD      TYR   8 -11.089   0.872  10.070
  530    HD2  TYR   8           2HD      TYR   8  -9.515   4.570   8.492
  531    HE1  TYR   8           1HE      TYR   8 -13.371   1.535   9.349
  532    HE2  TYR   8           2HE      TYR   8 -11.808   5.225   7.780
  533    HH   TYR   8           HH       TYR   8 -14.658   3.156   8.347
  534    H    LYS   9           H        LYS   9  -6.166   3.065  11.094
  535    HA   LYS   9           HA       LYS   9  -6.211   5.908  10.996
  536   1HB   LYS   9          1HB       LYS   9  -5.107   3.898  12.760
  537   2HB   LYS   9          2HB       LYS   9  -3.739   4.851  12.260
  538   1HG   LYS   9          1HG       LYS   9  -4.399   5.913  14.183
  539   2HG   LYS   9          2HG       LYS   9  -5.147   6.933  12.948
  540   1HD   LYS   9          1HD       LYS   9  -7.325   5.794  13.334
  541   2HD   LYS   9          2HD       LYS   9  -6.545   4.680  14.480
  542   1HE   LYS   9          1HE       LYS   9  -5.850   6.680  15.858
  543   2HE   LYS   9          2HE       LYS   9  -6.810   7.705  14.786
  544   1HZ   LYS   9          1HZ       LYS   9  -8.780   6.410  15.448
  545   2HZ   LYS   9          2HZ       LYS   9  -7.874   5.476  16.446
  546   3HZ   LYS   9          3HZ       LYS   9  -8.065   7.062  16.762
  547    H    LEU  10           H        LEU  10  -3.504   3.853   9.937
  548    HA   LEU  10           HA       LEU  10  -2.036   6.043   8.931
  549   1HB   LEU  10          1HB       LEU  10  -1.907   3.052   8.528
  550   2HB   LEU  10          2HB       LEU  10  -0.785   4.127   7.687
  551    HG   LEU  10           HG       LEU  10  -1.146   4.366  10.706
  552   1HD1  LEU  10          1HD1      LEU  10  -0.636   2.085  10.434
  553   2HD1  LEU  10          2HD1      LEU  10   0.639   2.414   9.235
  554   3HD1  LEU  10          3HD1      LEU  10   0.854   2.888  10.939
  555   1HD2  LEU  10          1HD2      LEU  10   1.174   4.976   8.829
  556   2HD2  LEU  10          2HD2      LEU  10   0.085   6.168   9.569
  557   3HD2  LEU  10          3HD2      LEU  10   1.165   5.217  10.590
  558    H    GLU  11           H        GLU  11  -4.373   3.875   7.406
  559    HA   GLU  11           HA       GLU  11  -4.458   4.994   4.797
  560   1HB   GLU  11          1HB       GLU  11  -6.200   3.414   6.622
  561   2HB   GLU  11          2HB       GLU  11  -7.113   4.202   5.442
  562   1HG   GLU  11          1HG       GLU  11  -4.721   2.346   4.923
  563   2HG   GLU  11          2HG       GLU  11  -6.394   1.857   4.893
  564    H    GLN  12           H        GLN  12  -5.990   6.353   7.852
  565    HA   GLN  12           HA       GLN  12  -6.952   8.591   6.246
  566   1HB   GLN  12          1HB       GLN  12  -7.192   7.777   9.141
  567   2HB   GLN  12          2HB       GLN  12  -7.806   9.316   8.509
  568   1HG   GLN  12          1HG       GLN  12  -9.110   8.117   6.798
  569   2HG   GLN  12          2HG       GLN  12  -8.580   6.578   7.424
  570   1HE2  GLN  12          2HE2      GLN  12 -11.322   8.209   7.325
  571   2HE2  GLN  12          1HE2      GLN  12 -11.926   7.947   8.954
  572    H    GLN  13           H        GLN  13  -4.148   8.056   8.217
  573    HA   GLN  13           HA       GLN  13  -3.437  10.877   8.457
  574   1HB   GLN  13          1HB       GLN  13  -1.762   8.318   8.470
  575   2HB   GLN  13          2HB       GLN  13  -1.068   9.910   8.745
  576   1HG   GLN  13          1HG       GLN  13  -3.308   8.850  10.515
  577   2HG   GLN  13          2HG       GLN  13  -1.618   8.455  10.787
  578   1HE2  GLN  13          2HE2      GLN  13  -0.995   9.652  12.581
  579   2HE2  GLN  13          1HE2      GLN  13  -1.292  11.377  12.738
  580    H    ALA  14           H        ALA  14  -2.924   8.456   5.867
  581    HA   ALA  14           HA       ALA  14  -1.378  10.291   4.199
  582   1HB   ALA  14          1HB       ALA  14  -1.365   7.843   3.836
  583   2HB   ALA  14          2HB       ALA  14  -3.117   7.856   3.527
  584   3HB   ALA  14          3HB       ALA  14  -2.009   8.684   2.411
  585    H    MET  15           H        MET  15  -4.856   9.561   4.600
  586    HA   MET  15           HA       MET  15  -5.856  11.242   2.497
  587   1HB   MET  15          1HB       MET  15  -7.196   9.518   3.600
  588   2HB   MET  15          2HB       MET  15  -7.160  10.407   5.118
  589   1HG   MET  15          1HG       MET  15  -8.829  11.752   4.565
  590   2HG   MET  15          2HG       MET  15  -8.178  12.099   2.966
  591   1HE   MET  15          1HE       MET  15  -8.850  11.151   0.835
  592   2HE   MET  15          2HE       MET  15  -7.959   9.710   1.356
  593   3HE   MET  15          3HE       MET  15  -9.572   9.542   0.613
  594    H    LYS  16           H        LYS  16  -5.251  12.058   5.979
  595    HA   LYS  16           HA       LYS  16  -6.024  14.849   5.716
  596   1HB   LYS  16          1HB       LYS  16  -4.330  13.276   7.678
  597   2HB   LYS  16          2HB       LYS  16  -4.604  15.028   7.820
  598   1HG   LYS  16          1HG       LYS  16  -7.056  14.678   7.809
  599   2HG   LYS  16          2HG       LYS  16  -6.826  12.927   7.681
  600   1HD   LYS  16          1HD       LYS  16  -5.691  12.893   9.861
  601   2HD   LYS  16          2HD       LYS  16  -5.873  14.667   9.988
  602   1HE   LYS  16          1HE       LYS  16  -8.335  14.427   9.827
  603   2HE   LYS  16          2HE       LYS  16  -8.167  12.673   9.693
  604   1HZ   LYS  16          1HZ       LYS  16  -7.206  12.661  11.941
  605   2HZ   LYS  16          2HZ       LYS  16  -7.356  14.286  12.061
  606   3HZ   LYS  16          3HZ       LYS  16  -8.686  13.348  11.975
  607    H    LEU  17           H        LEU  17  -2.846  13.235   5.399
  608    HA   LEU  17           HA       LEU  17  -1.475  15.657   4.757
  609   1HB   LEU  17          1HB       LEU  17  -0.898  12.824   4.785
  610   2HB   LEU  17          2HB       LEU  17  -0.322  13.446   3.266
  611    HG   LEU  17           HG       LEU  17   0.253  14.690   5.999
  612   1HD1  LEU  17          1HD1      LEU  17   1.199  12.382   5.627
  613   2HD1  LEU  17          2HD1      LEU  17   2.171  13.078   4.311
  614   3HD1  LEU  17          3HD1      LEU  17   2.387  13.655   5.972
  615   1HD2  LEU  17          1HD2      LEU  17   1.557  15.190   3.275
  616   2HD2  LEU  17          2HD2      LEU  17   0.537  16.340   4.166
  617   3HD2  LEU  17          3HD2      LEU  17   2.110  15.869   4.821
  618    H    TYR  18           H        TYR  18  -3.153  13.382   2.619
  619    HA   TYR  18           HA       TYR  18  -2.825  14.681   0.155
  620   1HB   TYR  18          1HB       TYR  18  -4.736  12.699   1.327
  621   2HB   TYR  18          2HB       TYR  18  -5.231  13.462  -0.133
  622    HD1  TYR  18           1HD      TYR  18  -3.153  13.665  -1.942
  623    HD2  TYR  18           2HD      TYR  18  -3.811  10.555   0.955
  624    HE1  TYR  18           1HE      TYR  18  -1.672  12.150  -3.243
  625    HE2  TYR  18           2HE      TYR  18  -2.297   9.050  -0.308
  626    HH   TYR  18           HH       TYR  18  -0.907   8.830  -2.095
  627    H    ARG  19           H        ARG  19  -5.432  15.219   2.577
  628    HA   ARG  19           HA       ARG  19  -6.942  17.117   1.101
  629   1HB   ARG  19          1HB       ARG  19  -7.609  15.960   3.233
  630   2HB   ARG  19          2HB       ARG  19  -6.512  17.023   4.122
  631   1HG   ARG  19          1HG       ARG  19  -7.829  19.003   3.323
  632   2HG   ARG  19          2HG       ARG  19  -8.927  17.900   2.472
  633   1HD   ARG  19          1HD       ARG  19  -9.490  16.825   4.662
  634   2HD   ARG  19          2HD       ARG  19  -8.403  17.947   5.475
  635    HE   ARG  19           HE       ARG  19  -9.866  19.764   5.039
  636   1HH1  ARG  19          1HH2      ARG  19 -11.331  16.779   3.916
  637   2HH1  ARG  19          2HH2      ARG  19 -12.920  17.490   3.845
  638   1HH2  ARG  19          1HH1      ARG  19 -11.911  20.597   4.909
  639   2HH2  ARG  19          2HH1      ARG  19 -13.231  19.592   4.388
  640    H    GLU  20           H        GLU  20  -4.151  17.684   3.245
  641    HA   GLU  20           HA       GLU  20  -4.154  20.588   2.744
  642   1HB   GLU  20          1HB       GLU  20  -3.234  18.929   4.758
  643   2HB   GLU  20          2HB       GLU  20  -1.757  19.211   3.879
  644   1HG   GLU  20          1HG       GLU  20  -1.823  20.888   5.547
  645   2HG   GLU  20          2HG       GLU  20  -2.210  21.712   4.042
  646    H    ALA  21           H        ALA  21  -2.294  17.805   1.624
  647    HA   ALA  21           HA       ALA  21  -0.427  19.128  -0.068
  648   1HB   ALA  21          1HB       ALA  21  -0.312  16.721   0.398
  649   2HB   ALA  21          2HB       ALA  21  -1.824  16.468  -0.510
  650   3HB   ALA  21          3HB       ALA  21  -0.374  17.029  -1.346
  651    H    SER  22           H        SER  22  -3.865  18.252  -0.714
  652    HA   SER  22           HA       SER  22  -4.055  19.192  -3.360
  653   1HB   SER  22          1HB       SER  22  -5.787  17.951  -1.979
  654   2HB   SER  22          2HB       SER  22  -6.214  19.514  -1.258
  655    HG   SER  22           HG       SER  22  -7.519  18.991  -3.068
  656    H    GLU  23           H        GLU  23  -3.990  21.132  -0.351
  657    HA   GLU  23           HA       GLU  23  -4.759  23.624  -1.604
  658   1HB   GLU  23          1HB       GLU  23  -4.735  22.935   0.912
  659   2HB   GLU  23          2HB       GLU  23  -3.034  23.356   0.863
  660   1HG   GLU  23          1HG       GLU  23  -4.216  25.258   1.688
  661   2HG   GLU  23          2HG       GLU  23  -3.618  25.654   0.085
  662    H    LYS  24           H        LYS  24  -1.601  22.174  -0.781
  663    HA   LYS  24           HA       LYS  24   0.018  24.267  -2.026
  664   1HB   LYS  24          1HB       LYS  24   0.626  21.384  -1.226
  665   2HB   LYS  24          2HB       LYS  24   1.759  22.374  -2.130
  666   1HG   LYS  24          1HG       LYS  24   2.541  22.808  -0.059
  667   2HG   LYS  24          2HG       LYS  24   1.442  24.158  -0.257
  668   1HD   LYS  24          1HD       LYS  24   1.171  23.357   1.951
  669   2HD   LYS  24          2HD       LYS  24  -0.278  22.821   1.092
  670   1HE   LYS  24          1HE       LYS  24   0.627  20.561   0.876
  671   2HE   LYS  24          2HE       LYS  24   2.208  21.084   1.467
  672   1HZ   LYS  24          1HZ       LYS  24   1.226  21.529   3.625
  673   2HZ   LYS  24          2HZ       LYS  24  -0.268  21.136   3.093
  674   3HZ   LYS  24          3HZ       LYS  24   0.898  19.985   3.212
  675    H    ALA  25           H        ALA  25  -1.248  21.203  -3.216
  676    HA   ALA  25           HA       ALA  25  -0.115  21.410  -5.868
  677   1HB   ALA  25          1HB       ALA  25  -0.428  19.278  -4.611
  678   2HB   ALA  25          2HB       ALA  25  -2.190  19.510  -4.685
  679   3HB   ALA  25          3HB       ALA  25  -1.269  19.247  -6.165
  680    H    ARG  26           H        ARG  26  -1.976  23.673  -5.148
  681    HA   ARG  26           HA       ARG  26  -4.499  23.294  -6.433
  682   1HB   ARG  26          1HB       ARG  26  -4.717  25.742  -6.246
  683   2HB   ARG  26          2HB       ARG  26  -4.290  24.934  -4.756
  684   1HG   ARG  26          1HG       ARG  26  -3.161  27.056  -4.951
  685   2HG   ARG  26          2HG       ARG  26  -1.974  25.753  -4.893
  686   1HD   ARG  26          1HD       ARG  26  -1.361  26.025  -7.138
  687   2HD   ARG  26          2HD       ARG  26  -2.910  26.783  -7.554
  688    HE   ARG  26           HE       ARG  26  -1.367  28.387  -5.689
  689   1HH1  ARG  26          1HH2      ARG  26  -1.640  27.694  -9.118
  690   2HH1  ARG  26          2HH2      ARG  26  -0.998  29.248  -9.573
  691   1HH2  ARG  26          1HH1      ARG  26  -0.574  30.360  -6.350
  692   2HH2  ARG  26          2HH1      ARG  26  -0.411  30.706  -8.047
  693    H    ASN  27           H        ASN  27  -1.479  23.603  -7.923
  694    HA   ASN  27           HA       ASN  27  -2.229  24.732 -10.462
  695   1HB   ASN  27          1HB       ASN  27   0.109  24.408  -9.727
  696   2HB   ASN  27          2HB       ASN  27  -0.115  22.658  -9.703
  697   1HD2  ASN  27          2HD2      ASN  27   1.229  25.062 -11.539
  698   2HD2  ASN  27          1HD2      ASN  27   1.083  24.287 -13.109
  699    HA   PRO  28           HA       PRO  28  -5.212  21.621 -11.306
  700   1HB   PRO  28          1HB       PRO  28  -5.758  21.984 -13.971
  701   2HB   PRO  28          2HB       PRO  28  -6.229  23.137 -12.686
  702   1HG   PRO  28          1HG       PRO  28  -3.773  23.241 -14.466
  703   2HG   PRO  28          2HG       PRO  28  -4.948  24.555 -14.124
  704   1HD   PRO  28          1HD       PRO  28  -2.601  24.364 -12.783
  705   2HD   PRO  28          2HD       PRO  28  -4.101  24.854 -11.930
  706    H    GLU  29           H        GLU  29  -2.116  21.421 -12.974
  707    HA   GLU  29           HA       GLU  29  -2.515  18.851 -14.239
  708   1HB   GLU  29          1HB       GLU  29  -0.657  20.510 -14.640
  709   2HB   GLU  29          2HB       GLU  29   0.058  20.045 -13.112
  710   1HG   GLU  29          1HG       GLU  29  -0.507  18.125 -15.414
  711   2HG   GLU  29          2HG       GLU  29   1.008  18.996 -15.225
  712    H    LYS  30           H        LYS  30  -1.040  19.770 -11.194
  713    HA   LYS  30           HA       LYS  30  -0.885  17.088 -10.106
  714   1HB   LYS  30          1HB       LYS  30   0.408  19.437  -9.562
  715   2HB   LYS  30          2HB       LYS  30  -0.822  19.534  -8.335
  716   1HG   LYS  30          1HG       LYS  30   1.105  18.493  -7.336
  717   2HG   LYS  30          2HG       LYS  30  -0.112  17.230  -7.523
  718   1HD   LYS  30          1HD       LYS  30   2.051  16.332  -8.161
  719   2HD   LYS  30          2HD       LYS  30   1.059  16.449  -9.606
  720   1HE   LYS  30          1HE       LYS  30   2.270  18.852  -9.800
  721   2HE   LYS  30          2HE       LYS  30   3.470  18.068  -8.775
  722   1HZ   LYS  30          1HZ       LYS  30   3.508  16.274 -10.540
  723   2HZ   LYS  30          2HZ       LYS  30   2.536  17.235 -11.468
  724   3HZ   LYS  30          3HZ       LYS  30   4.036  17.728 -11.072
  725    H    LYS  31           H        LYS  31  -3.157  19.753  -9.537
  726    HA   LYS  31           HA       LYS  31  -4.833  18.421  -7.710
  727   1HB   LYS  31          1HB       LYS  31  -4.810  20.903  -8.919
  728   2HB   LYS  31          2HB       LYS  31  -6.206  20.178  -9.692
  729   1HG   LYS  31          1HG       LYS  31  -5.723  20.605  -6.707
  730   2HG   LYS  31          2HG       LYS  31  -6.825  21.502  -7.757
  731   1HD   LYS  31          1HD       LYS  31  -8.046  19.275  -8.150
  732   2HD   LYS  31          2HD       LYS  31  -7.036  18.618  -6.850
  733   1HE   LYS  31          1HE       LYS  31  -9.063  19.180  -5.805
  734   2HE   LYS  31          2HE       LYS  31  -7.918  20.436  -5.330
  735   1HZ   LYS  31          1HZ       LYS  31  -8.931  21.883  -7.032
  736   2HZ   LYS  31          2HZ       LYS  31  -9.963  20.697  -7.485
  737   3HZ   LYS  31          3HZ       LYS  31 -10.079  21.358  -6.001
  738    H    SER  32           H        SER  32  -4.502  17.729 -11.077
  739    HA   SER  32           HA       SER  32  -6.861  15.897 -10.976
  740   1HB   SER  32          1HB       SER  32  -5.236  16.749 -13.405
  741   2HB   SER  32          2HB       SER  32  -6.755  15.837 -13.399
  742    HG   SER  32           HG       SER  32  -6.270  18.546 -12.809
  743    H    VAL  33           H        VAL  33  -3.805  15.587 -10.105
  744    HA   VAL  33           HA       VAL  33  -3.598  12.741 -11.051
  745    HB   VAL  33           HB       VAL  33  -1.448  14.755 -10.330
  746   1HG1  VAL  33          1HG1      VAL  33  -0.756  12.695  -9.214
  747   2HG1  VAL  33          2HG1      VAL  33  -1.127  11.742 -10.672
  748   3HG1  VAL  33          3HG1      VAL  33   0.202  12.922 -10.677
  749   1HG2  VAL  33          1HG2      VAL  33  -1.872  12.957 -12.765
  750   2HG2  VAL  33          2HG2      VAL  33  -2.282  14.679 -12.693
  751   3HG2  VAL  33          3HG2      VAL  33  -0.594  14.175 -12.556
  752    H    LEU  34           H        LEU  34  -3.193  14.886  -8.081
  753    HA   LEU  34           HA       LEU  34  -3.169  12.484  -6.431
  754   1HB   LEU  34          1HB       LEU  34  -2.681  13.778  -4.735
  755   2HB   LEU  34          2HB       LEU  34  -2.139  14.873  -5.994
  756    HG   LEU  34           HG       LEU  34  -4.820  14.903  -4.654
  757   1HD1  LEU  34          1HD1      LEU  34  -2.909  15.471  -3.092
  758   2HD1  LEU  34          2HD1      LEU  34  -2.498  16.820  -4.155
  759   3HD1  LEU  34          3HD1      LEU  34  -4.062  16.787  -3.304
  760   1HD2  LEU  34          1HD2      LEU  34  -3.540  17.100  -6.301
  761   2HD2  LEU  34          2HD2      LEU  34  -4.889  16.069  -6.836
  762   3HD2  LEU  34          3HD2      LEU  34  -5.118  17.190  -5.490
  763    H    GLN  35           H        GLN  35  -5.706  14.195  -8.048
  764    HA   GLN  35           HA       GLN  35  -7.864  13.654  -6.307
  765   1HB   GLN  35          1HB       GLN  35  -7.458  14.786  -8.885
  766   2HB   GLN  35          2HB       GLN  35  -8.591  13.480  -9.139
  767   1HG   GLN  35          1HG       GLN  35 -10.021  14.389  -7.281
  768   2HG   GLN  35          2HG       GLN  35  -8.888  15.739  -7.111
  769   1HE2  GLN  35          2HE2      GLN  35  -8.466  16.982  -9.279
  770   2HE2  GLN  35          1HE2      GLN  35  -9.908  17.258 -10.264
  771    H    LYS  36           H        LYS  36  -6.328  11.564  -8.771
  772    HA   LYS  36           HA       LYS  36  -8.381   9.502  -8.661
  773   1HB   LYS  36          1HB       LYS  36  -5.446   9.402  -9.559
  774   2HB   LYS  36          2HB       LYS  36  -6.613   8.095  -9.791
  775   1HG   LYS  36          1HG       LYS  36  -8.023   9.565 -11.193
  776   2HG   LYS  36          2HG       LYS  36  -6.859  10.891 -10.988
  777   1HD   LYS  36          1HD       LYS  36  -5.094   9.535 -12.064
  778   2HD   LYS  36          2HD       LYS  36  -6.233   8.183 -12.250
  779   1HE   LYS  36          1HE       LYS  36  -7.703   9.621 -13.648
  780   2HE   LYS  36          2HE       LYS  36  -6.562  10.962 -13.473
  781   1HZ   LYS  36          1HZ       LYS  36  -4.893   9.605 -14.618
  782   2HZ   LYS  36          2HZ       LYS  36  -5.940   8.357 -14.768
  783   3HZ   LYS  36          3HZ       LYS  36  -6.217   9.757 -15.558
  784    H    ILE  37           H        ILE  37  -5.316   9.955  -6.939
  785    HA   ILE  37           HA       ILE  37  -5.537   7.493  -5.389
  786    HB   ILE  37           HB       ILE  37  -4.134  10.114  -4.767
  787   1HG1  ILE  37          1HG1      ILE  37  -2.912   7.679  -6.013
  788   2HG1  ILE  37          2HG1      ILE  37  -3.274   9.228  -6.805
  789   1HG2  ILE  37          1HG2      ILE  37  -4.212   9.071  -2.684
  790   2HG2  ILE  37          2HG2      ILE  37  -4.348   7.455  -3.376
  791   3HG2  ILE  37          3HG2      ILE  37  -2.783   8.225  -3.316
  792   1HD1  ILE  37          1HD1      ILE  37  -1.697  10.309  -5.105
  793   2HD1  ILE  37          2HD1      ILE  37  -1.118   8.640  -4.804
  794   3HD1  ILE  37          3HD1      ILE  37  -0.989   9.346  -6.408
  795    H    LEU  38           H        LEU  38  -6.525  10.939  -4.709
  796    HA   LEU  38           HA       LEU  38  -7.748  10.467  -2.219
  797   1HB   LEU  38          1HB       LEU  38  -8.249  12.405  -4.479
  798   2HB   LEU  38          2HB       LEU  38  -9.389  12.355  -3.155
  799    HG   LEU  38           HG       LEU  38  -6.404  12.805  -2.724
  800   1HD1  LEU  38          1HD1      LEU  38  -7.357  14.618  -4.105
  801   2HD1  LEU  38          2HD1      LEU  38  -8.665  14.841  -2.919
  802   3HD1  LEU  38          3HD1      LEU  38  -6.976  15.184  -2.473
  803   1HD2  LEU  38          1HD2      LEU  38  -7.364  13.836  -0.565
  804   2HD2  LEU  38          2HD2      LEU  38  -8.897  13.067  -0.981
  805   3HD2  LEU  38          3HD2      LEU  38  -7.448  12.073  -0.689
  806    H    GLU  39           H        GLU  39  -9.242   9.933  -5.481
  807    HA   GLU  39           HA       GLU  39 -11.736   9.071  -4.315
  808   1HB   GLU  39          1HB       GLU  39 -11.466   9.959  -6.639
  809   2HB   GLU  39          2HB       GLU  39 -10.545   8.515  -7.077
  810   1HG   GLU  39          1HG       GLU  39 -12.527   7.102  -6.653
  811   2HG   GLU  39          2HG       GLU  39 -13.435   8.513  -6.101
  812    H    ASP  40           H        ASP  40  -8.856   7.217  -5.373
  813    HA   ASP  40           HA       ASP  40  -9.863   4.608  -4.858
  814   1HB   ASP  40          1HB       ASP  40  -7.182   6.020  -5.006
  815   2HB   ASP  40          2HB       ASP  40  -7.241   4.422  -4.434
  816    H    GLU  41           H        GLU  41  -8.432   7.084  -2.678
  817    HA   GLU  41           HA       GLU  41  -8.220   5.148  -0.465
  818   1HB   GLU  41          1HB       GLU  41  -8.037   8.174  -0.420
  819   2HB   GLU  41          2HB       GLU  41  -7.745   7.125   0.963
  820   1HG   GLU  41          1HG       GLU  41  -6.027   7.479  -1.496
  821   2HG   GLU  41          2HG       GLU  41  -5.665   7.916   0.152
  822    H    GLU  42           H        GLU  42 -10.557   7.673  -1.419
  823    HA   GLU  42           HA       GLU  42 -12.310   7.326   0.826
  824   1HB   GLU  42          1HB       GLU  42 -12.406   9.183  -0.836
  825   2HB   GLU  42          2HB       GLU  42 -13.037   8.050  -2.042
  826   1HG   GLU  42          1HG       GLU  42 -15.023   7.638  -0.649
  827   2HG   GLU  42          2HG       GLU  42 -14.350   8.623   0.653
  828    H    LYS  43           H        LYS  43 -11.963   5.493  -2.213
  829    HA   LYS  43           HA       LYS  43 -14.131   3.657  -1.753
  830   1HB   LYS  43          1HB       LYS  43 -12.258   4.083  -3.813
  831   2HB   LYS  43          2HB       LYS  43 -11.785   2.527  -3.161
  832   1HG   LYS  43          1HG       LYS  43 -13.318   2.071  -4.894
  833   2HG   LYS  43          2HG       LYS  43 -14.229   1.811  -3.400
  834   1HD   LYS  43          1HD       LYS  43 -15.267   4.071  -3.655
  835   2HD   LYS  43          2HD       LYS  43 -14.318   4.325  -5.136
  836   1HE   LYS  43          1HE       LYS  43 -15.404   2.324  -6.155
  837   2HE   LYS  43          2HE       LYS  43 -16.363   2.101  -4.686
  838   1HZ   LYS  43          1HZ       LYS  43 -17.373   4.286  -5.099
  839   2HZ   LYS  43          2HZ       LYS  43 -16.487   4.486  -6.459
  840   3HZ   LYS  43          3HZ       LYS  43 -17.612   3.308  -6.381
  841    H    HIS  44           H        HIS  44 -10.603   3.403  -0.759
  842    HA   HIS  44           HA       HIS  44 -10.853   0.901   0.469
  843   1HB   HIS  44          1HB       HIS  44  -9.075   3.300   1.113
  844   2HB   HIS  44          2HB       HIS  44  -8.864   1.649   1.596
  845    HD2  HIS  44           2HD      HIS  44  -9.827   0.986  -1.732
  846    HE1  HIS  44           1HE      HIS  44  -5.741   1.990  -2.267
  847    HE2  HIS  44           2HE      HIS  44  -7.821   1.031  -3.382
  848    H    ILE  45           H        ILE  45 -11.184   4.204   1.873
  849    HA   ILE  45           HA       ILE  45 -11.885   3.351   4.500
  850    HB   ILE  45           HB       ILE  45 -12.133   5.870   2.885
  851   1HG1  ILE  45          1HG1      ILE  45 -11.042   6.807   4.972
  852   2HG1  ILE  45          2HG1      ILE  45 -11.039   5.183   5.649
  853   1HG2  ILE  45          1HG2      ILE  45 -14.336   5.870   3.895
  854   2HG2  ILE  45          2HG2      ILE  45 -13.637   5.502   5.495
  855   3HG2  ILE  45          3HG2      ILE  45 -13.309   7.056   4.689
  856   1HD1  ILE  45          1HD1      ILE  45  -9.495   4.453   3.823
  857   2HD1  ILE  45          2HD1      ILE  45  -9.510   6.127   3.199
  858   3HD1  ILE  45          3HD1      ILE  45  -8.847   5.782   4.798
  859    H    GLU  46           H        GLU  46 -14.102   3.773   1.661
  860    HA   GLU  46           HA       GLU  46 -16.502   3.137   3.055
  861   1HB   GLU  46          1HB       GLU  46 -15.541   2.931   0.206
  862   2HB   GLU  46          2HB       GLU  46 -17.000   2.070   0.636
  863   1HG   GLU  46          1HG       GLU  46 -16.604   5.035   1.162
  864   2HG   GLU  46          2HG       GLU  46 -17.297   4.381  -0.323
  865    H    TRP  47           H        TRP  47 -14.107   0.908   1.572
  866    HA   TRP  47           HA       TRP  47 -15.630  -1.462   2.218
  867   1HB   TRP  47          1HB       TRP  47 -12.668  -1.159   1.609
  868   2HB   TRP  47          2HB       TRP  47 -13.635  -2.605   1.467
  869    HD1  TRP  47           1HD      TRP  47 -15.943  -0.639  -0.228
  870    HE1  TRP  47           1HE      TRP  47 -15.456  -0.281  -2.727
  871    HE3  TRP  47           3HE      TRP  47 -11.059  -1.948  -0.252
  872    HZ2  TRP  47           2HZ      TRP  47 -13.153  -0.474  -4.504
  873    HZ3  TRP  47           3HZ      TRP  47  -9.671  -1.828  -2.316
  874    HH2  TRP  47           2HH      TRP  47 -10.720  -1.052  -4.456
  875    H    LEU  48           H        LEU  48 -12.882   0.221   3.744
  876    HA   LEU  48           HA       LEU  48 -12.379  -1.517   5.927
  877   1HB   LEU  48          1HB       LEU  48 -12.123   1.445   5.377
  878   2HB   LEU  48          2HB       LEU  48 -11.769   0.880   6.972
  879    HG   LEU  48           HG       LEU  48 -10.433  -0.280   4.513
  880   1HD1  LEU  48          1HD1      LEU  48  -9.901   2.115   4.667
  881   2HD1  LEU  48          2HD1      LEU  48  -9.460   1.929   6.378
  882   3HD1  LEU  48          3HD1      LEU  48  -8.497   1.139   5.104
  883   1HD2  LEU  48          1HD2      LEU  48  -9.701  -0.341   7.482
  884   2HD2  LEU  48          2HD2      LEU  48 -10.286  -1.718   6.525
  885   3HD2  LEU  48          3HD2      LEU  48  -8.712  -1.008   6.168
  886    H    GLU  49           H        GLU  49 -14.787   1.099   5.619
  887    HA   GLU  49           HA       GLU  49 -15.948   0.717   8.223
  888   1HB   GLU  49          1HB       GLU  49 -16.319   2.614   6.422
  889   2HB   GLU  49          2HB       GLU  49 -17.585   1.569   5.807
  890   1HG   GLU  49          1HG       GLU  49 -18.608   1.499   8.104
  891   2HG   GLU  49          2HG       GLU  49 -17.366   2.615   8.666
  892    H    THR  50           H        THR  50 -16.910  -0.678   5.052
  893    HA   THR  50           HA       THR  50 -19.027  -2.234   6.199
  894    HB   THR  50           HB       THR  50 -18.395  -1.653   3.671
  895    HG1  THR  50           1HG      THR  50 -19.908  -3.903   4.491
  896   1HG2  THR  50          1HG2      THR  50 -16.620  -3.366   3.377
  897   2HG2  THR  50          2HG2      THR  50 -17.783  -4.639   3.792
  898   3HG2  THR  50          3HG2      THR  50 -18.019  -3.643   2.343
  899    H    ILE  51           H        ILE  51 -15.645  -2.855   6.174
  900    HA   ILE  51           HA       ILE  51 -15.969  -5.621   7.141
  901    HB   ILE  51           HB       ILE  51 -13.578  -3.910   6.399
  902   1HG1  ILE  51          1HG1      ILE  51 -14.894  -4.806   4.497
  903   2HG1  ILE  51          2HG1      ILE  51 -13.252  -5.408   4.545
  904   1HG2  ILE  51          1HG2      ILE  51 -12.686  -5.267   8.147
  905   2HG2  ILE  51          2HG2      ILE  51 -13.486  -6.725   7.525
  906   3HG2  ILE  51          3HG2      ILE  51 -12.152  -5.967   6.619
  907   1HD1  ILE  51          1HD1      ILE  51 -14.058  -7.591   5.405
  908   2HD1  ILE  51          2HD1      ILE  51 -15.728  -6.972   5.414
  909   3HD1  ILE  51          3HD1      ILE  51 -14.853  -7.150   3.888
  910    H    ASN  52           H        ASN  52 -15.734  -2.579   8.557
  911    HA   ASN  52           HA       ASN  52 -14.553  -3.390  11.094
  912   1HB   ASN  52          1HB       ASN  52 -14.559  -1.036  10.226
  913   2HB   ASN  52          2HB       ASN  52 -16.310  -0.986  10.455
  914   1HD2  ASN  52          2HD2      ASN  52 -16.124   0.771  11.965
  915   2HD2  ASN  52          1HD2      ASN  52 -15.472   0.489  13.572
  916    H    GLY  53           H        GLY  53 -15.524  -3.956  13.011
  917   1HA   GLY  53          1HA       GLY  53 -17.717  -3.866  14.321
  918   2HA   GLY  53          2HA       GLY  53 -18.410  -4.791  12.990
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1   5.373  20.555  -3.224
    2   2H    MET   1          2H        MET   1   6.409  21.616  -2.527
    3   3H    MET   1          3H        MET   1   5.705  21.975  -3.959
    4    HA   MET   1           HA       MET   1   6.851  20.176  -5.063
    5   1HB   MET   1          1HB       MET   1   8.491  22.316  -3.699
    6   2HB   MET   1          2HB       MET   1   9.279  21.076  -4.684
    7   1HG   MET   1          1HG       MET   1   7.991  21.629  -6.623
    8   2HG   MET   1          2HG       MET   1   6.962  22.743  -5.730
    9   1HE   MET   1          1HE       MET   1   7.307  25.212  -5.596
   10   2HE   MET   1          2HE       MET   1   8.360  24.816  -4.215
   11   3HE   MET   1          3HE       MET   1   8.900  25.980  -5.445
   12    H    ASP   2           H        ASP   2   8.807  20.505  -2.027
   13    HA   ASP   2           HA       ASP   2   9.476  17.695  -2.121
   14   1HB   ASP   2          1HB       ASP   2  11.029  19.461  -1.406
   15   2HB   ASP   2          2HB       ASP   2  10.011  19.811  -0.009
   16    H    TYR   3           H        TYR   3   7.084  17.146  -2.137
   17    HA   TYR   3           HA       TYR   3   6.096  16.369   0.564
   18   1HB   TYR   3          1HB       TYR   3   5.353  18.741  -0.354
   19   2HB   TYR   3          2HB       TYR   3   4.259  17.836  -1.366
   20    HD1  TYR   3           1HD      TYR   3   3.670  15.640   0.954
   21    HD2  TYR   3           2HD      TYR   3   3.696  19.954   0.772
   22    HE1  TYR   3           1HE      TYR   3   2.091  15.740   2.856
   23    HE2  TYR   3           2HE      TYR   3   2.110  20.035   2.678
   24    HH   TYR   3           HH       TYR   3   0.959  18.833   4.255
   25    H    LEU   4           H        LEU   4   7.182  14.592  -1.105
   26    HA   LEU   4           HA       LEU   4   4.897  12.999  -2.083
   27   1HB   LEU   4          1HB       LEU   4   5.877  12.537  -4.224
   28   2HB   LEU   4          2HB       LEU   4   5.693  14.262  -3.991
   29    HG   LEU   4           HG       LEU   4   8.267  13.917  -3.089
   30   1HD1  LEU   4          1HD1      LEU   4   8.286  11.508  -3.791
   31   2HD1  LEU   4          2HD1      LEU   4   7.924  12.014  -5.443
   32   3HD1  LEU   4          3HD1      LEU   4   9.461  12.489  -4.671
   33   1HD2  LEU   4          1HD2      LEU   4   7.491  14.415  -5.982
   34   2HD2  LEU   4          2HD2      LEU   4   7.532  15.631  -4.688
   35   3HD2  LEU   4          3HD2      LEU   4   9.028  14.844  -5.207
   36    H    ARG   5           H        ARG   5   8.463  12.781  -1.449
   37    HA   ARG   5           HA       ARG   5   8.422   9.939  -0.992
   38   1HB   ARG   5          1HB       ARG   5  10.455  11.349  -1.417
   39   2HB   ARG   5          2HB       ARG   5  10.294  12.036   0.206
   40   1HG   ARG   5          1HG       ARG   5  10.623   9.782   1.201
   41   2HG   ARG   5          2HG       ARG   5  10.632   9.065  -0.415
   42   1HD   ARG   5          1HD       ARG   5  12.894   9.205   0.309
   43   2HD   ARG   5          2HD       ARG   5  12.671  10.410  -0.970
   44    HE   ARG   5           HE       ARG   5  12.237  11.653   1.575
   45   1HH1  ARG   5          1HH2      ARG   5  14.926  10.358  -0.262
   46   2HH1  ARG   5          2HH2      ARG   5  16.086  11.381   0.542
   47   1HH2  ARG   5          1HH1      ARG   5  13.773  12.934   2.556
   48   2HH2  ARG   5          2HH1      ARG   5  15.443  12.794   2.093
   49    H    GLU   6           H        GLU   6   7.840  12.688   1.109
   50    HA   GLU   6           HA       GLU   6   7.407  11.426   3.595
   51   1HB   GLU   6          1HB       GLU   6   7.470  13.947   2.945
   52   2HB   GLU   6          2HB       GLU   6   5.795  13.753   2.460
   53   1HG   GLU   6          1HG       GLU   6   5.704  14.626   4.637
   54   2HG   GLU   6          2HG       GLU   6   5.327  12.923   4.856
   55    H    LEU   7           H        LEU   7   5.211  11.786   0.821
   56    HA   LEU   7           HA       LEU   7   2.880  10.703   2.195
   57   1HB   LEU   7          1HB       LEU   7   3.387  11.039  -0.797
   58   2HB   LEU   7          2HB       LEU   7   1.839  10.717  -0.026
   59    HG   LEU   7           HG       LEU   7   3.520  13.244   0.270
   60   1HD1  LEU   7          1HD1      LEU   7   2.352  13.007  -1.877
   61   2HD1  LEU   7          2HD1      LEU   7   0.817  12.714  -1.014
   62   3HD1  LEU   7          3HD1      LEU   7   1.642  14.291  -0.855
   63   1HD2  LEU   7          1HD2      LEU   7   0.875  12.450   1.541
   64   2HD2  LEU   7          2HD2      LEU   7   2.386  12.933   2.366
   65   3HD2  LEU   7          3HD2      LEU   7   1.461  14.122   1.433
   66    H    TYR   8           H        TYR   8   4.992   9.427  -0.376
   67    HA   TYR   8           HA       TYR   8   4.057   6.824  -0.768
   68   1HB   TYR   8          1HB       TYR   8   6.139   8.353  -1.601
   69   2HB   TYR   8          2HB       TYR   8   7.025   7.546  -0.376
   70    HD1  TYR   8           1HD      TYR   8   6.407   4.676  -0.641
   71    HD2  TYR   8           2HD      TYR   8   6.990   7.717  -3.638
   72    HE1  TYR   8           1HE      TYR   8   7.289   2.967  -2.200
   73    HE2  TYR   8           2HE      TYR   8   7.802   5.984  -5.226
   74    HH   TYR   8           HH       TYR   8   8.165   2.549  -4.283
   75    H    LYS   9           H        LYS   9   6.207   7.928   1.796
   76    HA   LYS   9           HA       LYS   9   6.657   5.336   2.882
   77   1HB   LYS   9          1HB       LYS   9   8.110   7.331   3.045
   78   2HB   LYS   9          2HB       LYS   9   6.959   8.098   4.145
   79   1HG   LYS   9          1HG       LYS   9   7.406   6.522   5.876
   80   2HG   LYS   9          2HG       LYS   9   8.248   5.407   4.780
   81   1HD   LYS   9          1HD       LYS   9   9.187   8.269   5.073
   82   2HD   LYS   9          2HD       LYS   9   9.607   7.092   6.321
   83   1HE   LYS   9          1HE       LYS   9  10.244   6.746   3.353
   84   2HE   LYS   9          2HE       LYS   9  11.356   7.466   4.518
   85   1HZ   LYS   9          1HZ       LYS   9  11.349   5.378   5.758
   86   2HZ   LYS   9          2HZ       LYS   9  10.326   4.683   4.687
   87   3HZ   LYS   9          3HZ       LYS   9  11.828   5.115   4.224
   88    H    LEU  10           H        LEU  10   4.496   7.841   4.319
   89    HA   LEU  10           HA       LEU  10   3.235   5.995   6.020
   90   1HB   LEU  10          1HB       LEU  10   2.355   8.690   4.939
   91   2HB   LEU  10          2HB       LEU  10   1.387   7.734   6.060
   92    HG   LEU  10           HG       LEU  10   3.905   7.643   7.251
   93   1HD1  LEU  10          1HD1      LEU  10   4.930   9.293   5.907
   94   2HD1  LEU  10          2HD1      LEU  10   3.571  10.415   6.097
   95   3HD1  LEU  10          3HD1      LEU  10   4.612  10.016   7.481
   96   1HD2  LEU  10          1HD2      LEU  10   1.670   9.637   7.808
   97   2HD2  LEU  10          2HD2      LEU  10   1.754   7.966   8.408
   98   3HD2  LEU  10          3HD2      LEU  10   2.951   9.153   8.942
   99    H    GLU  11           H        GLU  11   2.576   6.725   2.617
  100    HA   GLU  11           HA       GLU  11   0.284   5.042   2.248
  101   1HB   GLU  11          1HB       GLU  11   2.450   6.273   0.621
  102   2HB   GLU  11          2HB       GLU  11   1.766   4.944  -0.159
  103   1HG   GLU  11          1HG       GLU  11   0.131   7.265   1.012
  104   2HG   GLU  11          2HG       GLU  11   0.792   7.273  -0.614
  105    H    GLN  12           H        GLN  12   3.841   4.185   2.301
  106    HA   GLN  12           HA       GLN  12   3.293   1.411   2.032
  107   1HB   GLN  12          1HB       GLN  12   5.726   3.019   2.740
  108   2HB   GLN  12          2HB       GLN  12   5.694   1.268   2.976
  109   1HG   GLN  12          1HG       GLN  12   4.905   1.038   0.583
  110   2HG   GLN  12          2HG       GLN  12   5.269   2.735   0.377
  111   1HE2  GLN  12          2HE2      GLN  12   7.603   3.384   0.546
  112   2HE2  GLN  12          1HE2      GLN  12   8.857   2.158   0.431
  113    H    GLN  13           H        GLN  13   3.312   3.450   4.878
  114    HA   GLN  13           HA       GLN  13   3.696   1.306   6.806
  115   1HB   GLN  13          1HB       GLN  13   2.273   4.006   7.055
  116   2HB   GLN  13          2HB       GLN  13   2.421   2.889   8.398
  117   1HG   GLN  13          1HG       GLN  13   4.794   4.074   6.904
  118   2HG   GLN  13          2HG       GLN  13   4.138   4.699   8.409
  119   1HE2  GLN  13          2HE2      GLN  13   6.605   2.769   7.228
  120   2HE2  GLN  13          1HE2      GLN  13   6.856   1.795   8.671
  121    H    ALA  14           H        ALA  14   0.805   2.386   5.063
  122    HA   ALA  14           HA       ALA  14  -0.967   0.492   6.426
  123   1HB   ALA  14          1HB       ALA  14  -1.834   2.477   5.216
  124   2HB   ALA  14          2HB       ALA  14  -1.170   1.851   3.689
  125   3HB   ALA  14          3HB       ALA  14  -2.465   0.970   4.530
  126    H    MET  15           H        MET  15   1.126   0.401   3.489
  127    HA   MET  15           HA       MET  15   0.339  -2.250   2.657
  128   1HB   MET  15          1HB       MET  15   2.981  -0.818   2.197
  129   2HB   MET  15          2HB       MET  15   2.459  -2.265   1.360
  130   1HG   MET  15          1HG       MET  15   0.860   0.317   1.223
  131   2HG   MET  15          2HG       MET  15   2.216  -0.032   0.166
  132   1HE   MET  15          1HE       MET  15  -1.044  -2.535   1.208
  133   2HE   MET  15          2HE       MET  15  -1.339  -0.774   1.218
  134   3HE   MET  15          3HE       MET  15  -1.998  -1.801  -0.071
  135    H    LYS  16           H        LYS  16   2.997  -1.255   4.851
  136    HA   LYS  16           HA       LYS  16   3.934  -3.960   5.288
  137   1HB   LYS  16          1HB       LYS  16   4.302  -1.250   6.555
  138   2HB   LYS  16          2HB       LYS  16   4.680  -2.658   7.539
  139   1HG   LYS  16          1HG       LYS  16   6.665  -1.791   6.416
  140   2HG   LYS  16          2HG       LYS  16   6.319  -3.460   5.964
  141   1HD   LYS  16          1HD       LYS  16   5.388  -2.670   3.785
  142   2HD   LYS  16          2HD       LYS  16   5.749  -0.993   4.255
  143   1HE   LYS  16          1HE       LYS  16   8.157  -1.523   4.371
  144   2HE   LYS  16          2HE       LYS  16   7.808  -3.237   4.126
  145   1HZ   LYS  16          1HZ       LYS  16   7.002  -2.722   1.898
  146   2HZ   LYS  16          2HZ       LYS  16   7.390  -1.136   2.053
  147   3HZ   LYS  16          3HZ       LYS  16   8.553  -2.270   2.073
  148    H    LEU  17           H        LEU  17   1.532  -1.944   7.000
  149    HA   LEU  17           HA       LEU  17   0.765  -3.973   8.873
  150   1HB   LEU  17          1HB       LEU  17  -0.196  -1.365   7.995
  151   2HB   LEU  17          2HB       LEU  17  -1.558  -2.433   8.137
  152    HG   LEU  17           HG       LEU  17   0.552  -2.015  10.309
  153   1HD1  LEU  17          1HD1      LEU  17  -0.746   0.029   9.850
  154   2HD1  LEU  17          2HD1      LEU  17  -2.261  -0.872  10.081
  155   3HD1  LEU  17          3HD1      LEU  17  -1.132  -0.654  11.439
  156   1HD2  LEU  17          1HD2      LEU  17  -2.192  -3.352  10.434
  157   2HD2  LEU  17          2HD2      LEU  17  -0.630  -4.187  10.555
  158   3HD2  LEU  17          3HD2      LEU  17  -1.115  -3.050  11.814
  159    H    TYR  18           H        TYR  18  -0.416  -3.344   5.547
  160    HA   TYR  18           HA       TYR  18  -2.390  -5.328   5.488
  161   1HB   TYR  18          1HB       TYR  18  -0.914  -3.673   3.487
  162   2HB   TYR  18          2HB       TYR  18  -1.736  -5.055   2.861
  163    HD1  TYR  18           1HD      TYR  18  -4.187  -5.380   4.015
  164    HD2  TYR  18           2HD      TYR  18  -2.206  -1.637   3.307
  165    HE1  TYR  18           1HE      TYR  18  -6.364  -4.213   4.193
  166    HE2  TYR  18           2HE      TYR  18  -4.378  -0.446   3.475
  167    HH   TYR  18           HH       TYR  18  -6.596  -0.632   3.965
  168    H    ARG  19           H        ARG  19   1.117  -5.724   4.794
  169    HA   ARG  19           HA       ARG  19   0.954  -8.444   3.858
  170   1HB   ARG  19          1HB       ARG  19   3.106  -7.036   5.505
  171   2HB   ARG  19          2HB       ARG  19   3.210  -8.708   4.963
  172   1HG   ARG  19          1HG       ARG  19   2.838  -7.809   2.564
  173   2HG   ARG  19          2HG       ARG  19   3.151  -6.207   3.248
  174   1HD   ARG  19          1HD       ARG  19   5.220  -7.040   2.361
  175   2HD   ARG  19          2HD       ARG  19   5.360  -7.076   4.115
  176    HE   ARG  19           HE       ARG  19   4.932  -9.419   2.280
  177   1HH1  ARG  19          1HH2      ARG  19   5.950  -8.378   5.477
  178   2HH1  ARG  19          2HH2      ARG  19   6.406  -9.993   5.942
  179   1HH2  ARG  19          1HH1      ARG  19   5.526 -11.437   2.956
  180   2HH2  ARG  19          2HH1      ARG  19   6.176 -11.666   4.551
  181    H    GLU  20           H        GLU  20   1.044  -7.182   7.196
  182    HA   GLU  20           HA       GLU  20   0.989  -9.861   8.324
  183   1HB   GLU  20          1HB       GLU  20   1.762  -7.391   9.250
  184   2HB   GLU  20          2HB       GLU  20   0.167  -7.476   9.956
  185   1HG   GLU  20          1HG       GLU  20   1.557  -8.345  11.627
  186   2HG   GLU  20          2HG       GLU  20   0.833  -9.777  10.908
  187    H    ALA  21           H        ALA  21  -1.389  -7.300   7.846
  188    HA   ALA  21           HA       ALA  21  -3.664  -8.488   9.004
  189   1HB   ALA  21          1HB       ALA  21  -3.507  -6.171   8.078
  190   2HB   ALA  21          2HB       ALA  21  -3.582  -6.863   6.439
  191   3HB   ALA  21          3HB       ALA  21  -4.953  -7.046   7.539
  192    H    SER  22           H        SER  22  -2.197  -9.198   5.814
  193    HA   SER  22           HA       SER  22  -4.146 -11.062   4.879
  194   1HB   SER  22          1HB       SER  22  -2.208 -10.016   3.610
  195   2HB   SER  22          2HB       SER  22  -1.151 -11.200   4.400
  196    HG   SER  22           HG       SER  22  -1.929 -11.870   2.329
  197    H    GLU  23           H        GLU  23  -1.426 -11.515   7.180
  198    HA   GLU  23           HA       GLU  23  -1.815 -14.416   7.363
  199   1HB   GLU  23          1HB       GLU  23   0.328 -12.970   7.796
  200   2HB   GLU  23          2HB       GLU  23  -0.347 -12.758   9.407
  201   1HG   GLU  23          1HG       GLU  23  -0.454 -15.201   9.727
  202   2HG   GLU  23          2HG       GLU  23   0.084 -15.472   8.071
  203    H    LYS  24           H        LYS  24  -2.699 -11.581   9.300
  204    HA   LYS  24           HA       LYS  24  -4.154 -12.959  11.371
  205   1HB   LYS  24          1HB       LYS  24  -4.579 -10.191  10.177
  206   2HB   LYS  24          2HB       LYS  24  -5.393 -10.751  11.625
  207   1HG   LYS  24          1HG       LYS  24  -2.358 -10.772  11.533
  208   2HG   LYS  24          2HG       LYS  24  -3.224  -9.262  11.751
  209   1HD   LYS  24          1HD       LYS  24  -2.558 -10.124  13.892
  210   2HD   LYS  24          2HD       LYS  24  -4.320 -10.107  13.775
  211   1HE   LYS  24          1HE       LYS  24  -4.357 -12.531  13.386
  212   2HE   LYS  24          2HE       LYS  24  -2.588 -12.579  13.322
  213   1HZ   LYS  24          1HZ       LYS  24  -2.546 -11.898  15.657
  214   2HZ   LYS  24          2HZ       LYS  24  -4.177 -11.827  15.724
  215   3HZ   LYS  24          3HZ       LYS  24  -3.428 -13.259  15.502
  216    H    ALA  25           H        ALA  25  -5.199 -11.934   8.138
  217    HA   ALA  25           HA       ALA  25  -7.904 -12.902   8.347
  218   1HB   ALA  25          1HB       ALA  25  -7.896 -12.705   5.925
  219   2HB   ALA  25          2HB       ALA  25  -7.060 -11.293   6.610
  220   3HB   ALA  25          3HB       ALA  25  -6.128 -12.586   5.877
  221    H    ARG  26           H        ARG  26  -5.151 -14.323   6.594
  222    HA   ARG  26           HA       ARG  26  -4.973 -16.260   5.465
  223   1HB   ARG  26          1HB       ARG  26  -4.425 -16.621   8.138
  224   2HB   ARG  26          2HB       ARG  26  -5.572 -17.912   7.881
  225   1HG   ARG  26          1HG       ARG  26  -3.392 -18.811   7.517
  226   2HG   ARG  26          2HG       ARG  26  -4.112 -18.667   5.906
  227   1HD   ARG  26          1HD       ARG  26  -2.852 -16.587   5.502
  228   2HD   ARG  26          2HD       ARG  26  -2.258 -16.602   7.174
  229    HE   ARG  26           HE       ARG  26  -1.447 -19.037   6.064
  230   1HH1  ARG  26          1HH2      ARG  26  -0.784 -15.673   5.313
  231   2HH1  ARG  26          2HH2      ARG  26   0.852 -16.017   4.825
  232   1HH2  ARG  26          1HH1      ARG  26   0.638 -19.398   5.389
  233   2HH2  ARG  26          2HH1      ARG  26   1.618 -18.072   4.838
  234    H    ASN  27           H        ASN  27  -7.669 -15.257   5.337
  235    HA   ASN  27           HA       ASN  27  -9.218 -17.744   4.749
  236   1HB   ASN  27          1HB       ASN  27  -9.991 -16.614   6.808
  237   2HB   ASN  27          2HB       ASN  27 -10.175 -15.097   5.929
  238   1HD2  ASN  27          2HD2      ASN  27 -11.795 -18.028   6.810
  239   2HD2  ASN  27          1HD2      ASN  27 -13.186 -17.766   5.769
  240    HA   PRO  28           HA       PRO  28  -8.984 -16.108   0.721
  241   1HB   PRO  28          1HB       PRO  28 -10.831 -17.583  -0.670
  242   2HB   PRO  28          2HB       PRO  28  -9.316 -18.261   0.000
  243   1HG   PRO  28          1HG       PRO  28 -12.085 -18.302   1.247
  244   2HG   PRO  28          2HG       PRO  28 -10.952 -19.676   1.029
  245   1HD   PRO  28          1HD       PRO  28 -11.121 -18.335   3.377
  246   2HD   PRO  28          2HD       PRO  28  -9.536 -18.892   2.757
  247    H    GLU  29           H        GLU  29 -12.083 -15.716   2.380
  248    HA   GLU  29           HA       GLU  29 -13.336 -14.112   0.305
  249   1HB   GLU  29          1HB       GLU  29 -14.499 -15.245   2.282
  250   2HB   GLU  29          2HB       GLU  29 -13.822 -13.986   3.306
  251   1HG   GLU  29          1HG       GLU  29 -16.032 -13.310   2.806
  252   2HG   GLU  29          2HG       GLU  29 -14.992 -12.264   1.852
  253    H    LYS  30           H        LYS  30 -11.750 -13.269   3.318
  254    HA   LYS  30           HA       LYS  30 -11.433 -10.442   2.840
  255   1HB   LYS  30          1HB       LYS  30 -11.028 -12.202   4.982
  256   2HB   LYS  30          2HB       LYS  30  -9.393 -11.711   4.581
  257   1HG   LYS  30          1HG       LYS  30 -11.701  -9.772   5.076
  258   2HG   LYS  30          2HG       LYS  30 -10.625 -10.367   6.331
  259   1HD   LYS  30          1HD       LYS  30  -8.669  -9.382   5.072
  260   2HD   LYS  30          2HD       LYS  30  -9.830  -8.629   3.952
  261   1HE   LYS  30          1HE       LYS  30 -10.892  -7.403   5.763
  262   2HE   LYS  30          2HE       LYS  30  -9.996  -8.306   6.982
  263   1HZ   LYS  30          1HZ       LYS  30  -8.953  -6.203   6.743
  264   2HZ   LYS  30          2HZ       LYS  30  -7.933  -7.285   6.075
  265   3HZ   LYS  30          3HZ       LYS  30  -8.841  -6.319   5.107
  266    H    LYS  31           H        LYS  31  -9.258 -13.186   2.165
  267    HA   LYS  31           HA       LYS  31  -7.140 -11.625   1.088
  268   1HB   LYS  31          1HB       LYS  31  -7.290 -14.179   1.789
  269   2HB   LYS  31          2HB       LYS  31  -7.517 -14.393   0.043
  270   1HG   LYS  31          1HG       LYS  31  -5.390 -13.115  -0.331
  271   2HG   LYS  31          2HG       LYS  31  -5.251 -12.857   1.417
  272   1HD   LYS  31          1HD       LYS  31  -5.090 -15.317   1.755
  273   2HD   LYS  31          2HD       LYS  31  -5.173 -15.542  -0.009
  274   1HE   LYS  31          1HE       LYS  31  -3.153 -14.035  -0.232
  275   2HE   LYS  31          2HE       LYS  31  -3.054 -13.961   1.531
  276   1HZ   LYS  31          1HZ       LYS  31  -2.721 -16.386   1.534
  277   2HZ   LYS  31          2HZ       LYS  31  -2.797 -16.435  -0.099
  278   3HZ   LYS  31          3HZ       LYS  31  -1.567 -15.656   0.636
  279    H    SER  32           H        SER  32 -10.172 -11.925  -0.308
  280    HA   SER  32           HA       SER  32  -9.073 -10.795  -2.854
  281   1HB   SER  32          1HB       SER  32 -11.673 -12.305  -2.385
  282   2HB   SER  32          2HB       SER  32 -11.226 -11.498  -3.903
  283    HG   SER  32           HG       SER  32 -10.698 -13.747  -3.889
  284    H    VAL  33           H        VAL  33 -10.022  -9.641  -0.079
  285    HA   VAL  33           HA       VAL  33 -11.468  -7.290  -1.270
  286    HB   VAL  33           HB       VAL  33 -11.517  -8.390   1.562
  287   1HG1  VAL  33          1HG1      VAL  33 -11.437  -5.944   1.710
  288   2HG1  VAL  33          2HG1      VAL  33 -12.730  -5.803   0.499
  289   3HG1  VAL  33          3HG1      VAL  33 -13.059  -6.525   2.090
  290   1HG2  VAL  33          1HG2      VAL  33 -13.750  -7.908  -0.463
  291   2HG2  VAL  33          2HG2      VAL  33 -13.057  -9.491  -0.069
  292   3HG2  VAL  33          3HG2      VAL  33 -13.932  -8.586   1.171
  293    H    LEU  34           H        LEU  34  -8.910  -8.192   1.223
  294    HA   LEU  34           HA       LEU  34  -7.865  -5.494   1.158
  295   1HB   LEU  34          1HB       LEU  34  -6.570  -6.104   2.825
  296   2HB   LEU  34          2HB       LEU  34  -7.778  -7.363   3.016
  297    HG   LEU  34           HG       LEU  34  -5.177  -7.581   1.559
  298   1HD1  LEU  34          1HD1      LEU  34  -4.876  -7.338   4.056
  299   2HD1  LEU  34          2HD1      LEU  34  -5.877  -8.773   4.294
  300   3HD1  LEU  34          3HD1      LEU  34  -4.313  -8.896   3.462
  301   1HD2  LEU  34          1HD2      LEU  34  -6.918  -9.876   2.497
  302   2HD2  LEU  34          2HD2      LEU  34  -6.803  -9.326   0.809
  303   3HD2  LEU  34          3HD2      LEU  34  -5.385 -10.006   1.612
  304    H    GLN  35           H        GLN  35  -7.483  -8.231  -0.951
  305    HA   GLN  35           HA       GLN  35  -4.978  -7.537  -2.146
  306   1HB   GLN  35          1HB       GLN  35  -5.862  -9.724  -2.276
  307   2HB   GLN  35          2HB       GLN  35  -7.355  -9.209  -3.044
  308   1HG   GLN  35          1HG       GLN  35  -4.633  -8.817  -4.357
  309   2HG   GLN  35          2HG       GLN  35  -5.485 -10.352  -4.454
  310   1HE2  GLN  35          2HE2      GLN  35  -4.877  -9.103  -6.833
  311   2HE2  GLN  35          1HE2      GLN  35  -6.367  -8.490  -7.537
  312    H    LYS  36           H        LYS  36  -8.316  -6.438  -2.753
  313    HA   LYS  36           HA       LYS  36  -7.644  -5.074  -5.230
  314   1HB   LYS  36          1HB       LYS  36  -9.865  -6.067  -4.542
  315   2HB   LYS  36          2HB       LYS  36 -10.097  -4.695  -3.455
  316   1HG   LYS  36          1HG       LYS  36 -10.187  -3.144  -5.258
  317   2HG   LYS  36          2HG       LYS  36  -9.467  -4.271  -6.408
  318   1HD   LYS  36          1HD       LYS  36 -12.185  -4.753  -5.118
  319   2HD   LYS  36          2HD       LYS  36 -11.970  -3.882  -6.648
  320   1HE   LYS  36          1HE       LYS  36 -10.811  -5.856  -7.623
  321   2HE   LYS  36          2HE       LYS  36 -11.051  -6.750  -6.119
  322   1HZ   LYS  36          1HZ       LYS  36 -13.456  -6.577  -6.473
  323   2HZ   LYS  36          2HZ       LYS  36 -13.235  -5.740  -7.863
  324   3HZ   LYS  36          3HZ       LYS  36 -12.750  -7.292  -7.757
  325    H    ILE  37           H        ILE  37  -7.892  -4.077  -1.851
  326    HA   ILE  37           HA       ILE  37  -7.109  -1.285  -2.248
  327    HB   ILE  37           HB       ILE  37  -6.732  -3.218   0.070
  328   1HG1  ILE  37          1HG1      ILE  37  -8.801  -1.075  -0.312
  329   2HG1  ILE  37          2HG1      ILE  37  -9.033  -2.834  -0.322
  330   1HG2  ILE  37          1HG2      ILE  37  -6.232  -0.212  -0.055
  331   2HG2  ILE  37          2HG2      ILE  37  -6.230  -1.150   1.439
  332   3HG2  ILE  37          3HG2      ILE  37  -5.008  -1.468   0.232
  333   1HD1  ILE  37          1HD1      ILE  37  -8.271  -2.870   2.085
  334   2HD1  ILE  37          2HD1      ILE  37  -8.395  -1.086   2.056
  335   3HD1  ILE  37          3HD1      ILE  37  -9.825  -2.075   1.774
  336    H    LEU  38           H        LEU  38  -5.130  -4.294  -1.540
  337    HA   LEU  38           HA       LEU  38  -2.626  -3.063  -1.737
  338   1HB   LEU  38          1HB       LEU  38  -3.634  -5.837  -2.317
  339   2HB   LEU  38          2HB       LEU  38  -1.978  -5.456  -2.732
  340    HG   LEU  38           HG       LEU  38  -2.992  -4.823   0.055
  341   1HD1  LEU  38          1HD1      LEU  38  -3.542  -7.192  -0.295
  342   2HD1  LEU  38          2HD1      LEU  38  -1.902  -7.507  -0.902
  343   3HD1  LEU  38          3HD1      LEU  38  -2.158  -7.032   0.795
  344   1HD2  LEU  38          1HD2      LEU  38  -0.257  -5.697  -0.991
  345   2HD2  LEU  38          2HD2      LEU  38  -0.741  -4.012  -0.801
  346   3HD2  LEU  38          3HD2      LEU  38  -0.637  -5.063   0.625
  347    H    GLU  39           H        GLU  39  -4.578  -4.251  -4.509
  348    HA   GLU  39           HA       GLU  39  -2.630  -3.448  -6.460
  349   1HB   GLU  39          1HB       GLU  39  -4.437  -5.143  -6.822
  350   2HB   GLU  39          2HB       GLU  39  -5.646  -3.857  -6.757
  351   1HG   GLU  39          1HG       GLU  39  -4.689  -2.824  -8.784
  352   2HG   GLU  39          2HG       GLU  39  -3.387  -4.016  -8.798
  353    H    ASP  40           H        ASP  40  -5.443  -1.655  -5.132
  354    HA   ASP  40           HA       ASP  40  -5.171   0.702  -6.735
  355   1HB   ASP  40          1HB       ASP  40  -6.357  -0.134  -4.071
  356   2HB   ASP  40          2HB       ASP  40  -6.212   1.522  -4.399
  357    H    GLU  41           H        GLU  41  -3.554  -0.396  -3.743
  358    HA   GLU  41           HA       GLU  41  -2.370   2.262  -3.261
  359   1HB   GLU  41          1HB       GLU  41  -1.844  -0.422  -1.979
  360   2HB   GLU  41          2HB       GLU  41  -1.109   1.086  -1.442
  361   1HG   GLU  41          1HG       GLU  41  -4.093   0.444  -1.365
  362   2HG   GLU  41          2HG       GLU  41  -3.006   0.309  -0.004
  363    H    GLU  42           H        GLU  42  -1.263  -0.825  -4.669
  364    HA   GLU  42           HA       GLU  42   1.424  -0.005  -5.255
  365   1HB   GLU  42          1HB       GLU  42   0.564  -2.323  -5.421
  366   2HB   GLU  42          2HB       GLU  42  -0.416  -1.862  -6.821
  367   1HG   GLU  42          1HG       GLU  42   1.634  -1.319  -8.090
  368   2HG   GLU  42          2HG       GLU  42   2.623  -1.645  -6.663
  369    H    LYS  43           H        LYS  43  -1.659   0.591  -6.943
  370    HA   LYS  43           HA       LYS  43  -0.594   1.947  -9.226
  371   1HB   LYS  43          1HB       LYS  43  -3.137   1.209  -8.403
  372   2HB   LYS  43          2HB       LYS  43  -3.194   2.944  -8.151
  373   1HG   LYS  43          1HG       LYS  43  -3.977   2.637 -10.335
  374   2HG   LYS  43          2HG       LYS  43  -2.301   3.155 -10.573
  375   1HD   LYS  43          1HD       LYS  43  -1.628   0.768 -10.900
  376   2HD   LYS  43          2HD       LYS  43  -3.306   0.267 -10.612
  377   1HE   LYS  43          1HE       LYS  43  -4.020   1.672 -12.567
  378   2HE   LYS  43          2HE       LYS  43  -2.322   2.055 -12.882
  379   1HZ   LYS  43          1HZ       LYS  43  -1.927  -0.337 -13.221
  380   2HZ   LYS  43          2HZ       LYS  43  -3.502  -0.675 -12.943
  381   3HZ   LYS  43          3HZ       LYS  43  -3.074   0.200 -14.250
  382    H    HIS  44           H        HIS  44  -1.523   3.319  -5.961
  383    HA   HIS  44           HA       HIS  44  -0.929   5.985  -6.557
  384   1HB   HIS  44          1HB       HIS  44  -0.691   4.398  -3.954
  385   2HB   HIS  44          2HB       HIS  44  -0.816   6.117  -4.152
  386    HD2  HIS  44           2HD      HIS  44  -3.242   5.246  -6.542
  387    HE1  HIS  44           1HE      HIS  44  -5.519   4.812  -3.001
  388    HE2  HIS  44           2HE      HIS  44  -5.596   4.853  -5.537
  389    H    ILE  45           H        ILE  45   1.157   3.362  -5.281
  390    HA   ILE  45           HA       ILE  45   3.541   4.920  -5.017
  391    HB   ILE  45           HB       ILE  45   2.793   2.032  -5.020
  392   1HG1  ILE  45          1HG1      ILE  45   4.403   2.061  -3.074
  393   2HG1  ILE  45          2HG1      ILE  45   4.688   3.771  -3.395
  394   1HG2  ILE  45          1HG2      ILE  45   4.563   1.817  -6.666
  395   2HG2  ILE  45          2HG2      ILE  45   5.655   2.813  -5.673
  396   3HG2  ILE  45          3HG2      ILE  45   5.122   1.214  -5.111
  397   1HD1  ILE  45          1HD1      ILE  45   2.305   4.258  -2.880
  398   2HD1  ILE  45          2HD1      ILE  45   2.034   2.521  -2.584
  399   3HD1  ILE  45          3HD1      ILE  45   3.128   3.443  -1.541
  400    H    GLU  46           H        GLU  46   2.315   3.174  -7.946
  401    HA   GLU  46           HA       GLU  46   4.555   3.787  -9.600
  402   1HB   GLU  46          1HB       GLU  46   1.648   3.150 -10.044
  403   2HB   GLU  46          2HB       GLU  46   2.513   3.878 -11.380
  404   1HG   GLU  46          1HG       GLU  46   3.474   1.389  -9.929
  405   2HG   GLU  46          2HG       GLU  46   2.421   1.361 -11.344
  406    H    TRP  47           H        TRP  47   1.660   5.784  -8.902
  407    HA   TRP  47           HA       TRP  47   2.435   7.909 -10.684
  408   1HB   TRP  47          1HB       TRP  47   0.613   8.031  -8.249
  409   2HB   TRP  47          2HB       TRP  47   0.600   9.081  -9.644
  410    HD1  TRP  47           1HD      TRP  47   0.651   6.254 -11.598
  411    HE1  TRP  47           1HE      TRP  47  -1.627   5.128 -11.992
  412    HE3  TRP  47           3HE      TRP  47  -1.916   8.276  -7.698
  413    HZ2  TRP  47           2HZ      TRP  47  -4.251   5.134 -10.766
  414    HZ3  TRP  47           3HZ      TRP  47  -4.293   7.676  -7.277
  415    HH2  TRP  47           2HH      TRP  47  -5.471   6.101  -8.810
  416    H    LEU  48           H        LEU  48   2.767   7.403  -7.176
  417    HA   LEU  48           HA       LEU  48   4.058   9.819  -6.439
  418   1HB   LEU  48          1HB       LEU  48   4.002   6.955  -5.464
  419   2HB   LEU  48          2HB       LEU  48   5.057   8.066  -4.668
  420    HG   LEU  48           HG       LEU  48   2.101   8.660  -5.007
  421   1HD1  LEU  48          1HD1      LEU  48   2.247   6.569  -3.780
  422   2HD1  LEU  48          2HD1      LEU  48   3.548   7.205  -2.771
  423   3HD1  LEU  48          3HD1      LEU  48   1.894   7.859  -2.626
  424   1HD2  LEU  48          1HD2      LEU  48   4.187   9.652  -3.004
  425   2HD2  LEU  48          2HD2      LEU  48   3.561  10.589  -4.378
  426   3HD2  LEU  48          3HD2      LEU  48   2.477  10.132  -3.055
  427    H    GLU  49           H        GLU  49   5.490   6.775  -7.644
  428    HA   GLU  49           HA       GLU  49   8.204   7.753  -7.691
  429   1HB   GLU  49          1HB       GLU  49   7.008   5.306  -8.093
  430   2HB   GLU  49          2HB       GLU  49   7.421   5.716  -9.742
  431   1HG   GLU  49          1HG       GLU  49   9.324   5.652  -7.354
  432   2HG   GLU  49          2HG       GLU  49   9.135   4.362  -8.533
  433    H    THR  50           H        THR  50   5.629   7.769 -10.252
  434    HA   THR  50           HA       THR  50   7.199   8.962 -12.280
  435    HB   THR  50           HB       THR  50   4.210   9.137 -11.717
  436    HG1  THR  50           1HG      THR  50   4.838   7.021 -11.976
  437   1HG2  THR  50          1HG2      THR  50   4.785  10.787 -13.372
  438   2HG2  THR  50          2HG2      THR  50   5.795   9.604 -14.252
  439   3HG2  THR  50          3HG2      THR  50   4.021   9.400 -14.168
  440    H    ILE  51           H        ILE  51   5.558  10.378  -9.544
  441    HA   ILE  51           HA       ILE  51   6.065  13.127 -10.400
  442    HB   ILE  51           HB       ILE  51   4.460  11.760  -8.310
  443   1HG1  ILE  51          1HG1      ILE  51   2.906  13.683  -8.805
  444   2HG1  ILE  51          2HG1      ILE  51   4.120  14.356  -9.891
  445   1HG2  ILE  51          1HG2      ILE  51   5.790  13.046  -6.766
  446   2HG2  ILE  51          2HG2      ILE  51   5.439  14.549  -7.678
  447   3HG2  ILE  51          3HG2      ILE  51   4.139  13.659  -6.858
  448   1HD1  ILE  51          1HD1      ILE  51   3.932  12.321 -11.319
  449   2HD1  ILE  51          2HD1      ILE  51   2.709  11.678 -10.190
  450   3HD1  ILE  51          3HD1      ILE  51   2.384  13.155 -11.117
  451    H    ASN  52           H        ASN  52   7.859  10.876  -8.697
  452    HA   ASN  52           HA       ASN  52   9.474  12.679  -7.100
  453   1HB   ASN  52          1HB       ASN  52   9.128  10.149  -6.796
  454   2HB   ASN  52          2HB       ASN  52  10.287   9.921  -8.105
  455   1HD2  ASN  52          2HD2      ASN  52  10.894   8.746  -5.774
  456   2HD2  ASN  52          1HD2      ASN  52  12.136   9.651  -4.919
  457    H    GLY  53           H        GLY  53  11.432  13.644  -7.513
  458   1HA   GLY  53          1HA       GLY  53  13.136  13.336  -9.760
  459   2HA   GLY  53          2HA       GLY  53  11.977  14.611 -10.140
  460   1H    MET   1          1H        MET   1  -9.713 -10.031  16.795
  461   2H    MET   1          2H        MET   1  -8.791  -9.610  18.076
  462   3H    MET   1          3H        MET   1  -8.688 -11.125  17.460
  463    HA   MET   1           HA       MET   1  -6.778  -9.799  16.812
  464   1HB   MET   1          1HB       MET   1  -8.634 -10.463  14.486
  465   2HB   MET   1          2HB       MET   1  -6.914 -10.088  14.357
  466   1HG   MET   1          1HG       MET   1  -7.020 -12.384  14.185
  467   2HG   MET   1          2HG       MET   1  -6.426 -12.091  15.814
  468   1HE   MET   1          1HE       MET   1  -7.641 -14.817  14.426
  469   2HE   MET   1          2HE       MET   1  -6.919 -14.794  16.053
  470   3HE   MET   1          3HE       MET   1  -8.531 -15.501  15.803
  471    H    ASP   2           H        ASP   2  -5.950  -7.993  15.534
  472    HA   ASP   2           HA       ASP   2  -7.773  -5.616  15.553
  473   1HB   ASP   2          1HB       ASP   2  -5.126  -6.004  16.993
  474   2HB   ASP   2          2HB       ASP   2  -5.924  -4.447  16.777
  475    H    TYR   3           H        TYR   3  -7.664  -6.054  13.217
  476    HA   TYR   3           HA       TYR   3  -5.548  -4.509  11.778
  477   1HB   TYR   3          1HB       TYR   3  -5.013  -6.238  10.302
  478   2HB   TYR   3          2HB       TYR   3  -4.799  -6.887  11.907
  479    HD1  TYR   3           1HD      TYR   3  -6.025  -7.599   8.721
  480    HD2  TYR   3           2HD      TYR   3  -6.962  -8.227  12.876
  481    HE1  TYR   3           1HE      TYR   3  -7.548  -9.477   8.115
  482    HE2  TYR   3           2HE      TYR   3  -8.475 -10.106  12.249
  483    HH   TYR   3           HH       TYR   3  -9.397 -11.321  10.542
  484    H    LEU   4           H        LEU   4  -7.697  -3.448  12.417
  485    HA   LEU   4           HA       LEU   4  -9.000  -2.856   9.853
  486   1HB   LEU   4          1HB       LEU   4 -11.280  -2.820  10.902
  487   2HB   LEU   4          2HB       LEU   4 -10.549  -4.395  10.699
  488    HG   LEU   4           HG       LEU   4  -9.797  -3.762  13.294
  489   1HD1  LEU   4          1HD1      LEU   4 -11.603  -1.854  13.123
  490   2HD1  LEU   4          2HD1      LEU   4 -12.746  -3.184  13.245
  491   3HD1  LEU   4          3HD1      LEU   4 -11.577  -2.935  14.533
  492   1HD2  LEU   4          1HD2      LEU   4 -12.200  -5.370  12.358
  493   2HD2  LEU   4          2HD2      LEU   4 -10.534  -5.959  12.524
  494   3HD2  LEU   4          3HD2      LEU   4 -11.442  -5.471  13.966
  495    H    ARG   5           H        ARG   5  -9.623  -1.679  13.243
  496    HA   ARG   5           HA       ARG   5  -9.549   1.030  12.381
  497   1HB   ARG   5          1HB       ARG   5  -9.770   1.666  14.652
  498   2HB   ARG   5          2HB       ARG   5 -10.743   0.252  14.349
  499   1HG   ARG   5          1HG       ARG   5  -9.919  -0.136  16.442
  500   2HG   ARG   5          2HG       ARG   5  -8.852  -1.134  15.463
  501   1HD   ARG   5          1HD       ARG   5  -6.989   0.249  15.897
  502   2HD   ARG   5          2HD       ARG   5  -7.983   1.690  16.076
  503    HE   ARG   5           HE       ARG   5  -8.326   1.274  18.306
  504   1HH1  ARG   5          1HH2      ARG   5  -6.740  -1.582  17.034
  505   2HH1  ARG   5          2HH2      ARG   5  -6.640  -2.323  18.607
  506   1HH2  ARG   5          1HH1      ARG   5  -8.054   0.326  20.277
  507   2HH2  ARG   5          2HH1      ARG   5  -7.264  -1.218  20.398
  508    H    GLU   6           H        GLU   6  -6.914  -1.003  13.344
  509    HA   GLU   6           HA       GLU   6  -4.917   1.091  13.502
  510   1HB   GLU   6          1HB       GLU   6  -4.941  -1.494  14.288
  511   2HB   GLU   6          2HB       GLU   6  -4.306  -1.794  12.685
  512   1HG   GLU   6          1HG       GLU   6  -2.362  -0.393  13.099
  513   2HG   GLU   6          2HG       GLU   6  -3.091   0.323  14.534
  514    H    LEU   7           H        LEU   7  -6.287  -0.724  10.815
  515    HA   LEU   7           HA       LEU   7  -4.176   0.038   8.925
  516   1HB   LEU   7          1HB       LEU   7  -6.945  -1.051   8.310
  517   2HB   LEU   7          2HB       LEU   7  -5.526  -1.092   7.286
  518    HG   LEU   7           HG       LEU   7  -6.245  -2.726   9.700
  519   1HD1  LEU   7          1HD1      LEU   7  -5.837  -4.601   8.143
  520   2HD1  LEU   7          2HD1      LEU   7  -6.987  -3.440   7.438
  521   3HD1  LEU   7          3HD1      LEU   7  -5.290  -3.460   6.902
  522   1HD2  LEU   7          1HD2      LEU   7  -3.499  -2.682   8.461
  523   2HD2  LEU   7          2HD2      LEU   7  -3.930  -2.205  10.129
  524   3HD2  LEU   7          3HD2      LEU   7  -4.119  -3.885   9.633
  525    H    TYR   8           H        TYR   8  -7.556   0.856   9.489
  526    HA   TYR   8           HA       TYR   8  -8.173   2.799   7.586
  527   1HB   TYR   8          1HB       TYR   8  -9.330   1.571   9.782
  528   2HB   TYR   8          2HB       TYR   8  -8.996   3.076  10.536
  529    HD1  TYR   8           1HD      TYR   8  -9.817   4.937   8.134
  530    HD2  TYR   8           2HD      TYR   8 -11.613   1.515  10.056
  531    HE1  TYR   8           1HE      TYR   8 -12.076   5.795   7.571
  532    HE2  TYR   8           2HE      TYR   8 -13.864   2.364   9.452
  533    HH   TYR   8           HH       TYR   8 -14.330   5.469   7.719
  534    H    LYS   9           H        LYS   9  -6.656   3.384  10.737
  535    HA   LYS   9           HA       LYS   9  -6.879   6.202  10.424
  536   1HB   LYS   9          1HB       LYS   9  -6.448   4.530  12.556
  537   2HB   LYS   9          2HB       LYS   9  -4.832   5.215  12.398
  538   1HG   LYS   9          1HG       LYS   9  -5.739   7.492  12.628
  539   2HG   LYS   9          2HG       LYS   9  -7.389   6.897  12.420
  540   1HD   LYS   9          1HD       LYS   9  -7.213   7.329  14.688
  541   2HD   LYS   9          2HD       LYS   9  -7.144   5.567  14.538
  542   1HE   LYS   9          1HE       LYS   9  -4.688   5.623  14.818
  543   2HE   LYS   9          2HE       LYS   9  -4.708   7.392  14.837
  544   1HZ   LYS   9          1HZ       LYS   9  -6.016   7.303  16.885
  545   2HZ   LYS   9          2HZ       LYS   9  -6.013   5.669  16.878
  546   3HZ   LYS   9          3HZ       LYS   9  -4.619   6.491  17.089
  547    H    LEU  10           H        LEU  10  -3.901   4.257  10.048
  548    HA   LEU  10           HA       LEU  10  -2.458   6.362   8.890
  549   1HB   LEU  10          1HB       LEU  10  -2.110   3.348   8.732
  550   2HB   LEU  10          2HB       LEU  10  -0.984   4.525   8.051
  551    HG   LEU  10           HG       LEU  10  -1.247   5.585  10.542
  552   1HD1  LEU  10          1HD1      LEU  10  -2.657   3.886  11.515
  553   2HD1  LEU  10          2HD1      LEU  10  -1.537   2.615  11.010
  554   3HD1  LEU  10          3HD1      LEU  10  -1.051   3.802  12.234
  555   1HD2  LEU  10          1HD2      LEU  10   0.667   3.334   9.793
  556   2HD2  LEU  10          2HD2      LEU  10   0.877   5.057   9.409
  557   3HD2  LEU  10          3HD2      LEU  10   0.911   4.522  11.093
  558    H    GLU  11           H        GLU  11  -4.669   3.980   7.369
  559    HA   GLU  11           HA       GLU  11  -4.427   4.893   4.675
  560   1HB   GLU  11          1HB       GLU  11  -6.367   3.438   6.381
  561   2HB   GLU  11          2HB       GLU  11  -7.164   4.193   5.102
  562   1HG   GLU  11          1HG       GLU  11  -4.709   2.365   4.818
  563   2HG   GLU  11          2HG       GLU  11  -6.373   1.805   4.749
  564    H    GLN  12           H        GLN  12  -6.342   6.378   7.393
  565    HA   GLN  12           HA       GLN  12  -7.128   8.561   5.699
  566   1HB   GLN  12          1HB       GLN  12  -7.432   7.923   8.626
  567   2HB   GLN  12          2HB       GLN  12  -7.903   9.492   7.946
  568   1HG   GLN  12          1HG       GLN  12  -9.288   8.355   6.251
  569   2HG   GLN  12          2HG       GLN  12  -8.930   6.804   6.977
  570   1HE2  GLN  12          2HE2      GLN  12 -11.450   8.824   6.769
  571   2HE2  GLN  12          1HE2      GLN  12 -12.094   8.700   8.399
  572    H    GLN  13           H        GLN  13  -4.320   8.073   7.684
  573    HA   GLN  13           HA       GLN  13  -3.584  10.851   7.938
  574   1HB   GLN  13          1HB       GLN  13  -1.967   8.283   7.934
  575   2HB   GLN  13          2HB       GLN  13  -1.165   9.840   7.956
  576   1HG   GLN  13          1HG       GLN  13  -3.255   9.056  10.027
  577   2HG   GLN  13          2HG       GLN  13  -1.523   8.787  10.224
  578   1HE2  GLN  13          2HE2      GLN  13  -0.072  10.751  10.217
  579   2HE2  GLN  13          1HE2      GLN  13  -0.773  12.275  10.740
  580    H    ALA  14           H        ALA  14  -3.156   8.563   5.219
  581    HA   ALA  14           HA       ALA  14  -1.623  10.455   3.593
  582   1HB   ALA  14          1HB       ALA  14  -1.620   8.003   3.181
  583   2HB   ALA  14          2HB       ALA  14  -3.364   8.048   2.832
  584   3HB   ALA  14          3HB       ALA  14  -2.217   8.895   1.769
  585    H    MET  15           H        MET  15  -5.096   9.689   3.999
  586    HA   MET  15           HA       MET  15  -6.071  11.576   2.025
  587   1HB   MET  15          1HB       MET  15  -7.136   9.688   3.943
  588   2HB   MET  15          2HB       MET  15  -8.002  11.188   4.156
  589   1HG   MET  15          1HG       MET  15  -7.640  10.349   1.317
  590   2HG   MET  15          2HG       MET  15  -8.494   9.185   2.305
  591   1HE   MET  15          1HE       MET  15  -8.972  13.083   3.187
  592   2HE   MET  15          2HE       MET  15  -8.330  13.005   1.536
  593   3HE   MET  15          3HE       MET  15 -10.003  13.541   1.815
  594    H    LYS  16           H        LYS  16  -5.450  12.027   5.543
  595    HA   LYS  16           HA       LYS  16  -6.209  14.804   5.662
  596   1HB   LYS  16          1HB       LYS  16  -4.470  12.923   7.274
  597   2HB   LYS  16          2HB       LYS  16  -4.351  14.641   7.603
  598   1HG   LYS  16          1HG       LYS  16  -7.048  13.229   7.588
  599   2HG   LYS  16          2HG       LYS  16  -6.000  13.256   9.015
  600   1HD   LYS  16          1HD       LYS  16  -5.969  15.730   8.984
  601   2HD   LYS  16          2HD       LYS  16  -7.058  15.739   7.584
  602   1HE   LYS  16          1HE       LYS  16  -8.812  14.630   8.888
  603   2HE   LYS  16          2HE       LYS  16  -7.719  14.444  10.266
  604   1HZ   LYS  16          1HZ       LYS  16  -7.634  16.864  10.461
  605   2HZ   LYS  16          2HZ       LYS  16  -8.627  17.058   9.176
  606   3HZ   LYS  16          3HZ       LYS  16  -9.184  16.364  10.544
  607    H    LEU  17           H        LEU  17  -3.066  13.256   4.949
  608    HA   LEU  17           HA       LEU  17  -1.596  15.641   4.409
  609   1HB   LEU  17          1HB       LEU  17  -1.410  12.717   3.895
  610   2HB   LEU  17          2HB       LEU  17  -0.603  13.645   2.689
  611    HG   LEU  17           HG       LEU  17  -0.160  14.065   5.681
  612   1HD1  LEU  17          1HD1      LEU  17   0.408  11.748   5.062
  613   2HD1  LEU  17          2HD1      LEU  17   1.460  12.345   3.756
  614   3HD1  LEU  17          3HD1      LEU  17   1.847  12.700   5.460
  615   1HD2  LEU  17          1HD2      LEU  17   1.571  14.785   3.269
  616   2HD2  LEU  17          2HD2      LEU  17   0.602  15.939   4.208
  617   3HD2  LEU  17          3HD2      LEU  17   1.959  15.101   4.973
  618    H    TYR  18           H        TYR  18  -3.566  13.598   2.223
  619    HA   TYR  18           HA       TYR  18  -3.235  15.138  -0.103
  620   1HB   TYR  18          1HB       TYR  18  -5.181  13.056   0.863
  621   2HB   TYR  18          2HB       TYR  18  -5.507  13.853  -0.624
  622    HD1  TYR  18           1HD      TYR  18  -3.038  14.144  -2.032
  623    HD2  TYR  18           2HD      TYR  18  -4.361  10.850   0.393
  624    HE1  TYR  18           1HE      TYR  18  -1.541  12.657  -3.272
  625    HE2  TYR  18           2HE      TYR  18  -2.682   9.381  -0.704
  626    HH   TYR  18           HH       TYR  18  -0.935   9.272  -2.216
  627    H    ARG  19           H        ARG  19  -5.751  15.493   2.428
  628    HA   ARG  19           HA       ARG  19  -7.329  17.531   1.212
  629   1HB   ARG  19          1HB       ARG  19  -6.567  16.861   4.071
  630   2HB   ARG  19          2HB       ARG  19  -7.448  18.334   3.755
  631   1HG   ARG  19          1HG       ARG  19  -8.456  15.595   2.887
  632   2HG   ARG  19          2HG       ARG  19  -8.827  16.366   4.435
  633   1HD   ARG  19          1HD       ARG  19  -9.601  18.403   3.016
  634   2HD   ARG  19          2HD       ARG  19  -9.654  17.262   1.659
  635    HE   ARG  19           HE       ARG  19 -11.080  15.956   3.612
  636   1HH1  ARG  19          1HH2      ARG  19 -11.454  19.170   2.260
  637   2HH1  ARG  19          2HH2      ARG  19 -13.126  19.274   2.740
  638   1HH2  ARG  19          1HH1      ARG  19 -13.215  16.164   4.199
  639   2HH2  ARG  19          2HH1      ARG  19 -14.089  17.612   3.799
  640    H    GLU  20           H        GLU  20  -4.317  17.912   3.086
  641    HA   GLU  20           HA       GLU  20  -4.330  20.830   2.711
  642   1HB   GLU  20          1HB       GLU  20  -3.309  19.136   4.622
  643   2HB   GLU  20          2HB       GLU  20  -1.881  19.358   3.640
  644   1HG   GLU  20          1HG       GLU  20  -1.723  21.016   5.299
  645   2HG   GLU  20          2HG       GLU  20  -2.234  21.884   3.857
  646    H    ALA  21           H        ALA  21  -2.465  18.112   1.443
  647    HA   ALA  21           HA       ALA  21  -0.742  19.499  -0.307
  648   1HB   ALA  21          1HB       ALA  21  -0.686  17.034   0.119
  649   2HB   ALA  21          2HB       ALA  21  -2.150  16.864  -0.878
  650   3HB   ALA  21          3HB       ALA  21  -0.641  17.452  -1.601
  651    H    SER  22           H        SER  22  -4.217  18.614  -0.846
  652    HA   SER  22           HA       SER  22  -4.443  19.627  -3.463
  653   1HB   SER  22          1HB       SER  22  -6.148  18.307  -2.182
  654   2HB   SER  22          2HB       SER  22  -6.595  19.794  -1.325
  655    HG   SER  22           HG       SER  22  -7.177  20.703  -3.328
  656    H    GLU  23           H        GLU  23  -4.265  21.577  -0.433
  657    HA   GLU  23           HA       GLU  23  -4.936  24.075  -1.866
  658   1HB   GLU  23          1HB       GLU  23  -5.199  23.647   0.632
  659   2HB   GLU  23          2HB       GLU  23  -3.448  23.732   0.756
  660   1HG   GLU  23          1HG       GLU  23  -3.482  26.032  -0.199
  661   2HG   GLU  23          2HG       GLU  23  -5.239  25.943  -0.332
  662    H    LYS  24           H        LYS  24  -1.964  22.556  -0.624
  663    HA   LYS  24           HA       LYS  24  -0.141  24.513  -1.661
  664   1HB   LYS  24          1HB       LYS  24   0.065  22.520   0.162
  665   2HB   LYS  24          2HB       LYS  24   0.736  21.668  -1.220
  666   1HG   LYS  24          1HG       LYS  24   2.589  22.603  -0.085
  667   2HG   LYS  24          2HG       LYS  24   2.364  23.664  -1.477
  668   1HD   LYS  24          1HD       LYS  24   1.196  25.314  -0.017
  669   2HD   LYS  24          2HD       LYS  24   1.339  24.197   1.356
  670   1HE   LYS  24          1HE       LYS  24   3.829  24.283   1.133
  671   2HE   LYS  24          2HE       LYS  24   3.657  25.454  -0.181
  672   1HZ   LYS  24          1HZ       LYS  24   2.741  25.877   2.618
  673   2HZ   LYS  24          2HZ       LYS  24   4.058  26.559   1.942
  674   3HZ   LYS  24          3HZ       LYS  24   2.571  26.963   1.406
  675    H    ALA  25           H        ALA  25  -1.645  21.877  -3.240
  676    HA   ALA  25           HA       ALA  25   0.160  21.935  -5.593
  677   1HB   ALA  25          1HB       ALA  25  -0.191  19.797  -4.246
  678   2HB   ALA  25          2HB       ALA  25  -1.895  19.830  -4.789
  679   3HB   ALA  25          3HB       ALA  25  -0.596  19.688  -5.964
  680    H    ARG  26           H        ARG  26  -2.101  23.881  -5.129
  681    HA   ARG  26           HA       ARG  26  -4.336  23.408  -6.676
  682   1HB   ARG  26          1HB       ARG  26  -4.743  25.712  -6.676
  683   2HB   ARG  26          2HB       ARG  26  -3.950  25.340  -5.164
  684   1HG   ARG  26          1HG       ARG  26  -2.495  26.532  -7.579
  685   2HG   ARG  26          2HG       ARG  26  -3.274  27.492  -6.330
  686   1HD   ARG  26          1HD       ARG  26  -1.773  26.533  -4.606
  687   2HD   ARG  26          2HD       ARG  26  -0.990  25.539  -5.836
  688    HE   ARG  26           HE       ARG  26   0.205  27.338  -6.607
  689   1HH1  ARG  26          1HH2      ARG  26  -2.236  28.653  -4.455
  690   2HH1  ARG  26          2HH2      ARG  26  -1.522  30.242  -4.487
  691   1HH2  ARG  26          1HH1      ARG  26   1.054  29.376  -6.588
  692   2HH2  ARG  26          2HH1      ARG  26   0.292  30.631  -5.656
  693    H    ASN  27           H        ASN  27  -1.217  23.735  -8.038
  694    HA   ASN  27           HA       ASN  27  -1.813  24.446 -10.739
  695   1HB   ASN  27          1HB       ASN  27   0.437  24.394  -9.639
  696   2HB   ASN  27          2HB       ASN  27   0.356  22.634  -9.579
  697   1HD2  ASN  27          2HD2      ASN  27   1.440  21.646 -11.272
  698   2HD2  ASN  27          1HD2      ASN  27   1.702  22.407 -12.832
  699    HA   PRO  28           HA       PRO  28  -4.419  21.080 -11.642
  700   1HB   PRO  28          1HB       PRO  28  -4.565  21.067 -14.392
  701   2HB   PRO  28          2HB       PRO  28  -5.310  22.303 -13.336
  702   1HG   PRO  28          1HG       PRO  28  -2.645  22.442 -14.771
  703   2HG   PRO  28          2HG       PRO  28  -3.941  23.682 -14.711
  704   1HD   PRO  28          1HD       PRO  28  -1.790  23.811 -13.081
  705   2HD   PRO  28          2HD       PRO  28  -3.417  24.253 -12.474
  706    H    GLU  29           H        GLU  29  -1.233  20.877 -13.195
  707    HA   GLU  29           HA       GLU  29  -1.209  18.234 -14.113
  708   1HB   GLU  29          1HB       GLU  29   0.618  20.003 -14.203
  709   2HB   GLU  29          2HB       GLU  29   1.044  19.567 -12.556
  710   1HG   GLU  29          1HG       GLU  29   1.513  17.237 -13.270
  711   2HG   GLU  29          2HG       GLU  29   1.043  17.642 -14.923
  712    H    LYS  30           H        LYS  30  -0.579  19.356 -10.873
  713    HA   LYS  30           HA       LYS  30  -0.432  16.690  -9.638
  714   1HB   LYS  30          1HB       LYS  30   0.747  19.091  -9.097
  715   2HB   LYS  30          2HB       LYS  30  -0.649  19.248  -8.062
  716   1HG   LYS  30          1HG       LYS  30   1.541  17.123  -8.009
  717   2HG   LYS  30          2HG       LYS  30   1.305  18.430  -6.856
  718   1HD   LYS  30          1HD       LYS  30  -0.775  17.353  -6.040
  719   2HD   LYS  30          2HD       LYS  30  -0.523  16.006  -7.188
  720   1HE   LYS  30          1HE       LYS  30   1.569  15.406  -6.219
  721   2HE   LYS  30          2HE       LYS  30   1.671  16.912  -5.296
  722   1HZ   LYS  30          1HZ       LYS  30  -0.222  16.153  -3.959
  723   2HZ   LYS  30          2HZ       LYS  30  -0.274  14.725  -4.793
  724   3HZ   LYS  30          3HZ       LYS  30   1.030  15.103  -3.873
  725    H    LYS  31           H        LYS  31  -2.722  19.451  -9.542
  726    HA   LYS  31           HA       LYS  31  -4.546  18.238  -7.797
  727   1HB   LYS  31          1HB       LYS  31  -4.407  20.658  -8.438
  728   2HB   LYS  31          2HB       LYS  31  -5.368  20.266  -9.874
  729   1HG   LYS  31          1HG       LYS  31  -7.251  19.615  -8.563
  730   2HG   LYS  31          2HG       LYS  31  -6.283  19.457  -7.086
  731   1HD   LYS  31          1HD       LYS  31  -5.957  21.876  -6.985
  732   2HD   LYS  31          2HD       LYS  31  -6.892  22.092  -8.486
  733   1HE   LYS  31          1HE       LYS  31  -8.879  21.104  -7.405
  734   2HE   LYS  31          2HE       LYS  31  -7.950  20.772  -5.938
  735   1HZ   LYS  31          1HZ       LYS  31  -7.673  23.167  -5.633
  736   2HZ   LYS  31          2HZ       LYS  31  -8.506  23.491  -7.006
  737   3HZ   LYS  31          3HZ       LYS  31  -9.261  22.809  -5.731
  738    H    SER  32           H        SER  32  -4.182  17.478 -11.140
  739    HA   SER  32           HA       SER  32  -6.572  15.694 -11.001
  740   1HB   SER  32          1HB       SER  32  -4.864  16.528 -13.376
  741   2HB   SER  32          2HB       SER  32  -6.287  15.472 -13.451
  742    HG   SER  32           HG       SER  32  -6.775  17.680 -13.928
  743    H    VAL  33           H        VAL  33  -3.540  15.312 -10.036
  744    HA   VAL  33           HA       VAL  33  -3.414  12.413 -10.843
  745    HB   VAL  33           HB       VAL  33  -1.256  14.333  -9.937
  746   1HG1  VAL  33          1HG1      VAL  33  -0.829  12.317  -8.621
  747   2HG1  VAL  33          2HG1      VAL  33  -1.076  11.289 -10.053
  748   3HG1  VAL  33          3HG1      VAL  33   0.313  12.391  -9.960
  749   1HG2  VAL  33          1HG2      VAL  33  -1.401  12.384 -12.283
  750   2HG2  VAL  33          2HG2      VAL  33  -1.844  14.096 -12.392
  751   3HG2  VAL  33          3HG2      VAL  33  -0.182  13.647 -11.997
  752    H    LEU  34           H        LEU  34  -3.119  14.627  -7.918
  753    HA   LEU  34           HA       LEU  34  -3.325  12.351  -6.151
  754   1HB   LEU  34          1HB       LEU  34  -3.079  13.773  -4.468
  755   2HB   LEU  34          2HB       LEU  34  -2.367  14.766  -5.733
  756    HG   LEU  34           HG       LEU  34  -5.179  14.869  -4.744
  757   1HD1  LEU  34          1HD1      LEU  34  -3.997  15.733  -2.890
  758   2HD1  LEU  34          2HD1      LEU  34  -2.832  16.607  -3.928
  759   3HD1  LEU  34          3HD1      LEU  34  -4.509  17.156  -3.744
  760   1HD2  LEU  34          1HD2      LEU  34  -3.665  16.950  -6.337
  761   2HD2  LEU  34          2HD2      LEU  34  -4.869  15.846  -7.042
  762   3HD2  LEU  34          3HD2      LEU  34  -5.380  17.052  -5.864
  763    H    GLN  35           H        GLN  35  -5.784  14.102  -7.920
  764    HA   GLN  35           HA       GLN  35  -8.015  13.440  -6.278
  765   1HB   GLN  35          1HB       GLN  35  -7.842  15.149  -8.162
  766   2HB   GLN  35          2HB       GLN  35  -8.020  13.801  -9.300
  767   1HG   GLN  35          1HG       GLN  35 -10.219  13.271  -8.272
  768   2HG   GLN  35          2HG       GLN  35  -9.981  14.596  -7.119
  769   1HE2  GLN  35          2HE2      GLN  35 -11.578  16.110  -7.745
  770   2HE2  GLN  35          1HE2      GLN  35 -11.706  16.720  -9.391
  771    H    LYS  36           H        LYS  36  -6.359  11.605  -8.836
  772    HA   LYS  36           HA       LYS  36  -8.321   9.481  -9.020
  773   1HB   LYS  36          1HB       LYS  36  -5.903  10.266 -10.373
  774   2HB   LYS  36          2HB       LYS  36  -5.495   8.751  -9.619
  775   1HG   LYS  36          1HG       LYS  36  -6.213   8.122 -11.722
  776   2HG   LYS  36          2HG       LYS  36  -7.641   7.791 -10.729
  777   1HD   LYS  36          1HD       LYS  36  -8.673   9.909 -11.487
  778   2HD   LYS  36          2HD       LYS  36  -7.180  10.351 -12.343
  779   1HE   LYS  36          1HE       LYS  36  -7.421   8.283 -13.749
  780   2HE   LYS  36          2HE       LYS  36  -8.982   7.974 -12.977
  781   1HZ   LYS  36          1HZ       LYS  36  -9.751  10.124 -13.855
  782   2HZ   LYS  36          2HZ       LYS  36  -8.304  10.398 -14.567
  783   3HZ   LYS  36          3HZ       LYS  36  -9.245   9.169 -15.079
  784    H    ILE  37           H        ILE  37  -5.354   9.859  -7.139
  785    HA   ILE  37           HA       ILE  37  -5.543   7.315  -5.700
  786    HB   ILE  37           HB       ILE  37  -4.273  10.013  -5.034
  787   1HG1  ILE  37          1HG1      ILE  37  -2.960   7.532  -6.127
  788   2HG1  ILE  37          2HG1      ILE  37  -3.306   9.033  -6.997
  789   1HG2  ILE  37          1HG2      ILE  37  -4.589   8.955  -2.927
  790   2HG2  ILE  37          2HG2      ILE  37  -4.177   7.360  -3.577
  791   3HG2  ILE  37          3HG2      ILE  37  -2.923   8.578  -3.342
  792   1HD1  ILE  37          1HD1      ILE  37  -1.772  10.241  -5.409
  793   2HD1  ILE  37          2HD1      ILE  37  -1.252   8.635  -4.820
  794   3HD1  ILE  37          3HD1      ILE  37  -1.008   9.077  -6.508
  795    H    LEU  38           H        LEU  38  -6.716  10.676  -4.905
  796    HA   LEU  38           HA       LEU  38  -7.987   9.954  -2.507
  797   1HB   LEU  38          1HB       LEU  38  -8.494  12.096  -4.575
  798   2HB   LEU  38          2HB       LEU  38  -9.622  11.907  -3.250
  799    HG   LEU  38           HG       LEU  38  -6.634  12.332  -2.811
  800   1HD1  LEU  38          1HD1      LEU  38  -7.639  14.277  -3.956
  801   2HD1  LEU  38          2HD1      LEU  38  -8.928  14.339  -2.731
  802   3HD1  LEU  38          3HD1      LEU  38  -7.238  14.659  -2.277
  803   1HD2  LEU  38          1HD2      LEU  38  -7.528  13.047  -0.531
  804   2HD2  LEU  38          2HD2      LEU  38  -9.096  12.392  -1.005
  805   3HD2  LEU  38          3HD2      LEU  38  -7.681  11.323  -0.869
  806    H    GLU  39           H        GLU  39  -9.402   9.598  -5.846
  807    HA   GLU  39           HA       GLU  39 -11.899   8.652  -4.732
  808   1HB   GLU  39          1HB       GLU  39 -10.607   8.411  -7.489
  809   2HB   GLU  39          2HB       GLU  39 -12.179   7.698  -7.115
  810   1HG   GLU  39          1HG       GLU  39 -13.072   9.911  -6.486
  811   2HG   GLU  39          2HG       GLU  39 -11.521  10.662  -6.858
  812    H    ASP  40           H        ASP  40  -8.903   6.975  -5.467
  813    HA   ASP  40           HA       ASP  40  -9.944   4.296  -5.017
  814   1HB   ASP  40          1HB       ASP  40  -7.305   5.721  -5.406
  815   2HB   ASP  40          2HB       ASP  40  -7.247   4.242  -4.592
  816    H    GLU  41           H        GLU  41  -8.540   6.871  -2.945
  817    HA   GLU  41           HA       GLU  41  -8.173   4.999  -0.696
  818   1HB   GLU  41          1HB       GLU  41  -8.073   8.039  -0.663
  819   2HB   GLU  41          2HB       GLU  41  -7.656   6.985   0.676
  820   1HG   GLU  41          1HG       GLU  41  -6.111   7.368  -1.893
  821   2HG   GLU  41          2HG       GLU  41  -5.658   7.853  -0.281
  822    H    GLU  42           H        GLU  42 -10.616   7.443  -1.585
  823    HA   GLU  42           HA       GLU  42 -12.226   7.146   0.761
  824   1HB   GLU  42          1HB       GLU  42 -12.412   8.927  -0.995
  825   2HB   GLU  42          2HB       GLU  42 -13.159   7.739  -2.075
  826   1HG   GLU  42          1HG       GLU  42 -15.022   7.449  -0.483
  827   2HG   GLU  42          2HG       GLU  42 -14.216   8.497   0.688
  828    H    LYS  43           H        LYS  43 -11.956   5.135  -2.157
  829    HA   LYS  43           HA       LYS  43 -14.160   3.367  -1.539
  830   1HB   LYS  43          1HB       LYS  43 -12.626   3.706  -3.764
  831   2HB   LYS  43          2HB       LYS  43 -11.771   2.342  -3.056
  832   1HG   LYS  43          1HG       LYS  43 -13.351   1.373  -4.487
  833   2HG   LYS  43          2HG       LYS  43 -14.076   1.200  -2.882
  834   1HD   LYS  43          1HD       LYS  43 -15.497   3.215  -3.330
  835   2HD   LYS  43          2HD       LYS  43 -14.748   3.359  -4.933
  836   1HE   LYS  43          1HE       LYS  43 -15.568   1.058  -5.488
  837   2HE   LYS  43          2HE       LYS  43 -16.363   0.978  -3.910
  838   1HZ   LYS  43          1HZ       LYS  43 -17.721   2.899  -4.580
  839   2HZ   LYS  43          2HZ       LYS  43 -16.990   2.955  -6.041
  840   3HZ   LYS  43          3HZ       LYS  43 -17.914   1.673  -5.640
  841    H    HIS  44           H        HIS  44 -10.589   3.150  -0.744
  842    HA   HIS  44           HA       HIS  44 -10.707   0.716   0.630
  843   1HB   HIS  44          1HB       HIS  44  -8.992   3.205   1.090
  844   2HB   HIS  44          2HB       HIS  44  -8.699   1.585   1.632
  845    HD2  HIS  44           2HD      HIS  44  -9.732   0.720  -1.617
  846    HE1  HIS  44           1HE      HIS  44  -5.743   1.935  -2.383
  847    HE2  HIS  44           2HE      HIS  44  -7.805   0.801  -3.353
  848    H    ILE  45           H        ILE  45 -11.291   4.065   1.768
  849    HA   ILE  45           HA       ILE  45 -11.646   3.442   4.523
  850    HB   ILE  45           HB       ILE  45 -12.189   5.749   2.727
  851   1HG1  ILE  45          1HG1      ILE  45 -11.172   6.972   4.678
  852   2HG1  ILE  45          2HG1      ILE  45 -11.068   5.442   5.543
  853   1HG2  ILE  45          1HG2      ILE  45 -14.399   5.674   3.731
  854   2HG2  ILE  45          2HG2      ILE  45 -13.690   5.523   5.359
  855   3HG2  ILE  45          3HG2      ILE  45 -13.478   7.010   4.407
  856   1HD1  ILE  45          1HD1      ILE  45  -9.492   4.593   3.786
  857   2HD1  ILE  45          2HD1      ILE  45  -9.581   6.198   3.006
  858   3HD1  ILE  45          3HD1      ILE  45  -8.908   6.035   4.629
  859    H    GLU  46           H        GLU  46 -14.130   3.426   1.893
  860    HA   GLU  46           HA       GLU  46 -16.351   2.734   3.553
  861   1HB   GLU  46          1HB       GLU  46 -15.638   2.320   0.631
  862   2HB   GLU  46          2HB       GLU  46 -17.086   1.594   1.291
  863   1HG   GLU  46          1HG       GLU  46 -16.497   4.566   1.463
  864   2HG   GLU  46          2HG       GLU  46 -17.375   3.806   0.133
  865    H    TRP  47           H        TRP  47 -13.885   0.658   2.010
  866    HA   TRP  47           HA       TRP  47 -15.182  -1.817   2.751
  867   1HB   TRP  47          1HB       TRP  47 -12.282  -1.240   1.992
  868   2HB   TRP  47          2HB       TRP  47 -13.065  -2.791   1.977
  869    HD1  TRP  47           1HD      TRP  47 -15.622  -1.114   0.236
  870    HE1  TRP  47           1HE      TRP  47 -15.235  -0.924  -2.301
  871    HE3  TRP  47           3HE      TRP  47 -10.645  -2.180   0.106
  872    HZ2  TRP  47           2HZ      TRP  47 -13.010  -1.168  -4.145
  873    HZ3  TRP  47           3HZ      TRP  47  -9.377  -2.189  -2.036
  874    HH2  TRP  47           2HH      TRP  47 -10.558  -1.632  -4.169
  875    H    LEU  48           H        LEU  48 -12.622   0.207   4.137
  876    HA   LEU  48           HA       LEU  48 -11.767  -1.472   6.209
  877   1HB   LEU  48          1HB       LEU  48 -11.517   1.307   5.405
  878   2HB   LEU  48          2HB       LEU  48 -11.945   1.300   7.081
  879    HG   LEU  48           HG       LEU  48  -9.667   1.371   6.945
  880   1HD1  LEU  48          1HD1      LEU  48 -10.638  -0.234   8.651
  881   2HD1  LEU  48          2HD1      LEU  48 -10.149  -1.570   7.581
  882   3HD1  LEU  48          3HD1      LEU  48  -8.943  -0.470   8.234
  883   1HD2  LEU  48          1HD2      LEU  48  -9.631  -1.110   5.185
  884   2HD2  LEU  48          2HD2      LEU  48  -9.280   0.550   4.668
  885   3HD2  LEU  48          3HD2      LEU  48  -8.204  -0.262   5.817
  886    H    GLU  49           H        GLU  49 -14.348   0.924   6.281
  887    HA   GLU  49           HA       GLU  49 -15.384   0.308   8.905
  888   1HB   GLU  49          1HB       GLU  49 -15.956   2.065   6.741
  889   2HB   GLU  49          2HB       GLU  49 -17.421   1.147   6.907
  890   1HG   GLU  49          1HG       GLU  49 -16.076   2.660   9.189
  891   2HG   GLU  49          2HG       GLU  49 -17.385   3.292   8.203
  892    H    THR  50           H        THR  50 -15.565  -1.470   6.043
  893    HA   THR  50           HA       THR  50 -18.002  -2.997   6.790
  894    HB   THR  50           HB       THR  50 -16.241  -3.004   4.312
  895    HG1  THR  50           1HG      THR  50 -17.550  -1.254   4.352
  896   1HG2  THR  50          1HG2      THR  50 -17.056  -5.212   4.548
  897   2HG2  THR  50          2HG2      THR  50 -18.699  -4.617   4.940
  898   3HG2  THR  50          3HG2      THR  50 -18.001  -4.370   3.305
  899    H    ILE  51           H        ILE  51 -14.533  -3.308   6.581
  900    HA   ILE  51           HA       ILE  51 -14.385  -6.044   7.524
  901    HB   ILE  51           HB       ILE  51 -12.354  -3.788   7.455
  902   1HG1  ILE  51          1HG1      ILE  51 -12.317  -6.276   5.699
  903   2HG1  ILE  51          2HG1      ILE  51 -13.275  -4.891   5.233
  904   1HG2  ILE  51          1HG2      ILE  51 -11.713  -5.458   9.196
  905   2HG2  ILE  51          2HG2      ILE  51 -11.793  -6.742   7.987
  906   3HG2  ILE  51          3HG2      ILE  51 -10.587  -5.431   7.860
  907   1HD1  ILE  51          1HD1      ILE  51 -11.258  -3.434   5.301
  908   2HD1  ILE  51          2HD1      ILE  51 -10.265  -4.858   5.664
  909   3HD1  ILE  51          3HD1      ILE  51 -11.140  -4.747   4.129
  910    H    ASN  52           H        ASN  52 -14.690  -2.985   9.016
  911    HA   ASN  52           HA       ASN  52 -14.065  -3.723  11.714
  912   1HB   ASN  52          1HB       ASN  52 -14.289  -1.385  10.686
  913   2HB   ASN  52          2HB       ASN  52 -16.033  -1.556  10.873
  914   1HD2  ASN  52          2HD2      ASN  52 -14.336   0.465  12.099
  915   2HD2  ASN  52          1HD2      ASN  52 -14.445   0.203  13.833
  916    H    GLY  53           H        GLY  53 -15.304  -4.486  13.421
  917   1HA   GLY  53          1HA       GLY  53 -18.132  -5.169  13.272
  918   2HA   GLY  53          2HA       GLY  53 -17.078  -6.567  13.042
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1   5.551  21.481  -3.022
    2   2H    MET   1          2H        MET   1   6.962  22.243  -2.698
    3   3H    MET   1          3H        MET   1   5.973  22.808  -3.872
    4    HA   MET   1           HA       MET   1   6.293  20.847  -5.212
    5   1HB   MET   1          1HB       MET   1   8.860  22.269  -4.401
    6   2HB   MET   1          2HB       MET   1   8.767  21.076  -5.704
    7   1HG   MET   1          1HG       MET   1   7.047  22.440  -6.848
    8   2HG   MET   1          2HG       MET   1   7.197  23.678  -5.593
    9   1HE   MET   1          1HE       MET   1   8.811  25.291  -8.813
   10   2HE   MET   1          2HE       MET   1   7.463  24.132  -8.774
   11   3HE   MET   1          3HE       MET   1   7.543  25.446  -7.575
   12    H    ASP   2           H        ASP   2   8.976  20.625  -2.797
   13    HA   ASP   2           HA       ASP   2   9.125  17.766  -3.006
   14   1HB   ASP   2          1HB       ASP   2  11.065  19.162  -2.545
   15   2HB   ASP   2          2HB       ASP   2  10.340  19.738  -1.042
   16    H    TYR   3           H        TYR   3   6.907  17.212  -2.590
   17    HA   TYR   3           HA       TYR   3   6.380  16.638   0.266
   18   1HB   TYR   3          1HB       TYR   3   5.413  18.929  -0.605
   19   2HB   TYR   3          2HB       TYR   3   4.290  17.980  -1.544
   20    HD1  TYR   3           1HD      TYR   3   4.604  16.167   1.509
   21    HD2  TYR   3           2HD      TYR   3   3.039  19.857  -0.099
   22    HE1  TYR   3           1HE      TYR   3   3.091  16.370   3.442
   23    HE2  TYR   3           2HE      TYR   3   1.533  20.060   1.876
   24    HH   TYR   3           HH       TYR   3   1.524  17.654   4.519
   25    H    LEU   4           H        LEU   4   7.231  14.785  -1.321
   26    HA   LEU   4           HA       LEU   4   4.900  13.100  -2.044
   27   1HB   LEU   4          1HB       LEU   4   5.990  12.306  -4.039
   28   2HB   LEU   4          2HB       LEU   4   5.823  14.048  -4.072
   29    HG   LEU   4           HG       LEU   4   8.348  13.772  -2.972
   30   1HD1  LEU   4          1HD1      LEU   4   8.314  11.296  -3.419
   31   2HD1  LEU   4          2HD1      LEU   4   8.102  11.645  -5.139
   32   3HD1  LEU   4          3HD1      LEU   4   9.587  12.154  -4.292
   33   1HD2  LEU   4          1HD2      LEU   4   7.733  13.986  -5.928
   34   2HD2  LEU   4          2HD2      LEU   4   7.744  15.327  -4.763
   35   3HD2  LEU   4          3HD2      LEU   4   9.241  14.456  -5.120
   36    H    ARG   5           H        ARG   5   8.394  12.947  -1.307
   37    HA   ARG   5           HA       ARG   5   8.526  10.222  -0.541
   38   1HB   ARG   5          1HB       ARG   5  10.330  12.043  -1.053
   39   2HB   ARG   5          2HB       ARG   5  10.200  12.469   0.654
   40   1HG   ARG   5          1HG       ARG   5  10.895  10.145   1.258
   41   2HG   ARG   5          2HG       ARG   5  10.932   9.725  -0.470
   42   1HD   ARG   5          1HD       ARG   5  12.595  11.620  -0.803
   43   2HD   ARG   5          2HD       ARG   5  12.685  11.790   0.945
   44    HE   ARG   5           HE       ARG   5  13.753   9.609  -0.750
   45   1HH1  ARG   5          1HH2      ARG   5  13.260  10.626   2.570
   46   2HH1  ARG   5          2HH2      ARG   5  14.501   9.558   3.167
   47   1HH2  ARG   5          1HH1      ARG   5  15.317   8.295   0.075
   48   2HH2  ARG   5          2HH1      ARG   5  15.627   8.269   1.785
   49    H    GLU   6           H        GLU   6   7.597  13.061   1.254
   50    HA   GLU   6           HA       GLU   6   7.332  12.062   3.889
   51   1HB   GLU   6          1HB       GLU   6   7.202  14.476   3.061
   52   2HB   GLU   6          2HB       GLU   6   5.632  14.123   2.387
   53   1HG   GLU   6          1HG       GLU   6   5.182  15.185   4.431
   54   2HG   GLU   6          2HG       GLU   6   4.874  13.490   4.774
   55    H    LEU   7           H        LEU   7   4.797  12.307   1.365
   56    HA   LEU   7           HA       LEU   7   2.798  10.863   2.803
   57   1HB   LEU   7          1HB       LEU   7   3.135  11.708  -0.113
   58   2HB   LEU   7          2HB       LEU   7   1.785  10.714   0.423
   59    HG   LEU   7           HG       LEU   7   1.302  12.456   2.193
   60   1HD1  LEU   7          1HD1      LEU   7   3.254  13.823   2.266
   61   2HD1  LEU   7          2HD1      LEU   7   3.187  14.112   0.506
   62   3HD1  LEU   7          3HD1      LEU   7   1.961  14.802   1.585
   63   1HD2  LEU   7          1HD2      LEU   7   1.025  13.232  -0.735
   64   2HD2  LEU   7          2HD2      LEU   7  -0.067  12.185   0.204
   65   3HD2  LEU   7          3HD2      LEU   7   0.059  13.898   0.604
   66    H    TYR   8           H        TYR   8   4.998   9.806   0.204
   67    HA   TYR   8           HA       TYR   8   4.218   7.192  -0.333
   68   1HB   TYR   8          1HB       TYR   8   6.357   8.825  -0.889
   69   2HB   TYR   8          2HB       TYR   8   7.149   7.850   0.278
   70    HD1  TYR   8           1HD      TYR   8   6.985   8.389  -3.030
   71    HD2  TYR   8           2HD      TYR   8   6.699   5.097  -0.257
   72    HE1  TYR   8           1HE      TYR   8   7.804   6.830  -4.793
   73    HE2  TYR   8           2HE      TYR   8   7.547   3.557  -2.012
   74    HH   TYR   8           HH       TYR   8   8.328   3.347  -4.153
   75    H    LYS   9           H        LYS   9   6.094   8.296   2.460
   76    HA   LYS   9           HA       LYS   9   6.631   5.695   3.491
   77   1HB   LYS   9          1HB       LYS   9   7.794   7.952   4.040
   78   2HB   LYS   9          2HB       LYS   9   6.423   8.327   5.072
   79   1HG   LYS   9          1HG       LYS   9   6.955   6.220   6.409
   80   2HG   LYS   9          2HG       LYS   9   8.391   6.015   5.384
   81   1HD   LYS   9          1HD       LYS   9   9.126   8.354   6.110
   82   2HD   LYS   9          2HD       LYS   9   7.740   8.377   7.204
   83   1HE   LYS   9          1HE       LYS   9   9.541   7.752   8.570
   84   2HE   LYS   9          2HE       LYS   9   8.667   6.249   8.271
   85   1HZ   LYS   9          1HZ       LYS   9  10.347   5.721   6.557
   86   2HZ   LYS   9          2HZ       LYS   9  11.134   7.126   6.850
   87   3HZ   LYS   9          3HZ       LYS   9  11.071   5.971   7.997
   88    H    LEU  10           H        LEU  10   4.141   7.924   4.792
   89    HA   LEU  10           HA       LEU  10   2.875   5.917   6.273
   90   1HB   LEU  10          1HB       LEU  10   1.770   8.533   5.183
   91   2HB   LEU  10          2HB       LEU  10   0.931   7.467   6.308
   92    HG   LEU  10           HG       LEU  10   3.267   7.640   7.644
   93   1HD1  LEU  10          1HD1      LEU  10   4.509   9.112   6.267
   94   2HD1  LEU  10          2HD1      LEU  10   3.153  10.226   6.088
   95   3HD1  LEU  10          3HD1      LEU  10   3.987  10.064   7.648
   96   1HD2  LEU  10          1HD2      LEU  10   1.039   9.715   7.743
   97   2HD2  LEU  10          2HD2      LEU  10   1.062   8.145   8.574
   98   3HD2  LEU  10          3HD2      LEU  10   2.216   9.398   9.039
   99    H    GLU  11           H        GLU  11   2.418   6.843   2.880
  100    HA   GLU  11           HA       GLU  11   0.300   5.051   2.195
  101   1HB   GLU  11          1HB       GLU  11   2.526   6.508   0.859
  102   2HB   GLU  11          2HB       GLU  11   2.020   5.170  -0.050
  103   1HG   GLU  11          1HG       GLU  11   0.143   7.353   1.010
  104   2HG   GLU  11          2HG       GLU  11   0.942   7.416  -0.554
  105    H    GLN  12           H        GLN  12   3.911   4.357   2.512
  106    HA   GLN  12           HA       GLN  12   3.337   1.588   1.994
  107   1HB   GLN  12          1HB       GLN  12   5.805   3.156   2.707
  108   2HB   GLN  12          2HB       GLN  12   5.795   1.381   2.694
  109   1HG   GLN  12          1HG       GLN  12   4.829   1.416   0.407
  110   2HG   GLN  12          2HG       GLN  12   5.021   3.155   0.355
  111   1HE2  GLN  12          2HE2      GLN  12   6.430   0.567  -0.970
  112   2HE2  GLN  12          1HE2      GLN  12   8.126   1.012  -0.852
  113    H    GLN  13           H        GLN  13   3.353   3.419   4.926
  114    HA   GLN  13           HA       GLN  13   3.750   1.125   6.670
  115   1HB   GLN  13          1HB       GLN  13   2.349   3.810   7.098
  116   2HB   GLN  13          2HB       GLN  13   2.556   2.633   8.385
  117   1HG   GLN  13          1HG       GLN  13   4.990   3.671   6.898
  118   2HG   GLN  13          2HG       GLN  13   4.225   4.612   8.171
  119   1HE2  GLN  13          2HE2      GLN  13   5.471   4.412  10.014
  120   2HE2  GLN  13          1HE2      GLN  13   6.118   2.883  10.589
  121    H    ALA  14           H        ALA  14   0.821   2.446   5.084
  122    HA   ALA  14           HA       ALA  14  -0.933   0.461   6.391
  123   1HB   ALA  14          1HB       ALA  14  -1.840   2.597   5.528
  124   2HB   ALA  14          2HB       ALA  14  -1.263   2.211   3.890
  125   3HB   ALA  14          3HB       ALA  14  -2.531   1.220   4.643
  126    H    MET  15           H        MET  15   0.777   0.705   3.211
  127    HA   MET  15           HA       MET  15   0.018  -1.825   2.167
  128   1HB   MET  15          1HB       MET  15   2.619  -0.258   2.014
  129   2HB   MET  15          2HB       MET  15   2.497  -1.778   1.227
  130   1HG   MET  15          1HG       MET  15   0.675   0.591   0.672
  131   2HG   MET  15          2HG       MET  15   2.080   0.127  -0.282
  132   1HE   MET  15          1HE       MET  15   2.302  -2.547  -0.978
  133   2HE   MET  15          2HE       MET  15   1.216  -3.361   0.179
  134   3HE   MET  15          3HE       MET  15   0.899  -3.471  -1.566
  135    H    LYS  16           H        LYS  16   2.850  -1.159   4.420
  136    HA   LYS  16           HA       LYS  16   3.659  -3.941   4.508
  137   1HB   LYS  16          1HB       LYS  16   4.363  -1.409   5.951
  138   2HB   LYS  16          2HB       LYS  16   4.667  -2.924   6.801
  139   1HG   LYS  16          1HG       LYS  16   5.925  -3.810   4.853
  140   2HG   LYS  16          2HG       LYS  16   5.725  -2.257   4.017
  141   1HD   LYS  16          1HD       LYS  16   7.023  -1.115   5.731
  142   2HD   LYS  16          2HD       LYS  16   7.064  -2.583   6.738
  143   1HE   LYS  16          1HE       LYS  16   8.326  -3.778   4.976
  144   2HE   LYS  16          2HE       LYS  16   8.306  -2.331   3.961
  145   1HZ   LYS  16          1HZ       LYS  16   9.612  -1.190   5.670
  146   2HZ   LYS  16          2HZ       LYS  16   9.605  -2.513   6.632
  147   3HZ   LYS  16          3HZ       LYS  16  10.392  -2.546   5.204
  148    H    LEU  17           H        LEU  17   1.444  -1.998   6.471
  149    HA   LEU  17           HA       LEU  17   0.858  -4.097   8.360
  150   1HB   LEU  17          1HB       LEU  17  -0.287  -1.481   7.477
  151   2HB   LEU  17          2HB       LEU  17  -1.456  -2.560   8.101
  152    HG   LEU  17           HG       LEU  17   1.104  -1.719   9.545
  153   1HD1  LEU  17          1HD1      LEU  17  -0.397  -0.410  10.961
  154   2HD1  LEU  17          2HD1      LEU  17  -0.578   0.074   9.263
  155   3HD1  LEU  17          3HD1      LEU  17  -1.804  -0.959  10.025
  156   1HD2  LEU  17          1HD2      LEU  17  -1.258  -3.364  10.570
  157   2HD2  LEU  17          2HD2      LEU  17   0.411  -3.934  10.393
  158   3HD2  LEU  17          3HD2      LEU  17   0.039  -2.694  11.577
  159    H    TYR  18           H        TYR  18  -0.631  -3.206   5.227
  160    HA   TYR  18           HA       TYR  18  -2.503  -5.298   5.072
  161   1HB   TYR  18          1HB       TYR  18  -1.176  -3.386   3.188
  162   2HB   TYR  18          2HB       TYR  18  -1.927  -4.745   2.456
  163    HD1  TYR  18           1HD      TYR  18  -4.368  -5.240   3.873
  164    HD2  TYR  18           2HD      TYR  18  -2.563  -1.461   2.872
  165    HE1  TYR  18           1HE      TYR  18  -6.593  -4.211   3.836
  166    HE2  TYR  18           2HE      TYR  18  -4.854  -0.377   2.924
  167    HH   TYR  18           HH       TYR  18  -7.023  -0.654   3.416
  168    H    ARG  19           H        ARG  19   0.927  -5.370   4.095
  169    HA   ARG  19           HA       ARG  19   1.039  -7.987   2.992
  170   1HB   ARG  19          1HB       ARG  19   2.785  -6.316   2.747
  171   2HB   ARG  19          2HB       ARG  19   3.117  -6.333   4.477
  172   1HG   ARG  19          1HG       ARG  19   4.041  -8.559   4.377
  173   2HG   ARG  19          2HG       ARG  19   3.556  -8.745   2.677
  174   1HD   ARG  19          1HD       ARG  19   5.120  -7.005   1.985
  175   2HD   ARG  19          2HD       ARG  19   5.425  -6.549   3.658
  176    HE   ARG  19           HE       ARG  19   6.945  -8.247   3.898
  177   1HH1  ARG  19          1HH2      ARG  19   5.208  -8.968   0.933
  178   2HH1  ARG  19          2HH2      ARG  19   6.337 -10.218   0.485
  179   1HH2  ARG  19          1HH1      ARG  19   8.342  -9.827   3.246
  180   2HH2  ARG  19          2HH1      ARG  19   8.060 -10.681   1.759
  181    H    GLU  20           H        GLU  20   0.741  -7.129   6.351
  182    HA   GLU  20           HA       GLU  20   1.436  -9.915   7.243
  183   1HB   GLU  20          1HB       GLU  20   2.483  -7.583   7.995
  184   2HB   GLU  20          2HB       GLU  20   1.106  -7.496   9.044
  185   1HG   GLU  20          1HG       GLU  20   2.861  -9.986   9.024
  186   2HG   GLU  20          2HG       GLU  20   3.403  -8.534   9.850
  187    H    ALA  21           H        ALA  21  -0.962  -7.374   7.543
  188    HA   ALA  21           HA       ALA  21  -3.075  -8.648   8.900
  189   1HB   ALA  21          1HB       ALA  21  -3.084  -6.317   8.177
  190   2HB   ALA  21          2HB       ALA  21  -3.170  -6.831   6.475
  191   3HB   ALA  21          3HB       ALA  21  -4.519  -7.164   7.565
  192    H    SER  22           H        SER  22  -1.984  -9.140   5.524
  193    HA   SER  22           HA       SER  22  -3.998 -10.909   4.621
  194   1HB   SER  22          1HB       SER  22  -2.125  -9.927   3.272
  195   2HB   SER  22          2HB       SER  22  -1.014 -11.072   4.043
  196    HG   SER  22           HG       SER  22  -1.837 -11.818   2.010
  197    H    GLU  23           H        GLU  23  -1.129 -11.652   6.675
  198    HA   GLU  23           HA       GLU  23  -1.672 -14.526   6.721
  199   1HB   GLU  23          1HB       GLU  23   0.571 -13.210   7.035
  200   2HB   GLU  23          2HB       GLU  23   0.066 -13.090   8.718
  201   1HG   GLU  23          1HG       GLU  23  -0.139 -15.548   8.866
  202   2HG   GLU  23          2HG       GLU  23   0.238 -15.709   7.152
  203    H    LYS  24           H        LYS  24  -2.247 -11.780   8.872
  204    HA   LYS  24           HA       LYS  24  -3.565 -13.206  11.020
  205   1HB   LYS  24          1HB       LYS  24  -3.582 -10.352  10.040
  206   2HB   LYS  24          2HB       LYS  24  -4.680 -10.843  11.325
  207   1HG   LYS  24          1HG       LYS  24  -3.003 -11.312  12.843
  208   2HG   LYS  24          2HG       LYS  24  -1.764 -11.581  11.608
  209   1HD   LYS  24          1HD       LYS  24  -1.448  -9.293  11.199
  210   2HD   LYS  24          2HD       LYS  24  -2.954  -8.827  12.000
  211   1HE   LYS  24          1HE       LYS  24  -2.099  -9.394  14.183
  212   2HE   LYS  24          2HE       LYS  24  -0.654 -10.145  13.481
  213   1HZ   LYS  24          1HZ       LYS  24   0.067  -8.020  12.700
  214   2HZ   LYS  24          2HZ       LYS  24  -1.287  -7.255  13.261
  215   3HZ   LYS  24          3HZ       LYS  24  -0.212  -7.900  14.310
  216    H    ALA  25           H        ALA  25  -4.898 -11.907   7.977
  217    HA   ALA  25           HA       ALA  25  -7.620 -12.750   8.491
  218   1HB   ALA  25          1HB       ALA  25  -7.071 -11.011   6.838
  219   2HB   ALA  25          2HB       ALA  25  -6.137 -12.173   5.881
  220   3HB   ALA  25          3HB       ALA  25  -7.887 -12.381   6.063
  221    H    ARG  26           H        ARG  26  -5.178 -14.143   6.302
  222    HA   ARG  26           HA       ARG  26  -5.131 -16.076   5.133
  223   1HB   ARG  26          1HB       ARG  26  -4.405 -16.487   7.719
  224   2HB   ARG  26          2HB       ARG  26  -5.691 -17.664   7.620
  225   1HG   ARG  26          1HG       ARG  26  -3.646 -18.780   7.130
  226   2HG   ARG  26          2HG       ARG  26  -4.483 -18.642   5.576
  227   1HD   ARG  26          1HD       ARG  26  -3.079 -16.717   4.962
  228   2HD   ARG  26          2HD       ARG  26  -2.345 -16.708   6.578
  229    HE   ARG  26           HE       ARG  26  -1.831 -19.253   5.609
  230   1HH1  ARG  26          1HH2      ARG  26  -1.042 -16.045   4.425
  231   2HH1  ARG  26          2HH2      ARG  26   0.469 -16.576   3.741
  232   1HH2  ARG  26          1HH1      ARG  26   0.101 -19.856   4.694
  233   2HH2  ARG  26          2HH1      ARG  26   1.085 -18.678   3.878
  234    H    ASN  27           H        ASN  27  -7.896 -14.991   5.374
  235    HA   ASN  27           HA       ASN  27  -9.472 -17.460   4.761
  236   1HB   ASN  27          1HB       ASN  27  -9.905 -16.223   6.965
  237   2HB   ASN  27          2HB       ASN  27 -10.482 -14.866   6.004
  238   1HD2  ASN  27          2HD2      ASN  27 -12.732 -14.883   5.878
  239   2HD2  ASN  27          1HD2      ASN  27 -13.690 -16.351   5.865
  240    HA   PRO  28           HA       PRO  28  -9.425 -15.801   0.812
  241   1HB   PRO  28          1HB       PRO  28 -11.453 -17.088  -0.528
  242   2HB   PRO  28          2HB       PRO  28  -9.962 -17.888   0.052
  243   1HG   PRO  28          1HG       PRO  28 -12.664 -17.773   1.423
  244   2HG   PRO  28          2HG       PRO  28 -11.628 -19.210   1.136
  245   1HD   PRO  28          1HD       PRO  28 -11.619 -17.912   3.503
  246   2HD   PRO  28          2HD       PRO  28 -10.092 -18.546   2.813
  247    H    GLU  29           H        GLU  29 -12.477 -15.252   2.494
  248    HA   GLU  29           HA       GLU  29 -13.615 -13.424   0.578
  249   1HB   GLU  29          1HB       GLU  29 -14.746 -14.544   2.608
  250   2HB   GLU  29          2HB       GLU  29 -13.976 -13.318   3.595
  251   1HG   GLU  29          1HG       GLU  29 -16.176 -12.538   3.163
  252   2HG   GLU  29          2HG       GLU  29 -15.114 -11.545   2.175
  253    H    LYS  30           H        LYS  30 -11.702 -12.896   3.467
  254    HA   LYS  30           HA       LYS  30 -11.203 -10.066   3.110
  255   1HB   LYS  30          1HB       LYS  30  -9.766 -12.188   4.742
  256   2HB   LYS  30          2HB       LYS  30  -9.165 -10.540   4.588
  257   1HG   LYS  30          1HG       LYS  30 -10.341 -10.312   6.506
  258   2HG   LYS  30          2HG       LYS  30 -11.560  -9.798   5.345
  259   1HD   LYS  30          1HD       LYS  30 -12.517 -12.143   5.428
  260   2HD   LYS  30          2HD       LYS  30 -11.344 -12.538   6.691
  261   1HE   LYS  30          1HE       LYS  30 -13.503 -10.379   6.836
  262   2HE   LYS  30          2HE       LYS  30 -13.615 -11.986   7.553
  263   1HZ   LYS  30          1HZ       LYS  30 -11.665 -11.400   8.950
  264   2HZ   LYS  30          2HZ       LYS  30 -11.679  -9.879   8.347
  265   3HZ   LYS  30          3HZ       LYS  30 -12.939 -10.420   9.224
  266    H    LYS  31           H        LYS  31  -9.354 -12.958   2.152
  267    HA   LYS  31           HA       LYS  31  -7.316 -11.518   0.759
  268   1HB   LYS  31          1HB       LYS  31  -7.730 -14.155   1.550
  269   2HB   LYS  31          2HB       LYS  31  -7.751 -14.263  -0.214
  270   1HG   LYS  31          1HG       LYS  31  -5.557 -13.091  -0.300
  271   2HG   LYS  31          2HG       LYS  31  -5.625 -12.822   1.447
  272   1HD   LYS  31          1HD       LYS  31  -4.171 -14.626   1.166
  273   2HD   LYS  31          2HD       LYS  31  -5.683 -15.326   1.773
  274   1HE   LYS  31          1HE       LYS  31  -6.298 -16.036  -0.512
  275   2HE   LYS  31          2HE       LYS  31  -4.878 -15.221  -1.178
  276   1HZ   LYS  31          1HZ       LYS  31  -3.472 -16.772   0.058
  277   2HZ   LYS  31          2HZ       LYS  31  -4.776 -17.529   0.694
  278   3HZ   LYS  31          3HZ       LYS  31  -4.486 -17.602  -0.910
  279    H    SER  32           H        SER  32 -10.451 -11.597  -0.211
  280    HA   SER  32           HA       SER  32  -9.585 -10.591  -2.887
  281   1HB   SER  32          1HB       SER  32 -12.149 -12.099  -2.218
  282   2HB   SER  32          2HB       SER  32 -11.842 -11.262  -3.753
  283    HG   SER  32           HG       SER  32 -11.335 -13.508  -3.848
  284    H    VAL  33           H        VAL  33 -10.034  -9.409  -0.155
  285    HA   VAL  33           HA       VAL  33 -11.720  -7.071  -0.982
  286    HB   VAL  33           HB       VAL  33 -11.535  -8.635   1.565
  287   1HG1  VAL  33          1HG1      VAL  33 -10.780  -6.462   2.403
  288   2HG1  VAL  33          2HG1      VAL  33 -12.172  -5.677   1.615
  289   3HG1  VAL  33          3HG1      VAL  33 -12.391  -6.865   2.936
  290   1HG2  VAL  33          1HG2      VAL  33 -13.801  -7.089   0.258
  291   2HG2  VAL  33          2HG2      VAL  33 -13.470  -8.821   0.027
  292   3HG2  VAL  33          3HG2      VAL  33 -13.927  -8.219   1.626
  293    H    LEU  34           H        LEU  34  -8.893  -8.007   1.189
  294    HA   LEU  34           HA       LEU  34  -7.828  -5.326   0.977
  295   1HB   LEU  34          1HB       LEU  34  -6.324  -5.939   2.468
  296   2HB   LEU  34          2HB       LEU  34  -7.524  -7.154   2.865
  297    HG   LEU  34           HG       LEU  34  -5.158  -7.461   1.071
  298   1HD1  LEU  34          1HD1      LEU  34  -4.185  -7.200   3.201
  299   2HD1  LEU  34          2HD1      LEU  34  -5.430  -8.205   3.992
  300   3HD1  LEU  34          3HD1      LEU  34  -4.190  -8.926   2.941
  301   1HD2  LEU  34          1HD2      LEU  34  -6.792  -9.687   2.336
  302   2HD2  LEU  34          2HD2      LEU  34  -6.913  -9.192   0.631
  303   3HD2  LEU  34          3HD2      LEU  34  -5.416  -9.896   1.230
  304    H    GLN  35           H        GLN  35  -7.749  -8.118  -1.091
  305    HA   GLN  35           HA       GLN  35  -5.375  -7.529  -2.541
  306   1HB   GLN  35          1HB       GLN  35  -7.231  -9.568  -2.489
  307   2HB   GLN  35          2HB       GLN  35  -7.658  -8.782  -3.998
  308   1HG   GLN  35          1HG       GLN  35  -6.089 -10.456  -4.556
  309   2HG   GLN  35          2HG       GLN  35  -5.178  -8.952  -4.649
  310   1HE2  GLN  35          2HE2      GLN  35  -3.814 -11.388  -4.426
  311   2HE2  GLN  35          1HE2      GLN  35  -3.112 -11.492  -2.817
  312    H    LYS  36           H        LYS  36  -8.671  -6.261  -2.823
  313    HA   LYS  36           HA       LYS  36  -8.263  -4.955  -5.409
  314   1HB   LYS  36          1HB       LYS  36 -10.357  -4.560  -3.198
  315   2HB   LYS  36          2HB       LYS  36 -10.450  -3.823  -4.799
  316   1HG   LYS  36          1HG       LYS  36 -10.743  -5.943  -5.884
  317   2HG   LYS  36          2HG       LYS  36 -10.346  -6.845  -4.410
  318   1HD   LYS  36          1HD       LYS  36 -12.337  -5.989  -3.279
  319   2HD   LYS  36          2HD       LYS  36 -12.777  -5.028  -4.709
  320   1HE   LYS  36          1HE       LYS  36 -13.109  -7.011  -6.046
  321   2HE   LYS  36          2HE       LYS  36 -12.371  -8.044  -4.813
  322   1HZ   LYS  36          1HZ       LYS  36 -14.220  -7.603  -3.354
  323   2HZ   LYS  36          2HZ       LYS  36 -14.919  -6.572  -4.423
  324   3HZ   LYS  36          3HZ       LYS  36 -14.804  -8.165  -4.768
  325    H    ILE  37           H        ILE  37  -8.160  -3.887  -2.025
  326    HA   ILE  37           HA       ILE  37  -7.195  -1.180  -2.582
  327    HB   ILE  37           HB       ILE  37  -6.934  -3.128  -0.278
  328   1HG1  ILE  37          1HG1      ILE  37  -8.081  -0.621   0.541
  329   2HG1  ILE  37          2HG1      ILE  37  -8.950  -1.208  -0.852
  330   1HG2  ILE  37          1HG2      ILE  37  -4.878  -1.911  -0.093
  331   2HG2  ILE  37          2HG2      ILE  37  -5.655  -0.383  -0.580
  332   3HG2  ILE  37          3HG2      ILE  37  -5.983  -1.083   0.999
  333   1HD1  ILE  37          1HD1      ILE  37  -9.446  -3.307   0.271
  334   2HD1  ILE  37          2HD1      ILE  37  -8.364  -2.898   1.617
  335   3HD1  ILE  37          3HD1      ILE  37  -9.856  -1.974   1.369
  336    H    LEU  38           H        LEU  38  -5.361  -4.299  -1.924
  337    HA   LEU  38           HA       LEU  38  -2.855  -3.134  -2.342
  338   1HB   LEU  38          1HB       LEU  38  -3.867  -5.949  -2.779
  339   2HB   LEU  38          2HB       LEU  38  -2.186  -5.539  -3.065
  340    HG   LEU  38           HG       LEU  38  -3.543  -5.002  -0.383
  341   1HD1  LEU  38          1HD1      LEU  38  -3.564  -7.430  -0.870
  342   2HD1  LEU  38          2HD1      LEU  38  -1.822  -7.375  -1.218
  343   3HD1  LEU  38          3HD1      LEU  38  -2.423  -7.031   0.421
  344   1HD2  LEU  38          1HD2      LEU  38  -0.643  -5.117  -1.295
  345   2HD2  LEU  38          2HD2      LEU  38  -1.533  -3.687  -0.712
  346   3HD2  LEU  38          3HD2      LEU  38  -1.155  -5.006   0.395
  347    H    GLU  39           H        GLU  39  -5.019  -4.382  -4.958
  348    HA   GLU  39           HA       GLU  39  -3.126  -3.857  -7.051
  349   1HB   GLU  39          1HB       GLU  39  -5.832  -4.811  -6.836
  350   2HB   GLU  39          2HB       GLU  39  -5.866  -3.445  -7.943
  351   1HG   GLU  39          1HG       GLU  39  -4.043  -4.475  -9.276
  352   2HG   GLU  39          2HG       GLU  39  -3.979  -5.830  -8.145
  353    H    ASP  40           H        ASP  40  -5.295  -1.691  -5.325
  354    HA   ASP  40           HA       ASP  40  -4.855   0.621  -7.067
  355   1HB   ASP  40          1HB       ASP  40  -6.363  -0.105  -4.530
  356   2HB   ASP  40          2HB       ASP  40  -5.967   1.513  -4.751
  357    H    GLU  41           H        GLU  41  -3.217  -0.848  -4.260
  358    HA   GLU  41           HA       GLU  41  -2.345   1.819  -3.339
  359   1HB   GLU  41          1HB       GLU  41  -3.707   0.076  -2.072
  360   2HB   GLU  41          2HB       GLU  41  -2.251  -0.904  -1.992
  361   1HG   GLU  41          1HG       GLU  41  -2.709   0.170   0.055
  362   2HG   GLU  41          2HG       GLU  41  -1.298   1.015  -0.639
  363    H    GLU  42           H        GLU  42  -1.161  -1.176  -4.705
  364    HA   GLU  42           HA       GLU  42   1.602  -0.488  -5.088
  365   1HB   GLU  42          1HB       GLU  42   0.356  -2.677  -5.656
  366   2HB   GLU  42          2HB       GLU  42  -0.351  -1.831  -7.025
  367   1HG   GLU  42          1HG       GLU  42   2.025  -1.309  -7.812
  368   2HG   GLU  42          2HG       GLU  42   2.619  -2.305  -6.484
  369    H    LYS  43           H        LYS  43  -1.418   0.514  -6.727
  370    HA   LYS  43           HA       LYS  43  -0.222   1.733  -9.005
  371   1HB   LYS  43          1HB       LYS  43  -2.805   1.131  -8.260
  372   2HB   LYS  43          2HB       LYS  43  -2.812   2.870  -8.015
  373   1HG   LYS  43          1HG       LYS  43  -3.578   2.597 -10.186
  374   2HG   LYS  43          2HG       LYS  43  -1.881   3.040 -10.424
  375   1HD   LYS  43          1HD       LYS  43  -1.301   0.640 -10.729
  376   2HD   LYS  43          2HD       LYS  43  -2.983   0.181 -10.455
  377   1HE   LYS  43          1HE       LYS  43  -2.009   1.972 -12.731
  378   2HE   LYS  43          2HE       LYS  43  -2.271   0.232 -12.865
  379   1HZ   LYS  43          1HZ       LYS  43  -4.618   0.597 -12.312
  380   2HZ   LYS  43          2HZ       LYS  43  -4.392   2.215 -12.235
  381   3HZ   LYS  43          3HZ       LYS  43  -4.205   1.429 -13.650
  382    H    HIS  44           H        HIS  44  -1.185   3.249  -5.862
  383    HA   HIS  44           HA       HIS  44  -0.566   5.897  -6.515
  384   1HB   HIS  44          1HB       HIS  44  -0.484   4.291  -3.915
  385   2HB   HIS  44          2HB       HIS  44  -0.502   6.030  -4.065
  386    HD2  HIS  44           2HD      HIS  44  -2.839   5.321  -6.634
  387    HE1  HIS  44           1HE      HIS  44  -5.325   4.857  -3.236
  388    HE2  HIS  44           2HE      HIS  44  -5.266   5.022  -5.770
  389    H    ILE  45           H        ILE  45   1.515   3.271  -5.246
  390    HA   ILE  45           HA       ILE  45   3.854   4.924  -4.864
  391    HB   ILE  45           HB       ILE  45   3.174   2.008  -4.818
  392   1HG1  ILE  45          1HG1      ILE  45   4.656   2.114  -2.787
  393   2HG1  ILE  45          2HG1      ILE  45   4.938   3.821  -3.121
  394   1HG2  ILE  45          1HG2      ILE  45   5.041   1.819  -6.357
  395   2HG2  ILE  45          2HG2      ILE  45   6.044   2.866  -5.324
  396   3HG2  ILE  45          3HG2      ILE  45   5.527   1.264  -4.759
  397   1HD1  ILE  45          1HD1      ILE  45   2.522   4.283  -2.757
  398   2HD1  ILE  45          2HD1      ILE  45   2.251   2.547  -2.469
  399   3HD1  ILE  45          3HD1      ILE  45   3.258   3.486  -1.359
  400    H    GLU  46           H        GLU  46   2.693   3.093  -7.761
  401    HA   GLU  46           HA       GLU  46   4.967   3.710  -9.380
  402   1HB   GLU  46          1HB       GLU  46   2.049   3.118  -9.954
  403   2HB   GLU  46          2HB       GLU  46   3.135   3.581 -11.242
  404   1HG   GLU  46          1HG       GLU  46   3.685   1.242  -9.380
  405   2HG   GLU  46          2HG       GLU  46   2.788   1.098 -10.888
  406    H    TRP  47           H        TRP  47   1.968   5.608  -8.800
  407    HA   TRP  47           HA       TRP  47   2.666   7.721 -10.624
  408   1HB   TRP  47          1HB       TRP  47   0.831   7.772  -8.203
  409   2HB   TRP  47          2HB       TRP  47   0.840   8.889  -9.544
  410    HD1  TRP  47           1HD      TRP  47   1.015   5.969 -11.498
  411    HE1  TRP  47           1HE      TRP  47  -1.249   4.881 -11.997
  412    HE3  TRP  47           3HE      TRP  47  -1.791   8.366  -8.003
  413    HZ2  TRP  47           2HZ      TRP  47  -3.982   5.067 -11.006
  414    HZ3  TRP  47           3HZ      TRP  47  -4.227   7.901  -7.751
  415    HH2  TRP  47           2HH      TRP  47  -5.326   6.231  -9.248
  416    H    LEU  48           H        LEU  48   3.000   7.350  -7.089
  417    HA   LEU  48           HA       LEU  48   4.245   9.799  -6.408
  418   1HB   LEU  48          1HB       LEU  48   4.283   6.953  -5.387
  419   2HB   LEU  48          2HB       LEU  48   5.356   8.088  -4.659
  420    HG   LEU  48           HG       LEU  48   2.380   8.615  -4.864
  421   1HD1  LEU  48          1HD1      LEU  48   2.687   6.550  -3.586
  422   2HD1  LEU  48          2HD1      LEU  48   3.948   7.310  -2.599
  423   3HD1  LEU  48          3HD1      LEU  48   2.258   7.865  -2.486
  424   1HD2  LEU  48          1HD2      LEU  48   4.527   9.724  -2.987
  425   2HD2  LEU  48          2HD2      LEU  48   3.804  10.601  -4.354
  426   3HD2  LEU  48          3HD2      LEU  48   2.804  10.148  -2.968
  427    H    GLU  49           H        GLU  49   5.717   6.780  -7.620
  428    HA   GLU  49           HA       GLU  49   8.400   7.812  -7.696
  429   1HB   GLU  49          1HB       GLU  49   7.273   5.332  -8.162
  430   2HB   GLU  49          2HB       GLU  49   7.712   5.811  -9.788
  431   1HG   GLU  49          1HG       GLU  49  10.031   6.376  -8.939
  432   2HG   GLU  49          2HG       GLU  49   9.566   5.740  -7.363
  433    H    THR  50           H        THR  50   5.773   7.892 -10.225
  434    HA   THR  50           HA       THR  50   7.443   9.054 -12.238
  435    HB   THR  50           HB       THR  50   4.439   9.130 -11.749
  436    HG1  THR  50           1HG      THR  50   6.072   7.556 -13.464
  437   1HG2  THR  50          1HG2      THR  50   6.031   9.846 -14.223
  438   2HG2  THR  50          2HG2      THR  50   4.272   9.517 -14.192
  439   3HG2  THR  50          3HG2      THR  50   4.926  10.897 -13.294
  440    H    ILE  51           H        ILE  51   5.727  10.415  -9.533
  441    HA   ILE  51           HA       ILE  51   6.216  13.185 -10.341
  442    HB   ILE  51           HB       ILE  51   4.609  11.751  -8.272
  443   1HG1  ILE  51          1HG1      ILE  51   2.975  13.610  -8.874
  444   2HG1  ILE  51          2HG1      ILE  51   4.172  14.232 -10.007
  445   1HG2  ILE  51          1HG2      ILE  51   5.799  13.176  -6.744
  446   2HG2  ILE  51          2HG2      ILE  51   5.432  14.612  -7.753
  447   3HG2  ILE  51          3HG2      ILE  51   4.132  13.714  -6.927
  448   1HD1  ILE  51          1HD1      ILE  51   4.030  12.082 -11.275
  449   2HD1  ILE  51          2HD1      ILE  51   2.818  11.510 -10.096
  450   3HD1  ILE  51          3HD1      ILE  51   2.467  12.902 -11.137
  451    H    ASN  52           H        ASN  52   8.020  10.930  -8.676
  452    HA   ASN  52           HA       ASN  52   9.482  12.562  -6.844
  453   1HB   ASN  52          1HB       ASN  52   9.292   9.982  -7.063
  454   2HB   ASN  52          2HB       ASN  52  10.618  10.102  -8.216
  455   1HD2  ASN  52          2HD2      ASN  52  10.736   8.622  -5.786
  456   2HD2  ASN  52          1HD2      ASN  52  11.888   9.430  -4.734
  457    H    GLY  53           H        GLY  53  11.666  13.318  -6.927
  458   1HA   GLY  53          1HA       GLY  53  13.235  13.737  -9.273
  459   2HA   GLY  53          2HA       GLY  53  12.195  15.144  -9.038
  460   1H    MET   1          1H        MET   1  -6.047 -10.050  18.825
  461   2H    MET   1          2H        MET   1  -7.604 -10.377  18.459
  462   3H    MET   1          3H        MET   1  -6.436 -11.492  18.156
  463    HA   MET   1           HA       MET   1  -5.392 -10.023  16.557
  464   1HB   MET   1          1HB       MET   1  -6.977 -10.270  14.735
  465   2HB   MET   1          2HB       MET   1  -6.874 -11.729  15.704
  466   1HG   MET   1          1HG       MET   1  -9.014 -11.094  16.838
  467   2HG   MET   1          2HG       MET   1  -9.139  -9.693  15.764
  468   1HE   MET   1          1HE       MET   1 -11.143 -12.299  16.363
  469   2HE   MET   1          2HE       MET   1 -11.655 -10.854  15.459
  470   3HE   MET   1          3HE       MET   1 -11.873 -12.474  14.754
  471    H    ASP   2           H        ASP   2  -5.158  -8.050  15.621
  472    HA   ASP   2           HA       ASP   2  -6.750  -5.782  16.712
  473   1HB   ASP   2          1HB       ASP   2  -4.685  -4.857  17.636
  474   2HB   ASP   2          2HB       ASP   2  -5.073  -6.414  18.339
  475    H    TYR   3           H        TYR   3  -6.577  -6.668  13.940
  476    HA   TYR   3           HA       TYR   3  -4.653  -4.790  12.686
  477   1HB   TYR   3          1HB       TYR   3  -4.293  -6.375  11.017
  478   2HB   TYR   3          2HB       TYR   3  -4.259  -7.215  12.552
  479    HD1  TYR   3           1HD      TYR   3  -5.785  -7.036   9.280
  480    HD2  TYR   3           2HD      TYR   3  -6.244  -8.686  13.229
  481    HE1  TYR   3           1HE      TYR   3  -7.382  -8.703   8.383
  482    HE2  TYR   3           2HE      TYR   3  -7.886 -10.347  12.334
  483    HH   TYR   3           HH       TYR   3  -8.700 -10.482   8.849
  484    H    LEU   4           H        LEU   4  -7.173  -3.694  13.345
  485    HA   LEU   4           HA       LEU   4  -8.135  -3.072  10.615
  486   1HB   LEU   4          1HB       LEU   4 -10.470  -2.759  11.672
  487   2HB   LEU   4          2HB       LEU   4  -9.864  -4.320  11.162
  488    HG   LEU   4           HG       LEU   4  -9.306  -4.887  13.528
  489   1HD1  LEU   4          1HD1      LEU   4  -9.191  -2.806  14.712
  490   2HD1  LEU   4          2HD1      LEU   4 -10.807  -2.303  14.112
  491   3HD1  LEU   4          3HD1      LEU   4 -10.630  -3.616  15.290
  492   1HD2  LEU   4          1HD2      LEU   4 -12.207  -4.201  12.938
  493   2HD2  LEU   4          2HD2      LEU   4 -11.350  -5.673  12.418
  494   3HD2  LEU   4          3HD2      LEU   4 -11.630  -5.379  14.139
  495    H    ARG   5           H        ARG   5  -8.564  -1.491  13.860
  496    HA   ARG   5           HA       ARG   5  -8.564   1.138  12.707
  497   1HB   ARG   5          1HB       ARG   5  -8.041   0.050  15.480
  498   2HB   ARG   5          2HB       ARG   5  -7.458   1.671  15.101
  499   1HG   ARG   5          1HG       ARG   5  -9.755   2.279  14.276
  500   2HG   ARG   5          2HG       ARG   5 -10.343   0.732  14.919
  501   1HD   ARG   5          1HD       ARG   5  -9.639   1.377  17.181
  502   2HD   ARG   5          2HD       ARG   5  -8.839   2.818  16.563
  503    HE   ARG   5           HE       ARG   5 -10.953   3.815  16.011
  504   1HH1  ARG   5          1HH2      ARG   5 -11.340   0.979  18.038
  505   2HH1  ARG   5          2HH2      ARG   5 -12.914   1.488  18.588
  506   1HH2  ARG   5          1HH1      ARG   5 -12.948   4.390  16.746
  507   2HH2  ARG   5          2HH1      ARG   5 -13.795   3.367  17.868
  508    H    GLU   6           H        GLU   6  -5.854  -0.911  13.669
  509    HA   GLU   6           HA       GLU   6  -3.803   0.981  13.450
  510   1HB   GLU   6          1HB       GLU   6  -3.757  -1.416  14.348
  511   2HB   GLU   6          2HB       GLU   6  -3.530  -1.962  12.688
  512   1HG   GLU   6          1HG       GLU   6  -1.409  -0.858  12.526
  513   2HG   GLU   6          2HG       GLU   6  -1.733   0.168  13.919
  514    H    LEU   7           H        LEU   7  -5.121  -1.074  10.830
  515    HA   LEU   7           HA       LEU   7  -3.551   0.040   8.714
  516   1HB   LEU   7          1HB       LEU   7  -6.105  -1.621   8.959
  517   2HB   LEU   7          2HB       LEU   7  -5.544  -1.015   7.402
  518    HG   LEU   7           HG       LEU   7  -3.367  -2.064   7.763
  519   1HD1  LEU   7          1HD1      LEU   7  -3.100  -2.360  10.109
  520   2HD1  LEU   7          2HD1      LEU   7  -4.585  -3.325  10.218
  521   3HD1  LEU   7          3HD1      LEU   7  -3.150  -3.961   9.390
  522   1HD2  LEU   7          1HD2      LEU   7  -5.263  -3.143   6.511
  523   2HD2  LEU   7          2HD2      LEU   7  -4.086  -4.289   7.149
  524   3HD2  LEU   7          3HD2      LEU   7  -5.648  -4.065   7.978
  525    H    TYR   8           H        TYR   8  -6.982   0.553   9.578
  526    HA   TYR   8           HA       TYR   8  -7.738   2.477   7.662
  527   1HB   TYR   8          1HB       TYR   8  -8.883   1.129   9.722
  528   2HB   TYR   8          2HB       TYR   8  -8.619   2.581  10.600
  529    HD1  TYR   8           1HD      TYR   8 -11.140   0.848   9.499
  530    HD2  TYR   8           2HD      TYR   8  -9.467   4.758   8.751
  531    HE1  TYR   8           1HE      TYR   8 -13.389   1.699   8.896
  532    HE2  TYR   8           2HE      TYR   8 -11.725   5.591   8.139
  533    HH   TYR   8           HH       TYR   8 -14.628   3.525   8.230
  534    H    LYS   9           H        LYS   9  -6.355   3.092  10.907
  535    HA   LYS   9           HA       LYS   9  -6.536   5.918  10.629
  536   1HB   LYS   9          1HB       LYS   9  -6.178   4.464  12.785
  537   2HB   LYS   9          2HB       LYS   9  -4.463   4.550  12.393
  538   1HG   LYS   9          1HG       LYS   9  -4.896   6.259  13.981
  539   2HG   LYS   9          2HG       LYS   9  -4.719   7.112  12.441
  540   1HD   LYS   9          1HD       LYS   9  -7.188   7.292  12.247
  541   2HD   LYS   9          2HD       LYS   9  -7.385   6.310  13.714
  542   1HE   LYS   9          1HE       LYS   9  -6.140   8.055  15.006
  543   2HE   LYS   9          2HE       LYS   9  -6.049   9.047  13.546
  544   1HZ   LYS   9          1HZ       LYS   9  -8.501   9.095  13.527
  545   2HZ   LYS   9          2HZ       LYS   9  -8.565   8.192  14.888
  546   3HZ   LYS   9          3HZ       LYS   9  -7.933   9.695  14.936
  547    H    LEU  10           H        LEU  10  -3.672   3.886   9.951
  548    HA   LEU  10           HA       LEU  10  -2.172   6.077   8.974
  549   1HB   LEU  10          1HB       LEU  10  -1.917   3.095   8.895
  550   2HB   LEU  10          2HB       LEU  10  -0.945   4.015   7.746
  551    HG   LEU  10           HG       LEU  10  -0.982   4.742  10.699
  552   1HD1  LEU  10          1HD1      LEU  10  -0.278   2.460  10.641
  553   2HD1  LEU  10          2HD1      LEU  10   0.829   2.757   9.278
  554   3HD1  LEU  10          3HD1      LEU  10   1.159   3.460  10.881
  555   1HD2  LEU  10          1HD2      LEU  10   1.046   5.216   8.456
  556   2HD2  LEU  10          2HD2      LEU  10  -0.031   6.441   9.152
  557   3HD2  LEU  10          3HD2      LEU  10   1.234   5.726  10.148
  558    H    GLU  11           H        GLU  11  -4.318   3.766   7.307
  559    HA   GLU  11           HA       GLU  11  -4.221   4.842   4.682
  560   1HB   GLU  11          1HB       GLU  11  -6.058   3.260   6.385
  561   2HB   GLU  11          2HB       GLU  11  -6.941   4.084   5.218
  562   1HG   GLU  11          1HG       GLU  11  -4.550   2.241   4.682
  563   2HG   GLU  11          2HG       GLU  11  -6.218   1.729   4.690
  564    H    GLN  12           H        GLN  12  -5.988   6.172   7.592
  565    HA   GLN  12           HA       GLN  12  -6.826   8.421   6.035
  566   1HB   GLN  12          1HB       GLN  12  -7.060   7.674   8.941
  567   2HB   GLN  12          2HB       GLN  12  -7.556   9.261   8.329
  568   1HG   GLN  12          1HG       GLN  12  -8.977   8.156   6.623
  569   2HG   GLN  12          2HG       GLN  12  -8.587   6.599   7.326
  570   1HE2  GLN  12          2HE2      GLN  12 -11.173   8.460   7.157
  571   2HE2  GLN  12          1HE2      GLN  12 -11.770   8.368   8.806
  572    H    GLN  13           H        GLN  13  -4.026   7.950   8.070
  573    HA   GLN  13           HA       GLN  13  -3.393  10.793   8.237
  574   1HB   GLN  13          1HB       GLN  13  -1.553   8.367   8.452
  575   2HB   GLN  13          2HB       GLN  13  -1.060  10.049   8.686
  576   1HG   GLN  13          1HG       GLN  13  -3.001  10.159  10.439
  577   2HG   GLN  13          2HG       GLN  13  -2.892   8.402  10.436
  578   1HE2  GLN  13          2HE2      GLN  13  -1.796  11.090  12.064
  579   2HE2  GLN  13          1HE2      GLN  13  -0.290  10.420  12.676
  580    H    ALA  14           H        ALA  14  -2.712   8.323   5.737
  581    HA   ALA  14           HA       ALA  14  -1.201  10.192   4.052
  582   1HB   ALA  14          1HB       ALA  14  -1.050   7.720   3.796
  583   2HB   ALA  14          2HB       ALA  14  -2.780   7.647   3.390
  584   3HB   ALA  14          3HB       ALA  14  -1.644   8.488   2.311
  585    H    MET  15           H        MET  15  -4.656   9.322   4.426
  586    HA   MET  15           HA       MET  15  -5.633  10.942   2.227
  587   1HB   MET  15          1HB       MET  15  -7.024  10.177   4.835
  588   2HB   MET  15          2HB       MET  15  -7.814  11.005   3.529
  589   1HG   MET  15          1HG       MET  15  -6.484   8.506   2.666
  590   2HG   MET  15          2HG       MET  15  -7.741   8.286   3.882
  591   1HE   MET  15          1HE       MET  15  -7.698  11.125   1.013
  592   2HE   MET  15          2HE       MET  15  -6.829   9.690   0.407
  593   3HE   MET  15          3HE       MET  15  -8.404  10.129  -0.279
  594    H    LYS  16           H        LYS  16  -5.052  11.787   5.640
  595    HA   LYS  16           HA       LYS  16  -6.044  14.469   5.385
  596   1HB   LYS  16          1HB       LYS  16  -5.386  12.819   7.430
  597   2HB   LYS  16          2HB       LYS  16  -3.971  13.858   7.437
  598   1HG   LYS  16          1HG       LYS  16  -5.188  15.720   8.118
  599   2HG   LYS  16          2HG       LYS  16  -6.638  15.270   7.229
  600   1HD   LYS  16          1HD       LYS  16  -5.756  13.905   9.788
  601   2HD   LYS  16          2HD       LYS  16  -6.933  15.233   9.677
  602   1HE   LYS  16          1HE       LYS  16  -8.347  13.835   8.160
  603   2HE   LYS  16          2HE       LYS  16  -7.222  12.488   8.369
  604   1HZ   LYS  16          1HZ       LYS  16  -7.737  12.532  10.763
  605   2HZ   LYS  16          2HZ       LYS  16  -8.790  13.763  10.550
  606   3HZ   LYS  16          3HZ       LYS  16  -9.100  12.306   9.890
  607    H    LEU  17           H        LEU  17  -2.809  13.095   5.142
  608    HA   LEU  17           HA       LEU  17  -1.406  15.496   4.465
  609   1HB   LEU  17          1HB       LEU  17  -1.031  12.553   4.313
  610   2HB   LEU  17          2HB       LEU  17  -0.207  13.373   3.047
  611    HG   LEU  17           HG       LEU  17   0.051  14.124   5.999
  612   1HD1  LEU  17          1HD1      LEU  17   0.859  11.840   5.523
  613   2HD1  LEU  17          2HD1      LEU  17   1.916  12.477   4.243
  614   3HD1  LEU  17          3HD1      LEU  17   2.186  12.936   5.944
  615   1HD2  LEU  17          1HD2      LEU  17   1.767  14.857   3.581
  616   2HD2  LEU  17          2HD2      LEU  17   0.706  15.972   4.471
  617   3HD2  LEU  17          3HD2      LEU  17   2.122  15.282   5.270
  618    H    TYR  18           H        TYR  18  -2.958  13.089   2.314
  619    HA   TYR  18           HA       TYR  18  -2.840  14.485  -0.116
  620   1HB   TYR  18          1HB       TYR  18  -4.702  12.466   1.082
  621   2HB   TYR  18          2HB       TYR  18  -5.221  13.227  -0.365
  622    HD1  TYR  18           1HD      TYR  18  -3.130  13.384  -2.204
  623    HD2  TYR  18           2HD      TYR  18  -3.816  10.315   0.726
  624    HE1  TYR  18           1HE      TYR  18  -1.597  11.865  -3.443
  625    HE2  TYR  18           2HE      TYR  18  -2.270   8.800  -0.485
  626    HH   TYR  18           HH       TYR  18  -0.840   8.564  -2.255
  627    H    ARG  19           H        ARG  19  -5.418  15.025   2.380
  628    HA   ARG  19           HA       ARG  19  -6.816  17.024   0.840
  629   1HB   ARG  19          1HB       ARG  19  -6.597  16.580   3.848
  630   2HB   ARG  19          2HB       ARG  19  -7.545  17.882   3.132
  631   1HG   ARG  19          1HG       ARG  19  -8.875  16.205   1.837
  632   2HG   ARG  19          2HG       ARG  19  -7.982  14.912   2.645
  633   1HD   ARG  19          1HD       ARG  19 -10.056  15.181   3.831
  634   2HD   ARG  19          2HD       ARG  19  -8.773  15.800   4.859
  635    HE   ARG  19           HE       ARG  19  -9.605  17.974   4.653
  636   1HH1  ARG  19          1HH2      ARG  19 -11.443  15.939   2.467
  637   2HH1  ARG  19          2HH2      ARG  19 -12.645  17.171   2.194
  638   1HH2  ARG  19          1HH1      ARG  19 -11.165  19.498   4.241
  639   2HH2  ARG  19          2HH1      ARG  19 -12.483  19.126   3.172
  640    H    GLU  20           H        GLU  20  -4.067  17.385   3.084
  641    HA   GLU  20           HA       GLU  20  -4.046  20.308   2.852
  642   1HB   GLU  20          1HB       GLU  20  -3.009  18.584   4.655
  643   2HB   GLU  20          2HB       GLU  20  -1.618  18.672   3.611
  644   1HG   GLU  20          1HG       GLU  20  -1.240  20.307   5.276
  645   2HG   GLU  20          2HG       GLU  20  -1.687  21.211   3.835
  646    H    ALA  21           H        ALA  21  -2.186  17.699   1.403
  647    HA   ALA  21           HA       ALA  21  -0.609  19.167  -0.416
  648   1HB   ALA  21          1HB       ALA  21  -0.390  16.745  -0.094
  649   2HB   ALA  21          2HB       ALA  21  -1.970  16.488  -0.866
  650   3HB   ALA  21          3HB       ALA  21  -0.619  17.148  -1.806
  651    H    SER  22           H        SER  22  -4.070  18.137  -0.903
  652    HA   SER  22           HA       SER  22  -4.394  19.408  -3.406
  653   1HB   SER  22          1HB       SER  22  -5.994  17.861  -2.147
  654   2HB   SER  22          2HB       SER  22  -6.583  19.311  -1.314
  655    HG   SER  22           HG       SER  22  -7.076  20.190  -3.394
  656    H    GLU  23           H        GLU  23  -4.347  21.125  -0.238
  657    HA   GLU  23           HA       GLU  23  -5.321  23.652  -1.452
  658   1HB   GLU  23          1HB       GLU  23  -5.458  22.932   0.984
  659   2HB   GLU  23          2HB       GLU  23  -3.742  23.208   1.117
  660   1HG   GLU  23          1HG       GLU  23  -5.748  25.331   0.247
  661   2HG   GLU  23          2HG       GLU  23  -5.283  25.067   1.921
  662    H    LYS  24           H        LYS  24  -2.132  22.355  -0.353
  663    HA   LYS  24           HA       LYS  24  -0.531  24.558  -1.247
  664   1HB   LYS  24          1HB       LYS  24   0.111  22.732   0.409
  665   2HB   LYS  24          2HB       LYS  24   0.305  21.645  -0.964
  666   1HG   LYS  24          1HG       LYS  24   2.475  22.388  -0.349
  667   2HG   LYS  24          2HG       LYS  24   2.097  23.203  -1.862
  668   1HD   LYS  24          1HD       LYS  24   1.506  25.272  -0.556
  669   2HD   LYS  24          2HD       LYS  24   1.913  24.404   0.940
  670   1HE   LYS  24          1HE       LYS  24   4.235  24.041   0.037
  671   2HE   LYS  24          2HE       LYS  24   3.804  25.007  -1.380
  672   1HZ   LYS  24          1HZ       LYS  24   3.395  26.892   0.134
  673   2HZ   LYS  24          2HZ       LYS  24   3.829  25.991   1.427
  674   3HZ   LYS  24          3HZ       LYS  24   4.930  26.361   0.283
  675    H    ALA  25           H        ALA  25  -1.547  21.643  -2.913
  676    HA   ALA  25           HA       ALA  25   0.050  22.155  -5.323
  677   1HB   ALA  25          1HB       ALA  25  -0.121  19.896  -4.137
  678   2HB   ALA  25          2HB       ALA  25  -1.824  19.839  -4.664
  679   3HB   ALA  25          3HB       ALA  25  -0.534  19.901  -5.861
  680    H    ARG  26           H        ARG  26  -2.149  23.970  -4.750
  681    HA   ARG  26           HA       ARG  26  -4.578  23.560  -5.975
  682   1HB   ARG  26          1HB       ARG  26  -4.786  25.968  -5.960
  683   2HB   ARG  26          2HB       ARG  26  -3.940  25.440  -4.533
  684   1HG   ARG  26          1HG       ARG  26  -1.958  25.974  -6.609
  685   2HG   ARG  26          2HG       ARG  26  -3.053  27.337  -6.544
  686   1HD   ARG  26          1HD       ARG  26  -1.763  26.194  -4.033
  687   2HD   ARG  26          2HD       ARG  26  -0.898  27.305  -5.102
  688    HE   ARG  26           HE       ARG  26  -3.404  28.487  -4.519
  689   1HH1  ARG  26          1HH2      ARG  26  -0.463  27.715  -2.783
  690   2HH1  ARG  26          2HH2      ARG  26  -0.602  29.105  -1.740
  691   1HH2  ARG  26          1HH1      ARG  26  -3.504  30.262  -3.174
  692   2HH2  ARG  26          2HH1      ARG  26  -2.282  30.501  -1.961
  693    H    ASN  27           H        ASN  27  -1.649  23.851  -7.758
  694    HA   ASN  27           HA       ASN  27  -2.643  24.691 -10.314
  695   1HB   ASN  27          1HB       ASN  27  -0.267  24.768  -9.601
  696   2HB   ASN  27          2HB       ASN  27  -0.224  23.008  -9.504
  697   1HD2  ASN  27          2HD2      ASN  27   0.255  25.705 -11.581
  698   2HD2  ASN  27          1HD2      ASN  27   0.410  24.773 -13.062
  699    HA   PRO  28           HA       PRO  28  -5.042  21.151 -11.273
  700   1HB   PRO  28          1HB       PRO  28  -5.236  21.208 -14.012
  701   2HB   PRO  28          2HB       PRO  28  -6.063  22.345 -12.904
  702   1HG   PRO  28          1HG       PRO  28  -3.445  22.749 -14.376
  703   2HG   PRO  28          2HG       PRO  28  -4.837  23.874 -14.259
  704   1HD   PRO  28          1HD       PRO  28  -2.666  24.124 -12.663
  705   2HD   PRO  28          2HD       PRO  28  -4.310  24.427 -12.018
  706    H    GLU  29           H        GLU  29  -1.790  21.235 -12.620
  707    HA   GLU  29           HA       GLU  29  -1.758  18.692 -13.873
  708   1HB   GLU  29          1HB       GLU  29  -0.045  20.686 -13.877
  709   2HB   GLU  29          2HB       GLU  29   0.642  19.896 -12.469
  710   1HG   GLU  29          1HG       GLU  29   1.903  19.143 -14.326
  711   2HG   GLU  29          2HG       GLU  29   0.874  17.784 -13.888
  712    H    LYS  30           H        LYS  30  -0.880  19.568 -10.592
  713    HA   LYS  30           HA       LYS  30  -0.664  16.764  -9.683
  714   1HB   LYS  30          1HB       LYS  30   0.722  18.791  -8.782
  715   2HB   LYS  30          2HB       LYS  30  -0.743  19.223  -7.920
  716   1HG   LYS  30          1HG       LYS  30   0.252  17.916  -6.260
  717   2HG   LYS  30          2HG       LYS  30  -0.596  16.641  -7.096
  718   1HD   LYS  30          1HD       LYS  30   1.589  15.822  -6.782
  719   2HD   LYS  30          2HD       LYS  30   1.597  16.339  -8.479
  720   1HE   LYS  30          1HE       LYS  30   2.632  18.516  -7.780
  721   2HE   LYS  30          2HE       LYS  30   2.567  17.997  -6.093
  722   1HZ   LYS  30          1HZ       LYS  30   4.079  16.156  -6.699
  723   2HZ   LYS  30          2HZ       LYS  30   4.204  16.744  -8.228
  724   3HZ   LYS  30          3HZ       LYS  30   4.765  17.613  -6.961
  725    H    LYS  31           H        LYS  31  -2.910  19.500  -9.234
  726    HA   LYS  31           HA       LYS  31  -4.705  18.217  -7.494
  727   1HB   LYS  31          1HB       LYS  31  -4.470  20.664  -7.999
  728   2HB   LYS  31          2HB       LYS  31  -5.420  20.406  -9.438
  729   1HG   LYS  31          1HG       LYS  31  -6.668  19.345  -6.947
  730   2HG   LYS  31          2HG       LYS  31  -6.380  21.087  -6.938
  731   1HD   LYS  31          1HD       LYS  31  -7.595  21.396  -9.007
  732   2HD   LYS  31          2HD       LYS  31  -7.811  19.647  -9.204
  733   1HE   LYS  31          1HE       LYS  31  -9.120  19.556  -7.098
  734   2HE   LYS  31          2HE       LYS  31  -8.896  21.295  -6.869
  735   1HZ   LYS  31          1HZ       LYS  31 -10.148  21.667  -8.924
  736   2HZ   LYS  31          2HZ       LYS  31 -10.339  20.058  -9.157
  737   3HZ   LYS  31          3HZ       LYS  31 -11.049  20.791  -7.885
  738    H    SER  32           H        SER  32  -4.394  17.510 -10.841
  739    HA   SER  32           HA       SER  32  -6.901  15.878 -10.699
  740   1HB   SER  32          1HB       SER  32  -5.294  16.542 -13.196
  741   2HB   SER  32          2HB       SER  32  -6.916  15.835 -13.105
  742    HG   SER  32           HG       SER  32  -6.062  18.467 -12.533
  743    H    VAL  33           H        VAL  33  -3.830  15.395  -9.952
  744    HA   VAL  33           HA       VAL  33  -3.778  12.535 -10.881
  745    HB   VAL  33           HB       VAL  33  -1.557  14.424 -10.032
  746   1HG1  VAL  33          1HG1      VAL  33  -1.051  12.302  -8.917
  747   2HG1  VAL  33          2HG1      VAL  33  -1.374  11.405 -10.422
  748   3HG1  VAL  33          3HG1      VAL  33   0.006  12.518 -10.307
  749   1HG2  VAL  33          1HG2      VAL  33  -1.942  12.695 -12.520
  750   2HG2  VAL  33          2HG2      VAL  33  -2.284  14.433 -12.432
  751   3HG2  VAL  33          3HG2      VAL  33  -0.628  13.854 -12.221
  752    H    LEU  34           H        LEU  34  -3.226  14.655  -7.920
  753    HA   LEU  34           HA       LEU  34  -3.337  12.305  -6.239
  754   1HB   LEU  34          1HB       LEU  34  -2.629  13.595  -4.622
  755   2HB   LEU  34          2HB       LEU  34  -2.113  14.632  -5.935
  756    HG   LEU  34           HG       LEU  34  -4.684  14.860  -4.412
  757   1HD1  LEU  34          1HD1      LEU  34  -3.705  16.738  -3.177
  758   2HD1  LEU  34          2HD1      LEU  34  -2.660  15.332  -2.975
  759   3HD1  LEU  34          3HD1      LEU  34  -2.195  16.605  -4.108
  760   1HD2  LEU  34          1HD2      LEU  34  -3.369  16.966  -6.142
  761   2HD2  LEU  34          2HD2      LEU  34  -4.782  16.001  -6.623
  762   3HD2  LEU  34          3HD2      LEU  34  -4.909  17.130  -5.269
  763    H    GLN  35           H        GLN  35  -5.829  14.310  -7.663
  764    HA   GLN  35           HA       GLN  35  -7.912  13.749  -5.781
  765   1HB   GLN  35          1HB       GLN  35  -7.826  15.530  -7.515
  766   2HB   GLN  35          2HB       GLN  35  -8.201  14.330  -8.752
  767   1HG   GLN  35          1HG       GLN  35  -9.910  15.013  -6.307
  768   2HG   GLN  35          2HG       GLN  35 -10.132  15.728  -7.896
  769   1HE2  GLN  35          2HE2      GLN  35 -11.848  13.843  -6.092
  770   2HE2  GLN  35          1HE2      GLN  35 -12.351  12.614  -7.243
  771    H    LYS  36           H        LYS  36  -6.728  12.024  -8.652
  772    HA   LYS  36           HA       LYS  36  -8.726   9.979  -8.763
  773   1HB   LYS  36          1HB       LYS  36  -6.914  10.796 -10.472
  774   2HB   LYS  36          2HB       LYS  36  -5.796   9.731  -9.615
  775   1HG   LYS  36          1HG       LYS  36  -7.390   7.816 -10.117
  776   2HG   LYS  36          2HG       LYS  36  -8.342   8.939 -11.096
  777   1HD   LYS  36          1HD       LYS  36  -5.442   8.109 -11.507
  778   2HD   LYS  36          2HD       LYS  36  -6.813   7.642 -12.510
  779   1HE   LYS  36          1HE       LYS  36  -5.642  10.452 -12.234
  780   2HE   LYS  36          2HE       LYS  36  -5.358   9.341 -13.570
  781   1HZ   LYS  36          1HZ       LYS  36  -7.730   9.447 -14.102
  782   2HZ   LYS  36          2HZ       LYS  36  -8.009  10.491 -12.872
  783   3HZ   LYS  36          3HZ       LYS  36  -7.076  10.940 -14.131
  784    H    ILE  37           H        ILE  37  -5.590  10.048  -7.104
  785    HA   ILE  37           HA       ILE  37  -5.837   7.461  -5.761
  786    HB   ILE  37           HB       ILE  37  -4.398  10.043  -5.018
  787   1HG1  ILE  37          1HG1      ILE  37  -3.247   7.584  -6.301
  788   2HG1  ILE  37          2HG1      ILE  37  -3.570   9.147  -7.076
  789   1HG2  ILE  37          1HG2      ILE  37  -4.634   8.880  -2.956
  790   2HG2  ILE  37          2HG2      ILE  37  -4.421   7.302  -3.736
  791   3HG2  ILE  37          3HG2      ILE  37  -3.046   8.365  -3.511
  792   1HD1  ILE  37          1HD1      ILE  37  -1.942  10.190  -5.425
  793   2HD1  ILE  37          2HD1      ILE  37  -1.435   8.519  -5.045
  794   3HD1  ILE  37          3HD1      ILE  37  -1.264   9.142  -6.682
  795    H    LEU  38           H        LEU  38  -6.760  10.843  -4.741
  796    HA   LEU  38           HA       LEU  38  -7.931  10.188  -2.319
  797   1HB   LEU  38          1HB       LEU  38  -8.041  12.363  -4.237
  798   2HB   LEU  38          2HB       LEU  38  -9.614  12.172  -3.510
  799    HG   LEU  38           HG       LEU  38  -7.175  12.225  -1.722
  800   1HD1  LEU  38          1HD1      LEU  38  -6.798  14.120  -3.224
  801   2HD1  LEU  38          2HD1      LEU  38  -8.460  14.696  -2.960
  802   3HD1  LEU  38          3HD1      LEU  38  -7.285  14.694  -1.622
  803   1HD2  LEU  38          1HD2      LEU  38  -9.941  13.493  -1.427
  804   2HD2  LEU  38          2HD2      LEU  38  -9.562  11.864  -0.866
  805   3HD2  LEU  38          3HD2      LEU  38  -8.721  13.261  -0.156
  806    H    GLU  39           H        GLU  39  -9.515   9.789  -5.541
  807    HA   GLU  39           HA       GLU  39 -11.968   8.841  -4.337
  808   1HB   GLU  39          1HB       GLU  39 -11.767   9.872  -6.616
  809   2HB   GLU  39          2HB       GLU  39 -10.896   8.437  -7.170
  810   1HG   GLU  39          1HG       GLU  39 -12.882   7.039  -6.742
  811   2HG   GLU  39          2HG       GLU  39 -13.736   8.426  -6.058
  812    H    ASP  40           H        ASP  40  -9.107   7.074  -5.550
  813    HA   ASP  40           HA       ASP  40 -10.094   4.395  -5.147
  814   1HB   ASP  40          1HB       ASP  40  -7.436   5.884  -5.340
  815   2HB   ASP  40          2HB       ASP  40  -7.418   4.291  -4.788
  816    H    GLU  41           H        GLU  41  -8.579   6.794  -2.973
  817    HA   GLU  41           HA       GLU  41  -8.208   4.798  -0.836
  818   1HB   GLU  41          1HB       GLU  41  -7.966   7.814  -0.810
  819   2HB   GLU  41          2HB       GLU  41  -7.536   6.761   0.544
  820   1HG   GLU  41          1HG       GLU  41  -6.165   6.733  -2.166
  821   2HG   GLU  41          2HG       GLU  41  -5.605   7.622  -0.761
  822    H    GLU  42           H        GLU  42 -10.574   7.365  -1.574
  823    HA   GLU  42           HA       GLU  42 -12.212   7.029   0.741
  824   1HB   GLU  42          1HB       GLU  42 -12.419   8.841  -0.972
  825   2HB   GLU  42          2HB       GLU  42 -13.091   7.661  -2.106
  826   1HG   GLU  42          1HG       GLU  42 -14.974   7.246  -0.527
  827   2HG   GLU  42          2HG       GLU  42 -14.270   8.399   0.610
  828    H    LYS  43           H        LYS  43 -11.990   5.113  -2.266
  829    HA   LYS  43           HA       LYS  43 -14.179   3.347  -1.625
  830   1HB   LYS  43          1HB       LYS  43 -12.658   3.761  -3.874
  831   2HB   LYS  43          2HB       LYS  43 -11.960   2.262  -3.314
  832   1HG   LYS  43          1HG       LYS  43 -13.685   1.642  -4.779
  833   2HG   LYS  43          2HG       LYS  43 -14.413   1.409  -3.182
  834   1HD   LYS  43          1HD       LYS  43 -15.533   3.625  -3.373
  835   2HD   LYS  43          2HD       LYS  43 -14.800   3.874  -4.956
  836   1HE   LYS  43          1HE       LYS  43 -16.700   1.589  -4.250
  837   2HE   LYS  43          2HE       LYS  43 -17.200   3.115  -4.981
  838   1HZ   LYS  43          1HZ       LYS  43 -15.776   2.609  -6.891
  839   2HZ   LYS  43          2HZ       LYS  43 -15.333   1.176  -6.240
  840   3HZ   LYS  43          3HZ       LYS  43 -16.882   1.433  -6.677
  841    H    HIS  44           H        HIS  44 -10.620   3.059  -0.875
  842    HA   HIS  44           HA       HIS  44 -10.723   0.510   0.307
  843   1HB   HIS  44          1HB       HIS  44  -9.040   3.005   0.883
  844   2HB   HIS  44          2HB       HIS  44  -8.727   1.392   1.420
  845    HD2  HIS  44           2HD      HIS  44  -9.817   0.712  -1.909
  846    HE1  HIS  44           1HE      HIS  44  -5.749   1.699  -2.564
  847    HE2  HIS  44           2HE      HIS  44  -7.875   0.833  -3.633
  848    H    ILE  45           H        ILE  45 -10.855   3.723   1.835
  849    HA   ILE  45           HA       ILE  45 -11.618   3.025   4.435
  850    HB   ILE  45           HB       ILE  45 -12.139   5.431   2.681
  851   1HG1  ILE  45          1HG1      ILE  45  -9.765   4.982   3.163
  852   2HG1  ILE  45          2HG1      ILE  45 -10.338   6.515   3.791
  853   1HG2  ILE  45          1HG2      ILE  45 -13.847   5.588   4.330
  854   2HG2  ILE  45          2HG2      ILE  45 -12.717   5.164   5.635
  855   3HG2  ILE  45          3HG2      ILE  45 -12.566   6.721   4.775
  856   1HD1  ILE  45          1HD1      ILE  45 -10.432   5.572   6.058
  857   2HD1  ILE  45          2HD1      ILE  45  -9.903   3.988   5.436
  858   3HD1  ILE  45          3HD1      ILE  45  -8.826   5.395   5.335
  859    H    GLU  46           H        GLU  46 -13.908   3.549   1.655
  860    HA   GLU  46           HA       GLU  46 -16.316   3.108   3.066
  861   1HB   GLU  46          1HB       GLU  46 -15.371   2.697   0.243
  862   2HB   GLU  46          2HB       GLU  46 -16.841   1.874   0.697
  863   1HG   GLU  46          1HG       GLU  46 -16.432   4.851   1.063
  864   2HG   GLU  46          2HG       GLU  46 -17.092   4.110  -0.401
  865    H    TRP  47           H        TRP  47 -14.112   0.658   1.650
  866    HA   TRP  47           HA       TRP  47 -15.796  -1.558   2.446
  867   1HB   TRP  47          1HB       TRP  47 -12.851  -1.534   1.674
  868   2HB   TRP  47          2HB       TRP  47 -13.956  -2.883   1.601
  869    HD1  TRP  47           1HD      TRP  47 -16.241  -1.000  -0.055
  870    HE1  TRP  47           1HE      TRP  47 -15.828  -0.602  -2.564
  871    HE3  TRP  47           3HE      TRP  47 -11.243  -2.068  -0.243
  872    HZ2  TRP  47           2HZ      TRP  47 -13.649  -0.978  -4.448
  873    HZ3  TRP  47           3HZ      TRP  47 -10.023  -2.118  -2.387
  874    HH2  TRP  47           2HH      TRP  47 -11.216  -1.543  -4.510
  875    H    LEU  48           H        LEU  48 -12.775  -0.115   3.733
  876    HA   LEU  48           HA       LEU  48 -12.312  -1.781   5.949
  877   1HB   LEU  48          1HB       LEU  48 -11.915   1.152   5.325
  878   2HB   LEU  48          2HB       LEU  48 -11.497   0.580   6.906
  879    HG   LEU  48           HG       LEU  48 -10.369  -0.684   4.403
  880   1HD1  LEU  48          1HD1      LEU  48  -9.709   1.674   4.412
  881   2HD1  LEU  48          2HD1      LEU  48  -9.224   1.565   6.116
  882   3HD1  LEU  48          3HD1      LEU  48  -8.324   0.679   4.863
  883   1HD2  LEU  48          1HD2      LEU  48  -9.407  -0.643   7.308
  884   2HD2  LEU  48          2HD2      LEU  48 -10.163  -2.030   6.495
  885   3HD2  LEU  48          3HD2      LEU  48  -8.585  -1.446   5.954
  886    H    GLU  49           H        GLU  49 -14.583   0.961   5.715
  887    HA   GLU  49           HA       GLU  49 -15.560   0.726   8.418
  888   1HB   GLU  49          1HB       GLU  49 -15.950   2.603   6.598
  889   2HB   GLU  49          2HB       GLU  49 -17.319   1.627   6.105
  890   1HG   GLU  49          1HG       GLU  49 -18.171   1.670   8.475
  891   2HG   GLU  49          2HG       GLU  49 -16.828   2.722   8.912
  892    H    THR  50           H        THR  50 -16.839  -0.685   5.378
  893    HA   THR  50           HA       THR  50 -18.987  -2.067   6.714
  894    HB   THR  50           HB       THR  50 -18.468  -1.542   4.138
  895    HG1  THR  50           1HG      THR  50 -20.109  -3.655   5.067
  896   1HG2  THR  50          1HG2      THR  50 -16.863  -3.409   3.774
  897   2HG2  THR  50          2HG2      THR  50 -18.125  -4.567   4.234
  898   3HG2  THR  50          3HG2      THR  50 -18.326  -3.543   2.802
  899    H    ILE  51           H        ILE  51 -15.681  -2.787   6.598
  900    HA   ILE  51           HA       ILE  51 -16.044  -5.575   7.550
  901    HB   ILE  51           HB       ILE  51 -13.846  -4.036   6.169
  902   1HG1  ILE  51          1HG1      ILE  51 -14.714  -6.809   5.376
  903   2HG1  ILE  51          2HG1      ILE  51 -15.929  -5.565   5.177
  904   1HG2  ILE  51          1HG2      ILE  51 -12.562  -5.261   7.807
  905   2HG2  ILE  51          2HG2      ILE  51 -13.436  -6.766   7.436
  906   3HG2  ILE  51          3HG2      ILE  51 -12.369  -6.020   6.226
  907   1HD1  ILE  51          1HD1      ILE  51 -14.737  -4.416   3.546
  908   2HD1  ILE  51          2HD1      ILE  51 -13.177  -5.072   4.058
  909   3HD1  ILE  51          3HD1      ILE  51 -14.362  -6.093   3.191
  910    H    ASN  52           H        ASN  52 -15.439  -2.569   8.857
  911    HA   ASN  52           HA       ASN  52 -14.073  -3.496  11.293
  912   1HB   ASN  52          1HB       ASN  52 -13.887  -1.158  10.369
  913   2HB   ASN  52          2HB       ASN  52 -15.595  -0.913  10.743
  914   1HD2  ASN  52          2HD2      ASN  52 -15.081   0.830  12.198
  915   2HD2  ASN  52          1HD2      ASN  52 -14.326   0.493  13.749
  916    H    GLY  53           H        GLY  53 -15.186  -3.150  13.454
  917   1HA   GLY  53          1HA       GLY  53 -18.043  -3.270  13.762
  918   2HA   GLY  53          2HA       GLY  53 -17.370  -4.896  13.875
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1   6.546  22.622   0.433
    2   2H    MET   1          2H        MET   1   7.492  23.615  -0.446
    3   3H    MET   1          3H        MET   1   5.865  23.815  -0.459
    4    HA   MET   1           HA       MET   1   5.550  21.689  -1.553
    5   1HB   MET   1          1HB       MET   1   7.429  23.649  -2.934
    6   2HB   MET   1          2HB       MET   1   6.751  22.244  -3.756
    7   1HG   MET   1          1HG       MET   1   4.467  22.984  -3.238
    8   2HG   MET   1          2HG       MET   1   5.090  24.443  -2.470
    9   1HE   MET   1          1HE       MET   1   5.838  26.574  -3.679
   10   2HE   MET   1          2HE       MET   1   7.281  25.688  -4.231
   11   3HE   MET   1          3HE       MET   1   6.323  26.638  -5.387
   12    H    ASP   2           H        ASP   2   6.891  20.174  -3.143
   13    HA   ASP   2           HA       ASP   2   8.120  18.327  -3.261
   14   1HB   ASP   2          1HB       ASP   2   9.824  19.987  -3.788
   15   2HB   ASP   2          2HB       ASP   2  10.347  20.004  -2.104
   16    H    TYR   3           H        TYR   3   6.618  17.462  -1.741
   17    HA   TYR   3           HA       TYR   3   7.908  16.215   0.673
   18   1HB   TYR   3          1HB       TYR   3   5.619  16.462   1.722
   19   2HB   TYR   3          2HB       TYR   3   6.413  17.987   1.397
   20    HD1  TYR   3           1HD      TYR   3   5.435  19.632  -0.051
   21    HD2  TYR   3           2HD      TYR   3   3.717  15.689   0.159
   22    HE1  TYR   3           1HE      TYR   3   3.505  20.399  -1.433
   23    HE2  TYR   3           2HE      TYR   3   1.801  16.463  -1.230
   24    HH   TYR   3           HH       TYR   3   1.561  19.790  -2.487
   25    H    LEU   4           H        LEU   4   7.010  15.407  -2.323
   26    HA   LEU   4           HA       LEU   4   5.005  13.447  -2.108
   27   1HB   LEU   4          1HB       LEU   4   5.705  12.706  -4.293
   28   2HB   LEU   4          2HB       LEU   4   5.764  14.454  -4.188
   29    HG   LEU   4           HG       LEU   4   8.350  13.821  -3.469
   30   1HD1  LEU   4          1HD1      LEU   4   7.961  11.388  -3.976
   31   2HD1  LEU   4          2HD1      LEU   4   7.589  11.835  -5.650
   32   3HD1  LEU   4          3HD1      LEU   4   9.211  12.129  -4.979
   33   1HD2  LEU   4          1HD2      LEU   4   7.382  14.214  -6.316
   34   2HD2  LEU   4          2HD2      LEU   4   7.684  15.505  -5.134
   35   3HD2  LEU   4          3HD2      LEU   4   9.024  14.500  -5.700
   36    H    ARG   5           H        ARG   5   8.474  13.040  -1.498
   37    HA   ARG   5           HA       ARG   5   8.369  10.166  -1.137
   38   1HB   ARG   5          1HB       ARG   5  10.378  11.565  -1.714
   39   2HB   ARG   5          2HB       ARG   5  10.426  12.152  -0.057
   40   1HG   ARG   5          1HG       ARG   5  10.411   9.164  -0.596
   41   2HG   ARG   5          2HG       ARG   5  11.873  10.072  -0.938
   42   1HD   ARG   5          1HD       ARG   5  10.518  10.053   1.790
   43   2HD   ARG   5          2HD       ARG   5  11.816   8.970   1.326
   44    HE   ARG   5           HE       ARG   5  12.027  11.809   2.003
   45   1HH1  ARG   5          1HH2      ARG   5  13.742   9.191   0.412
   46   2HH1  ARG   5          2HH2      ARG   5  15.286   9.973   0.607
   47   1HH2  ARG   5          1HH1      ARG   5  14.030  12.740   2.210
   48   2HH2  ARG   5          2HH1      ARG   5  15.436  11.921   1.598
   49    H    GLU   6           H        GLU   6   7.702  12.882   0.983
   50    HA   GLU   6           HA       GLU   6   7.620  11.365   3.452
   51   1HB   GLU   6          1HB       GLU   6   7.832  13.907   3.199
   52   2HB   GLU   6          2HB       GLU   6   6.113  13.941   2.828
   53   1HG   GLU   6          1HG       GLU   6   5.570  12.897   4.991
   54   2HG   GLU   6          2HG       GLU   6   7.286  12.723   5.363
   55    H    LEU   7           H        LEU   7   5.185  12.271   1.005
   56    HA   LEU   7           HA       LEU   7   2.949  10.951   2.231
   57   1HB   LEU   7          1HB       LEU   7   3.428  11.201  -0.767
   58   2HB   LEU   7          2HB       LEU   7   1.908  10.887   0.049
   59    HG   LEU   7           HG       LEU   7   3.496  13.467   0.020
   60   1HD1  LEU   7          1HD1      LEU   7   2.130  12.974  -1.967
   61   2HD1  LEU   7          2HD1      LEU   7   0.711  12.700  -0.935
   62   3HD1  LEU   7          3HD1      LEU   7   1.420  14.313  -1.048
   63   1HD2  LEU   7          1HD2      LEU   7   0.974  12.827   1.603
   64   2HD2  LEU   7          2HD2      LEU   7   2.565  13.277   2.271
   65   3HD2  LEU   7          3HD2      LEU   7   1.637  14.459   1.342
   66    H    TYR   8           H        TYR   8   5.186   9.734  -0.257
   67    HA   TYR   8           HA       TYR   8   4.384   7.088  -0.643
   68   1HB   TYR   8          1HB       TYR   8   6.427   8.688  -1.439
   69   2HB   TYR   8          2HB       TYR   8   7.315   7.879  -0.214
   70    HD1  TYR   8           1HD      TYR   8   7.013   8.009  -3.552
   71    HD2  TYR   8           2HD      TYR   8   7.022   5.090  -0.377
   72    HE1  TYR   8           1HE      TYR   8   7.860   6.285  -5.136
   73    HE2  TYR   8           2HE      TYR   8   7.915   3.393  -1.951
   74    HH   TYR   8           HH       TYR   8   8.641   2.953  -4.069
   75    H    LYS   9           H        LYS   9   6.528   8.283   1.955
   76    HA   LYS   9           HA       LYS   9   6.986   5.701   3.062
   77   1HB   LYS   9          1HB       LYS   9   8.345   7.824   3.454
   78   2HB   LYS   9          2HB       LYS   9   7.106   8.332   4.612
   79   1HG   LYS   9          1HG       LYS   9   7.546   6.280   5.962
   80   2HG   LYS   9          2HG       LYS   9   8.741   5.753   4.759
   81   1HD   LYS   9          1HD       LYS   9  10.074   7.823   5.219
   82   2HD   LYS   9          2HD       LYS   9   8.898   8.271   6.476
   83   1HE   LYS   9          1HE       LYS   9   9.382   6.124   7.660
   84   2HE   LYS   9          2HE       LYS   9  10.564   5.709   6.413
   85   1HZ   LYS   9          1HZ       LYS   9  11.839   7.690   7.064
   86   2HZ   LYS   9          2HZ       LYS   9  10.750   8.058   8.228
   87   3HZ   LYS   9          3HZ       LYS   9  11.644   6.699   8.344
   88    H    LEU  10           H        LEU  10   4.636   8.092   4.352
   89    HA   LEU  10           HA       LEU  10   3.417   6.237   6.074
   90   1HB   LEU  10          1HB       LEU  10   2.382   8.799   4.818
   91   2HB   LEU  10          2HB       LEU  10   1.451   7.831   5.957
   92    HG   LEU  10           HG       LEU  10   3.925   8.024   7.241
   93   1HD1  LEU  10          1HD1      LEU  10   4.851   9.683   5.849
   94   2HD1  LEU  10          2HD1      LEU  10   3.382  10.677   5.899
   95   3HD1  LEU  10          3HD1      LEU  10   4.386  10.475   7.351
   96   1HD2  LEU  10          1HD2      LEU  10   1.490   9.817   7.602
   97   2HD2  LEU  10          2HD2      LEU  10   1.716   8.203   8.308
   98   3HD2  LEU  10          3HD2      LEU  10   2.768   9.534   8.805
   99    H    GLU  11           H        GLU  11   2.772   6.897   2.648
  100    HA   GLU  11           HA       GLU  11   0.646   5.035   2.225
  101   1HB   GLU  11          1HB       GLU  11   2.731   6.455   0.647
  102   2HB   GLU  11          2HB       GLU  11   2.187   5.075  -0.159
  103   1HG   GLU  11          1HG       GLU  11   0.329   7.241   0.980
  104   2HG   GLU  11          2HG       GLU  11   1.040   7.328  -0.622
  105    H    GLN  12           H        GLN  12   4.231   4.379   2.456
  106    HA   GLN  12           HA       GLN  12   3.741   1.565   2.117
  107   1HB   GLN  12          1HB       GLN  12   6.156   3.241   2.779
  108   2HB   GLN  12          2HB       GLN  12   6.191   1.472   2.837
  109   1HG   GLN  12          1HG       GLN  12   5.320   1.384   0.516
  110   2HG   GLN  12          2HG       GLN  12   5.434   3.123   0.408
  111   1HE2  GLN  12          2HE2      GLN  12   7.023   0.488  -0.672
  112   2HE2  GLN  12          1HE2      GLN  12   8.686   1.039  -0.537
  113    H    GLN  13           H        GLN  13   3.644   3.583   4.945
  114    HA   GLN  13           HA       GLN  13   4.175   1.444   6.870
  115   1HB   GLN  13          1HB       GLN  13   2.540   4.016   7.123
  116   2HB   GLN  13          2HB       GLN  13   2.835   2.898   8.456
  117   1HG   GLN  13          1HG       GLN  13   5.246   3.235   8.297
  118   2HG   GLN  13          2HG       GLN  13   5.046   4.344   6.945
  119   1HE2  GLN  13          2HE2      GLN  13   6.254   4.887   9.631
  120   2HE2  GLN  13          1HE2      GLN  13   5.287   6.205  10.277
  121    H    ALA  14           H        ALA  14   1.237   2.426   5.112
  122    HA   ALA  14           HA       ALA  14  -0.454   0.428   6.423
  123   1HB   ALA  14          1HB       ALA  14  -1.386   2.411   5.260
  124   2HB   ALA  14          2HB       ALA  14  -0.696   1.842   3.720
  125   3HB   ALA  14          3HB       ALA  14  -1.966   0.901   4.531
  126    H    MET  15           H        MET  15   2.009   0.322   3.896
  127    HA   MET  15           HA       MET  15   1.047  -2.182   2.704
  128   1HB   MET  15          1HB       MET  15   2.194  -0.394   1.387
  129   2HB   MET  15          2HB       MET  15   3.648  -0.637   2.348
  130   1HG   MET  15          1HG       MET  15   4.004  -1.636   0.286
  131   2HG   MET  15          2HG       MET  15   3.880  -2.926   1.466
  132   1HE   MET  15          1HE       MET  15   2.526  -4.795   1.342
  133   2HE   MET  15          2HE       MET  15   0.986  -4.005   1.717
  134   3HE   MET  15          3HE       MET  15   1.092  -5.099   0.331
  135    H    LYS  16           H        LYS  16   3.682  -1.155   4.926
  136    HA   LYS  16           HA       LYS  16   4.690  -3.780   5.548
  137   1HB   LYS  16          1HB       LYS  16   4.600  -1.062   6.896
  138   2HB   LYS  16          2HB       LYS  16   5.106  -2.447   7.850
  139   1HG   LYS  16          1HG       LYS  16   6.433  -1.751   5.193
  140   2HG   LYS  16          2HG       LYS  16   6.959  -1.080   6.744
  141   1HD   LYS  16          1HD       LYS  16   7.312  -3.376   7.635
  142   2HD   LYS  16          2HD       LYS  16   6.867  -4.056   6.057
  143   1HE   LYS  16          1HE       LYS  16   8.750  -2.882   4.990
  144   2HE   LYS  16          2HE       LYS  16   9.163  -2.104   6.523
  145   1HZ   LYS  16          1HZ       LYS  16   9.635  -4.305   7.449
  146   2HZ   LYS  16          2HZ       LYS  16   9.247  -5.036   6.040
  147   3HZ   LYS  16          3HZ       LYS  16  10.550  -4.058   6.123
  148    H    LEU  17           H        LEU  17   2.084  -1.860   7.091
  149    HA   LEU  17           HA       LEU  17   1.258  -3.883   8.908
  150   1HB   LEU  17          1HB       LEU  17   0.181  -1.374   7.722
  151   2HB   LEU  17          2HB       LEU  17  -1.062  -2.479   8.184
  152    HG   LEU  17           HG       LEU  17   1.203  -1.598  10.033
  153   1HD1  LEU  17          1HD1      LEU  17  -0.260   0.283   9.387
  154   2HD1  LEU  17          2HD1      LEU  17  -1.686  -0.637   9.917
  155   3HD1  LEU  17          3HD1      LEU  17  -0.443  -0.153  11.095
  156   1HD2  LEU  17          1HD2      LEU  17  -1.436  -3.014  10.645
  157   2HD2  LEU  17          2HD2      LEU  17   0.174  -3.751  10.745
  158   3HD2  LEU  17          3HD2      LEU  17  -0.256  -2.445  11.844
  159    H    TYR  18           H        TYR  18   0.070  -3.260   5.565
  160    HA   TYR  18           HA       TYR  18  -1.656  -5.435   5.435
  161   1HB   TYR  18          1HB       TYR  18  -0.281  -3.654   3.487
  162   2HB   TYR  18          2HB       TYR  18  -0.948  -5.092   2.829
  163    HD1  TYR  18           1HD      TYR  18  -3.468  -5.492   4.306
  164    HD2  TYR  18           2HD      TYR  18  -1.690  -1.858   2.834
  165    HE1  TYR  18           1HE      TYR  18  -5.687  -4.374   4.401
  166    HE2  TYR  18           2HE      TYR  18  -3.900  -0.731   2.945
  167    HH   TYR  18           HH       TYR  18  -6.099  -0.911   3.598
  168    H    ARG  19           H        ARG  19   1.866  -5.515   4.908
  169    HA   ARG  19           HA       ARG  19   2.000  -8.179   3.882
  170   1HB   ARG  19          1HB       ARG  19   3.871  -6.183   4.868
  171   2HB   ARG  19          2HB       ARG  19   4.230  -7.710   5.658
  172   1HG   ARG  19          1HG       ARG  19   5.530  -7.684   3.673
  173   2HG   ARG  19          2HG       ARG  19   4.206  -8.816   3.372
  174   1HD   ARG  19          1HD       ARG  19   2.967  -6.812   2.294
  175   2HD   ARG  19          2HD       ARG  19   4.504  -5.954   2.346
  176    HE   ARG  19           HE       ARG  19   3.672  -8.063   0.522
  177   1HH1  ARG  19          1HH2      ARG  19   6.604  -6.685   1.879
  178   2HH1  ARG  19          2HH2      ARG  19   7.580  -7.276   0.564
  179   1HH2  ARG  19          1HH1      ARG  19   4.972  -8.754  -1.114
  180   2HH2  ARG  19          2HH1      ARG  19   6.676  -8.406  -1.085
  181    H    GLU  20           H        GLU  20   1.247  -7.157   7.114
  182    HA   GLU  20           HA       GLU  20   1.439  -9.966   8.115
  183   1HB   GLU  20          1HB       GLU  20   2.313  -7.598   9.215
  184   2HB   GLU  20          2HB       GLU  20   0.721  -7.699   9.922
  185   1HG   GLU  20          1HG       GLU  20   2.149  -8.744  11.485
  186   2HG   GLU  20          2HG       GLU  20   1.282 -10.059  10.699
  187    H    ALA  21           H        ALA  21  -0.816  -7.262   7.789
  188    HA   ALA  21           HA       ALA  21  -3.152  -8.498   8.806
  189   1HB   ALA  21          1HB       ALA  21  -2.937  -6.096   8.068
  190   2HB   ALA  21          2HB       ALA  21  -3.034  -6.670   6.384
  191   3HB   ALA  21          3HB       ALA  21  -4.399  -6.910   7.470
  192    H    SER  22           H        SER  22  -1.751  -8.792   5.490
  193    HA   SER  22           HA       SER  22  -3.581 -10.629   4.394
  194   1HB   SER  22          1HB       SER  22  -1.731  -9.446   3.204
  195   2HB   SER  22          2HB       SER  22  -0.573 -10.535   3.985
  196    HG   SER  22           HG       SER  22  -2.605 -11.141   2.083
  197    H    GLU  23           H        GLU  23  -0.935 -11.318   6.707
  198    HA   GLU  23           HA       GLU  23  -1.036 -14.214   6.451
  199   1HB   GLU  23          1HB       GLU  23   0.850 -12.724   7.412
  200   2HB   GLU  23          2HB       GLU  23  -0.116 -12.666   8.875
  201   1HG   GLU  23          1HG       GLU  23   1.459 -14.401   9.198
  202   2HG   GLU  23          2HG       GLU  23  -0.096 -15.181   8.962
  203    H    LYS  24           H        LYS  24  -2.415 -11.863   8.762
  204    HA   LYS  24           HA       LYS  24  -4.005 -13.806  10.241
  205   1HB   LYS  24          1HB       LYS  24  -4.266 -10.780   9.963
  206   2HB   LYS  24          2HB       LYS  24  -5.270 -11.787  11.022
  207   1HG   LYS  24          1HG       LYS  24  -3.179 -12.630  12.137
  208   2HG   LYS  24          2HG       LYS  24  -2.244 -11.458  11.189
  209   1HD   LYS  24          1HD       LYS  24  -3.486  -9.591  12.232
  210   2HD   LYS  24          2HD       LYS  24  -4.546 -10.740  13.056
  211   1HE   LYS  24          1HE       LYS  24  -3.007 -10.040  14.704
  212   2HE   LYS  24          2HE       LYS  24  -2.540 -11.681  14.257
  213   1HZ   LYS  24          1HZ       LYS  24  -0.777 -10.710  12.860
  214   2HZ   LYS  24          2HZ       LYS  24  -1.227  -9.192  13.286
  215   3HZ   LYS  24          3HZ       LYS  24  -0.618 -10.210  14.403
  216    H    ALA  25           H        ALA  25  -4.753 -11.774   7.442
  217    HA   ALA  25           HA       ALA  25  -7.431 -12.824   7.046
  218   1HB   ALA  25          1HB       ALA  25  -6.738 -10.505   6.414
  219   2HB   ALA  25          2HB       ALA  25  -5.608 -11.192   5.213
  220   3HB   ALA  25          3HB       ALA  25  -7.345 -11.416   5.021
  221    H    ARG  26           H        ARG  26  -5.426 -15.013   7.143
  222    HA   ARG  26           HA       ARG  26  -4.847 -15.929   4.499
  223   1HB   ARG  26          1HB       ARG  26  -4.333 -18.066   5.540
  224   2HB   ARG  26          2HB       ARG  26  -3.574 -16.714   6.335
  225   1HG   ARG  26          1HG       ARG  26  -4.281 -18.387   7.932
  226   2HG   ARG  26          2HG       ARG  26  -5.129 -16.873   8.241
  227   1HD   ARG  26          1HD       ARG  26  -7.192 -17.737   7.608
  228   2HD   ARG  26          2HD       ARG  26  -6.458 -18.871   6.465
  229    HE   ARG  26           HE       ARG  26  -5.966 -19.423   9.319
  230   1HH1  ARG  26          1HH2      ARG  26  -8.000 -20.216   6.566
  231   2HH1  ARG  26          2HH2      ARG  26  -8.515 -21.722   7.270
  232   1HH2  ARG  26          1HH1      ARG  26  -6.661 -21.378  10.138
  233   2HH2  ARG  26          2HH1      ARG  26  -7.779 -22.353   9.228
  234    H    ASN  27           H        ASN  27  -7.843 -15.807   6.099
  235    HA   ASN  27           HA       ASN  27  -9.263 -17.897   4.728
  236   1HB   ASN  27          1HB       ASN  27 -10.037 -16.794   6.808
  237   2HB   ASN  27          2HB       ASN  27 -10.217 -15.264   5.947
  238   1HD2  ASN  27          2HD2      ASN  27 -11.966 -17.880   7.058
  239   2HD2  ASN  27          1HD2      ASN  27 -13.301 -17.772   5.919
  240    HA   PRO  28           HA       PRO  28  -8.851 -16.007   0.746
  241   1HB   PRO  28          1HB       PRO  28 -10.572 -17.499  -0.781
  242   2HB   PRO  28          2HB       PRO  28  -9.035 -18.127  -0.113
  243   1HG   PRO  28          1HG       PRO  28 -11.823 -18.413   1.054
  244   2HG   PRO  28          2HG       PRO  28 -10.600 -19.700   0.780
  245   1HD   PRO  28          1HD       PRO  28 -10.907 -18.524   3.202
  246   2HD   PRO  28          2HD       PRO  28  -9.277 -18.949   2.593
  247    H    GLU  29           H        GLU  29 -11.934 -15.865   2.395
  248    HA   GLU  29           HA       GLU  29 -13.366 -14.299   0.426
  249   1HB   GLU  29          1HB       GLU  29 -14.253 -15.624   2.454
  250   2HB   GLU  29          2HB       GLU  29 -13.822 -14.231   3.431
  251   1HG   GLU  29          1HG       GLU  29 -15.721 -14.251   1.038
  252   2HG   GLU  29          2HG       GLU  29 -16.220 -14.352   2.720
  253    H    LYS  30           H        LYS  30 -11.691 -13.391   3.387
  254    HA   LYS  30           HA       LYS  30 -11.534 -10.543   2.850
  255   1HB   LYS  30          1HB       LYS  30 -10.850 -12.292   5.024
  256   2HB   LYS  30          2HB       LYS  30  -9.361 -11.558   4.509
  257   1HG   LYS  30          1HG       LYS  30  -9.929  -9.873   5.907
  258   2HG   LYS  30          2HG       LYS  30 -10.910  -9.310   4.563
  259   1HD   LYS  30          1HD       LYS  30 -12.333  -9.262   6.466
  260   2HD   LYS  30          2HD       LYS  30 -12.839 -10.701   5.562
  261   1HE   LYS  30          1HE       LYS  30 -11.381 -12.100   7.077
  262   2HE   LYS  30          2HE       LYS  30 -10.943 -10.640   7.968
  263   1HZ   LYS  30          1HZ       LYS  30 -13.698 -11.736   7.743
  264   2HZ   LYS  30          2HZ       LYS  30 -12.743 -11.841   9.061
  265   3HZ   LYS  30          3HZ       LYS  30 -13.293 -10.385   8.572
  266    H    LYS  31           H        LYS  31  -9.278 -13.228   2.180
  267    HA   LYS  31           HA       LYS  31  -7.300 -11.541   1.003
  268   1HB   LYS  31          1HB       LYS  31  -7.478 -14.273   1.681
  269   2HB   LYS  31          2HB       LYS  31  -7.100 -14.239  -0.046
  270   1HG   LYS  31          1HG       LYS  31  -5.185 -12.733   0.395
  271   2HG   LYS  31          2HG       LYS  31  -5.671 -12.582   2.087
  272   1HD   LYS  31          1HD       LYS  31  -3.886 -14.053   2.148
  273   2HD   LYS  31          2HD       LYS  31  -5.313 -15.087   2.330
  274   1HE   LYS  31          1HE       LYS  31  -5.177 -15.769  -0.020
  275   2HE   LYS  31          2HE       LYS  31  -3.888 -14.594  -0.324
  276   1HZ   LYS  31          1HZ       LYS  31  -2.467 -15.835   1.208
  277   2HZ   LYS  31          2HZ       LYS  31  -3.645 -16.934   1.494
  278   3HZ   LYS  31          3HZ       LYS  31  -2.976 -16.816   0.010
  279    H    SER  32           H        SER  32 -10.255 -11.845  -0.273
  280    HA   SER  32           HA       SER  32  -9.156 -10.853  -2.867
  281   1HB   SER  32          1HB       SER  32 -10.546 -13.061  -2.863
  282   2HB   SER  32          2HB       SER  32 -11.939 -12.016  -2.559
  283    HG   SER  32           HG       SER  32 -10.151 -12.016  -4.792
  284    H    VAL  33           H        VAL  33 -10.169  -9.704  -0.078
  285    HA   VAL  33           HA       VAL  33 -11.639  -7.348  -1.224
  286    HB   VAL  33           HB       VAL  33 -11.579  -8.477   1.596
  287   1HG1  VAL  33          1HG1      VAL  33 -11.524  -6.025   1.783
  288   2HG1  VAL  33          2HG1      VAL  33 -12.859  -5.891   0.612
  289   3HG1  VAL  33          3HG1      VAL  33 -13.112  -6.649   2.200
  290   1HG2  VAL  33          1HG2      VAL  33 -13.878  -7.993  -0.354
  291   2HG2  VAL  33          2HG2      VAL  33 -13.158  -9.574   0.002
  292   3HG2  VAL  33          3HG2      VAL  33 -14.003  -8.691   1.277
  293    H    LEU  34           H        LEU  34  -9.051  -8.176   1.275
  294    HA   LEU  34           HA       LEU  34  -8.018  -5.471   1.102
  295   1HB   LEU  34          1HB       LEU  34  -6.607  -5.985   2.713
  296   2HB   LEU  34          2HB       LEU  34  -7.807  -7.220   3.052
  297    HG   LEU  34           HG       LEU  34  -5.314  -7.581   1.431
  298   1HD1  LEU  34          1HD1      LEU  34  -4.869  -7.052   3.852
  299   2HD1  LEU  34          2HD1      LEU  34  -5.795  -8.489   4.304
  300   3HD1  LEU  34          3HD1      LEU  34  -4.286  -8.649   3.371
  301   1HD2  LEU  34          1HD2      LEU  34  -7.081  -9.713   2.654
  302   2HD2  LEU  34          2HD2      LEU  34  -6.966  -9.320   0.922
  303   3HD2  LEU  34          3HD2      LEU  34  -5.567  -9.993   1.765
  304    H    GLN  35           H        GLN  35  -7.666  -8.254  -0.947
  305    HA   GLN  35           HA       GLN  35  -5.209  -7.494  -2.221
  306   1HB   GLN  35          1HB       GLN  35  -6.559  -9.731  -2.229
  307   2HB   GLN  35          2HB       GLN  35  -7.446  -9.017  -3.587
  308   1HG   GLN  35          1HG       GLN  35  -5.137  -8.624  -4.668
  309   2HG   GLN  35          2HG       GLN  35  -4.460  -9.600  -3.357
  310   1HE2  GLN  35          2HE2      GLN  35  -6.385 -11.742  -3.168
  311   2HE2  GLN  35          1HE2      GLN  35  -6.316 -12.585  -4.709
  312    H    LYS  36           H        LYS  36  -8.593  -6.515  -2.731
  313    HA   LYS  36           HA       LYS  36  -8.147  -5.187  -5.281
  314   1HB   LYS  36          1HB       LYS  36 -10.361  -6.112  -4.309
  315   2HB   LYS  36          2HB       LYS  36 -10.388  -4.697  -3.248
  316   1HG   LYS  36          1HG       LYS  36 -10.346  -3.236  -5.324
  317   2HG   LYS  36          2HG       LYS  36 -10.432  -4.717  -6.296
  318   1HD   LYS  36          1HD       LYS  36 -12.594  -5.289  -5.045
  319   2HD   LYS  36          2HD       LYS  36 -12.478  -3.708  -4.268
  320   1HE   LYS  36          1HE       LYS  36 -13.978  -3.383  -6.051
  321   2HE   LYS  36          2HE       LYS  36 -12.459  -2.663  -6.595
  322   1HZ   LYS  36          1HZ       LYS  36 -12.050  -4.713  -7.883
  323   2HZ   LYS  36          2HZ       LYS  36 -13.454  -5.366  -7.357
  324   3HZ   LYS  36          3HZ       LYS  36 -13.475  -4.052  -8.320
  325    H    ILE  37           H        ILE  37  -8.286  -4.076  -1.919
  326    HA   ILE  37           HA       ILE  37  -7.468  -1.306  -2.380
  327    HB   ILE  37           HB       ILE  37  -7.009  -3.310  -0.115
  328   1HG1  ILE  37          1HG1      ILE  37  -8.949  -1.021  -0.253
  329   2HG1  ILE  37          2HG1      ILE  37  -9.294  -2.754  -0.360
  330   1HG2  ILE  37          1HG2      ILE  37  -5.152  -1.791   0.064
  331   2HG2  ILE  37          2HG2      ILE  37  -6.198  -0.392  -0.234
  332   3HG2  ILE  37          3HG2      ILE  37  -6.305  -1.293   1.281
  333   1HD1  ILE  37          1HD1      ILE  37  -9.907  -2.071   1.824
  334   2HD1  ILE  37          2HD1      ILE  37  -8.416  -3.021   1.983
  335   3HD1  ILE  37          3HD1      ILE  37  -8.375  -1.240   2.096
  336    H    LEU  38           H        LEU  38  -5.429  -4.273  -1.695
  337    HA   LEU  38           HA       LEU  38  -3.055  -2.846  -2.086
  338   1HB   LEU  38          1HB       LEU  38  -3.711  -5.784  -2.342
  339   2HB   LEU  38          2HB       LEU  38  -2.073  -5.190  -2.582
  340    HG   LEU  38           HG       LEU  38  -3.676  -4.686  -0.029
  341   1HD1  LEU  38          1HD1      LEU  38  -3.194  -7.089  -0.342
  342   2HD1  LEU  38          2HD1      LEU  38  -1.472  -6.714  -0.590
  343   3HD1  LEU  38          3HD1      LEU  38  -2.245  -6.401   0.983
  344   1HD2  LEU  38          1HD2      LEU  38  -0.773  -4.204  -0.802
  345   2HD2  LEU  38          2HD2      LEU  38  -1.969  -2.991  -0.290
  346   3HD2  LEU  38          3HD2      LEU  38  -1.380  -4.166   0.865
  347    H    GLU  39           H        GLU  39  -5.020  -4.268  -4.722
  348    HA   GLU  39           HA       GLU  39  -2.986  -3.730  -6.702
  349   1HB   GLU  39          1HB       GLU  39  -4.982  -5.301  -6.902
  350   2HB   GLU  39          2HB       GLU  39  -5.994  -3.870  -7.158
  351   1HG   GLU  39          1HG       GLU  39  -4.604  -3.272  -9.143
  352   2HG   GLU  39          2HG       GLU  39  -3.575  -4.674  -8.844
  353    H    ASP  40           H        ASP  40  -5.666  -1.739  -5.441
  354    HA   ASP  40           HA       ASP  40  -5.229   0.626  -7.068
  355   1HB   ASP  40          1HB       ASP  40  -6.619  -0.210  -4.501
  356   2HB   ASP  40          2HB       ASP  40  -6.251   1.411  -4.622
  357    H    GLU  41           H        GLU  41  -3.867  -0.660  -4.094
  358    HA   GLU  41           HA       GLU  41  -2.719   1.848  -3.256
  359   1HB   GLU  41          1HB       GLU  41  -3.655  -0.202  -1.904
  360   2HB   GLU  41          2HB       GLU  41  -2.044  -0.890  -2.126
  361   1HG   GLU  41          1HG       GLU  41  -2.346   0.102   0.015
  362   2HG   GLU  41          2HG       GLU  41  -1.168   1.063  -0.923
  363    H    GLU  42           H        GLU  42  -1.383  -1.076  -4.781
  364    HA   GLU  42           HA       GLU  42   1.345  -0.183  -5.054
  365   1HB   GLU  42          1HB       GLU  42   0.377  -2.511  -5.515
  366   2HB   GLU  42          2HB       GLU  42  -0.312  -1.840  -6.995
  367   1HG   GLU  42          1HG       GLU  42   2.232  -1.105  -7.444
  368   2HG   GLU  42          2HG       GLU  42   2.578  -2.356  -6.260
  369    H    LYS  43           H        LYS  43  -1.645   0.544  -6.861
  370    HA   LYS  43           HA       LYS  43  -0.398   1.795  -9.106
  371   1HB   LYS  43          1HB       LYS  43  -3.001   1.109  -8.442
  372   2HB   LYS  43          2HB       LYS  43  -3.071   2.851  -8.287
  373   1HG   LYS  43          1HG       LYS  43  -3.675   2.377 -10.527
  374   2HG   LYS  43          2HG       LYS  43  -2.005   2.955 -10.637
  375   1HD   LYS  43          1HD       LYS  43  -1.224   0.562 -10.730
  376   2HD   LYS  43          2HD       LYS  43  -2.916   0.035 -10.638
  377   1HE   LYS  43          1HE       LYS  43  -3.398   1.273 -12.746
  378   2HE   LYS  43          2HE       LYS  43  -1.706   1.779 -12.831
  379   1HZ   LYS  43          1HZ       LYS  43  -1.083  -0.578 -12.993
  380   2HZ   LYS  43          2HZ       LYS  43  -2.650  -1.039 -12.928
  381   3HZ   LYS  43          3HZ       LYS  43  -2.103  -0.182 -14.203
  382    H    HIS  44           H        HIS  44  -1.361   3.240  -5.928
  383    HA   HIS  44           HA       HIS  44  -0.792   5.908  -6.554
  384   1HB   HIS  44          1HB       HIS  44  -0.511   4.307  -3.962
  385   2HB   HIS  44          2HB       HIS  44  -0.615   6.034  -4.139
  386    HD2  HIS  44           2HD      HIS  44  -3.071   5.246  -6.523
  387    HE1  HIS  44           1HE      HIS  44  -5.331   4.786  -2.975
  388    HE2  HIS  44           2HE      HIS  44  -5.425   4.907  -5.513
  389    H    ILE  45           H        ILE  45   1.351   3.298  -5.339
  390    HA   ILE  45           HA       ILE  45   3.715   4.860  -5.020
  391    HB   ILE  45           HB       ILE  45   3.274   1.913  -5.683
  392   1HG1  ILE  45          1HG1      ILE  45   2.191   2.511  -3.568
  393   2HG1  ILE  45          2HG1      ILE  45   3.552   1.436  -3.327
  394   1HG2  ILE  45          1HG2      ILE  45   5.522   2.379  -6.240
  395   2HG2  ILE  45          2HG2      ILE  45   5.759   3.340  -4.763
  396   3HG2  ILE  45          3HG2      ILE  45   5.530   1.571  -4.666
  397   1HD1  ILE  45          1HD1      ILE  45   4.943   3.339  -2.565
  398   2HD1  ILE  45          2HD1      ILE  45   3.568   4.444  -2.829
  399   3HD1  ILE  45          3HD1      ILE  45   3.463   3.166  -1.604
  400    H    GLU  46           H        GLU  46   2.493   3.110  -7.958
  401    HA   GLU  46           HA       GLU  46   4.733   3.695  -9.613
  402   1HB   GLU  46          1HB       GLU  46   1.776   3.253 -10.157
  403   2HB   GLU  46          2HB       GLU  46   2.904   3.588 -11.448
  404   1HG   GLU  46          1HG       GLU  46   3.250   1.274  -9.508
  405   2HG   GLU  46          2HG       GLU  46   2.375   1.157 -11.032
  406    H    TRP  47           H        TRP  47   1.827   5.680  -8.914
  407    HA   TRP  47           HA       TRP  47   2.579   7.792 -10.728
  408   1HB   TRP  47          1HB       TRP  47   0.743   7.915  -8.305
  409   2HB   TRP  47          2HB       TRP  47   0.739   8.963  -9.701
  410    HD1  TRP  47           1HD      TRP  47   0.812   6.120 -11.642
  411    HE1  TRP  47           1HE      TRP  47  -1.471   4.998 -12.041
  412    HE3  TRP  47           3HE      TRP  47  -1.799   8.246  -7.820
  413    HZ2  TRP  47           2HZ      TRP  47  -4.104   5.012 -10.814
  414    HZ3  TRP  47           3HZ      TRP  47  -4.189   7.690  -7.420
  415    HH2  TRP  47           2HH      TRP  47  -5.346   6.052  -8.911
  416    H    LEU  48           H        LEU  48   2.872   7.335  -7.200
  417    HA   LEU  48           HA       LEU  48   4.115   9.780  -6.497
  418   1HB   LEU  48          1HB       LEU  48   4.105   6.924  -5.477
  419   2HB   LEU  48          2HB       LEU  48   5.146   8.054  -4.694
  420    HG   LEU  48           HG       LEU  48   2.184   8.592  -5.051
  421   1HD1  LEU  48          1HD1      LEU  48   2.438   6.517  -3.762
  422   2HD1  LEU  48          2HD1      LEU  48   3.621   7.298  -2.698
  423   3HD1  LEU  48          3HD1      LEU  48   1.921   7.834  -2.704
  424   1HD2  LEU  48          1HD2      LEU  48   4.241   9.696  -3.077
  425   2HD2  LEU  48          2HD2      LEU  48   3.584  10.575  -4.474
  426   3HD2  LEU  48          3HD2      LEU  48   2.519  10.125  -3.135
  427    H    GLU  49           H        GLU  49   5.593   6.783  -7.730
  428    HA   GLU  49           HA       GLU  49   8.282   7.869  -7.763
  429   1HB   GLU  49          1HB       GLU  49   7.339   5.363  -8.011
  430   2HB   GLU  49          2HB       GLU  49   7.426   5.731  -9.723
  431   1HG   GLU  49          1HG       GLU  49   9.838   6.457  -9.371
  432   2HG   GLU  49          2HG       GLU  49   9.708   5.907  -7.701
  433    H    THR  50           H        THR  50   5.774   7.630 -10.352
  434    HA   THR  50           HA       THR  50   7.487   8.880 -12.295
  435    HB   THR  50           HB       THR  50   5.180   7.579 -12.555
  436    HG1  THR  50           1HG      THR  50   5.305   8.211 -14.683
  437   1HG2  THR  50          1HG2      THR  50   3.729   9.499 -11.802
  438   2HG2  THR  50          2HG2      THR  50   4.338  10.446 -13.170
  439   3HG2  THR  50          3HG2      THR  50   3.414   8.957 -13.450
  440    H    ILE  51           H        ILE  51   5.594  10.284  -9.778
  441    HA   ILE  51           HA       ILE  51   5.941  13.028 -10.735
  442    HB   ILE  51           HB       ILE  51   4.660  11.745  -8.307
  443   1HG1  ILE  51          1HG1      ILE  51   3.425  11.611 -10.472
  444   2HG1  ILE  51          2HG1      ILE  51   2.564  12.472  -9.216
  445   1HG2  ILE  51          1HG2      ILE  51   5.426  13.779  -7.363
  446   2HG2  ILE  51          2HG2      ILE  51   4.905  14.731  -8.770
  447   3HG2  ILE  51          3HG2      ILE  51   3.708  13.975  -7.691
  448   1HD1  ILE  51          1HD1      ILE  51   3.099  14.632 -10.300
  449   2HD1  ILE  51          2HD1      ILE  51   4.044  13.779 -11.546
  450   3HD1  ILE  51          3HD1      ILE  51   2.298  13.525 -11.421
  451    H    ASN  52           H        ASN  52   7.889  10.922  -9.018
  452    HA   ASN  52           HA       ASN  52   9.382  12.861  -7.437
  453   1HB   ASN  52          1HB       ASN  52   9.377  10.383  -6.999
  454   2HB   ASN  52          2HB       ASN  52  10.269  10.155  -8.506
  455   1HD2  ASN  52          2HD2      ASN  52  12.193   9.340  -7.635
  456   2HD2  ASN  52          1HD2      ASN  52  13.211  10.308  -6.578
  457    H    GLY  53           H        GLY  53  11.484  13.671  -7.837
  458   1HA   GLY  53          1HA       GLY  53  13.171  14.725  -9.003
  459   2HA   GLY  53          2HA       GLY  53  12.994  13.482 -10.239
  460   1H    MET   1          1H        MET   1  -5.978 -10.637  18.703
  461   2H    MET   1          2H        MET   1  -5.105 -10.259  17.372
  462   3H    MET   1          3H        MET   1  -5.780 -11.741  17.512
  463    HA   MET   1           HA       MET   1  -7.061 -10.425  15.965
  464   1HB   MET   1          1HB       MET   1  -8.166 -12.151  17.337
  465   2HB   MET   1          2HB       MET   1  -8.499 -10.964  18.596
  466   1HG   MET   1          1HG       MET   1  -9.991  -9.737  17.074
  467   2HG   MET   1          2HG       MET   1  -9.528 -10.790  15.736
  468   1HE   MET   1          1HE       MET   1 -10.388 -11.955  19.518
  469   2HE   MET   1          2HE       MET   1 -11.402 -10.530  19.189
  470   3HE   MET   1          3HE       MET   1 -12.142 -12.137  19.348
  471    H    ASP   2           H        ASP   2  -5.928  -8.337  15.837
  472    HA   ASP   2           HA       ASP   2  -7.487  -6.093  16.860
  473   1HB   ASP   2          1HB       ASP   2  -6.056  -6.728  18.821
  474   2HB   ASP   2          2HB       ASP   2  -4.623  -6.488  17.832
  475    H    TYR   3           H        TYR   3  -7.378  -6.521  14.295
  476    HA   TYR   3           HA       TYR   3  -5.423  -4.623  13.152
  477   1HB   TYR   3          1HB       TYR   3  -4.428  -6.027  11.652
  478   2HB   TYR   3          2HB       TYR   3  -4.413  -6.944  13.135
  479    HD1  TYR   3           1HD      TYR   3  -4.918  -7.139   9.706
  480    HD2  TYR   3           2HD      TYR   3  -6.625  -8.598  13.387
  481    HE1  TYR   3           1HE      TYR   3  -6.046  -8.954   8.453
  482    HE2  TYR   3           2HE      TYR   3  -7.769 -10.419  12.124
  483    HH   TYR   3           HH       TYR   3  -7.504 -10.710   8.567
  484    H    LEU   4           H        LEU   4  -7.490  -3.552  13.406
  485    HA   LEU   4           HA       LEU   4  -8.660  -3.330  10.710
  486   1HB   LEU   4          1HB       LEU   4 -10.972  -3.099  11.617
  487   2HB   LEU   4          2HB       LEU   4 -10.271  -4.696  11.608
  488    HG   LEU   4           HG       LEU   4  -9.640  -3.847  14.179
  489   1HD1  LEU   4          1HD1      LEU   4 -11.598  -2.931  15.199
  490   2HD1  LEU   4          2HD1      LEU   4 -11.180  -1.846  13.864
  491   3HD1  LEU   4          3HD1      LEU   4 -12.511  -3.011  13.682
  492   1HD2  LEU   4          1HD2      LEU   4 -12.109  -5.371  13.268
  493   2HD2  LEU   4          2HD2      LEU   4 -10.495  -6.062  13.545
  494   3HD2  LEU   4          3HD2      LEU   4 -11.411  -5.389  14.905
  495    H    ARG   5           H        ARG   5  -8.943  -1.706  13.940
  496    HA   ARG   5           HA       ARG   5  -9.165   0.900  12.740
  497   1HB   ARG   5          1HB       ARG   5  -9.966   0.269  14.995
  498   2HB   ARG   5          2HB       ARG   5  -8.301   0.145  15.571
  499   1HG   ARG   5          1HG       ARG   5  -8.020   2.438  15.663
  500   2HG   ARG   5          2HG       ARG   5  -9.024   2.732  14.241
  501   1HD   ARG   5          1HD       ARG   5 -10.103   3.667  16.195
  502   2HD   ARG   5          2HD       ARG   5 -11.061   2.354  15.498
  503    HE   ARG   5           HE       ARG   5  -9.274   1.603  17.732
  504   1HH1  ARG   5          1HH2      ARG   5 -12.544   2.561  16.902
  505   2HH1  ARG   5          2HH2      ARG   5 -13.203   1.933  18.388
  506   1HH2  ARG   5          1HH1      ARG   5 -10.189   0.831  19.615
  507   2HH2  ARG   5          2HH1      ARG   5 -11.900   0.993  19.878
  508    H    GLU   6           H        GLU   6  -6.364  -0.917  13.877
  509    HA   GLU   6           HA       GLU   6  -4.364   1.056  13.498
  510   1HB   GLU   6          1HB       GLU   6  -4.225  -1.246  14.618
  511   2HB   GLU   6          2HB       GLU   6  -4.030  -1.939  13.013
  512   1HG   GLU   6          1HG       GLU   6  -1.957  -0.740  12.657
  513   2HG   GLU   6          2HG       GLU   6  -2.250   0.318  14.036
  514    H    LEU   7           H        LEU   7  -5.860  -1.144  11.159
  515    HA   LEU   7           HA       LEU   7  -4.089  -0.550   8.929
  516   1HB   LEU   7          1HB       LEU   7  -6.969  -1.538   8.792
  517   2HB   LEU   7          2HB       LEU   7  -5.710  -1.699   7.579
  518    HG   LEU   7           HG       LEU   7  -6.039  -3.175  10.195
  519   1HD1  LEU   7          1HD1      LEU   7  -7.205  -4.002   8.167
  520   2HD1  LEU   7          2HD1      LEU   7  -5.644  -4.106   7.318
  521   3HD1  LEU   7          3HD1      LEU   7  -5.971  -5.140   8.724
  522   1HD2  LEU   7          1HD2      LEU   7  -3.562  -3.227   8.448
  523   2HD2  LEU   7          2HD2      LEU   7  -3.662  -2.678  10.142
  524   3HD2  LEU   7          3HD2      LEU   7  -3.942  -4.376   9.758
  525    H    TYR   8           H        TYR   8  -7.343   0.497   9.726
  526    HA   TYR   8           HA       TYR   8  -7.871   2.345   7.637
  527   1HB   TYR   8          1HB       TYR   8  -9.115   1.165   9.842
  528   2HB   TYR   8          2HB       TYR   8  -8.892   2.743  10.484
  529    HD1  TYR   8           1HD      TYR   8 -11.412   1.019   9.899
  530    HD2  TYR   8           2HD      TYR   8  -9.554   4.368   7.910
  531    HE1  TYR   8           1HE      TYR   8 -13.642   1.810   9.150
  532    HE2  TYR   8           2HE      TYR   8 -11.799   5.155   7.178
  533    HH   TYR   8           HH       TYR   8 -14.802   3.497   8.083
  534    H    LYS   9           H        LYS   9  -6.460   2.982  10.881
  535    HA   LYS   9           HA       LYS   9  -6.614   5.805  10.591
  536   1HB   LYS   9          1HB       LYS   9  -6.273   4.542  12.766
  537   2HB   LYS   9          2HB       LYS   9  -4.607   4.207  12.279
  538   1HG   LYS   9          1HG       LYS   9  -4.193   6.708  12.221
  539   2HG   LYS   9          2HG       LYS   9  -5.851   6.944  12.809
  540   1HD   LYS   9          1HD       LYS   9  -5.254   5.563  14.849
  541   2HD   LYS   9          2HD       LYS   9  -3.611   5.419  14.217
  542   1HE   LYS   9          1HE       LYS   9  -3.496   7.149  15.814
  543   2HE   LYS   9          2HE       LYS   9  -3.446   7.950  14.242
  544   1HZ   LYS   9          1HZ       LYS   9  -5.829   8.460  14.523
  545   2HZ   LYS   9          2HZ       LYS   9  -5.857   7.700  15.972
  546   3HZ   LYS   9          3HZ       LYS   9  -4.976   9.055  15.779
  547    H    LEU  10           H        LEU  10  -3.626   3.892  10.103
  548    HA   LEU  10           HA       LEU  10  -2.225   5.961   8.895
  549   1HB   LEU  10          1HB       LEU  10  -2.004   2.937   8.666
  550   2HB   LEU  10          2HB       LEU  10  -0.891   4.050   7.870
  551    HG   LEU  10           HG       LEU  10  -0.900   5.158  10.363
  552   1HD1  LEU  10          1HD1      LEU  10  -2.285   3.555  11.478
  553   2HD1  LEU  10          2HD1      LEU  10  -1.287   2.219  10.893
  554   3HD1  LEU  10          3HD1      LEU  10  -0.630   3.387  12.056
  555   1HD2  LEU  10          1HD2      LEU  10   0.859   2.827   9.497
  556   2HD2  LEU  10          2HD2      LEU  10   1.103   4.541   9.078
  557   3HD2  LEU  10          3HD2      LEU  10   1.250   4.019  10.759
  558    H    GLU  11           H        GLU  11  -4.506   3.688   7.348
  559    HA   GLU  11           HA       GLU  11  -4.289   4.711   4.700
  560   1HB   GLU  11          1HB       GLU  11  -6.091   3.020   6.311
  561   2HB   GLU  11          2HB       GLU  11  -6.985   3.774   5.101
  562   1HG   GLU  11          1HG       GLU  11  -4.380   2.175   4.695
  563   2HG   GLU  11          2HG       GLU  11  -5.981   1.488   4.589
  564    H    GLN  12           H        GLN  12  -6.215   6.130   7.472
  565    HA   GLN  12           HA       GLN  12  -7.114   8.266   5.684
  566   1HB   GLN  12          1HB       GLN  12  -7.516   7.572   8.600
  567   2HB   GLN  12          2HB       GLN  12  -8.101   9.088   7.881
  568   1HG   GLN  12          1HG       GLN  12  -9.271   7.826   6.136
  569   2HG   GLN  12          2HG       GLN  12  -8.798   6.313   6.878
  570   1HE2  GLN  12          2HE2      GLN  12 -11.488   8.123   6.561
  571   2HE2  GLN  12          1HE2      GLN  12 -12.202   7.892   8.149
  572    H    GLN  13           H        GLN  13  -4.469   7.807   7.806
  573    HA   GLN  13           HA       GLN  13  -3.795  10.579   8.296
  574   1HB   GLN  13          1HB       GLN  13  -3.033   8.604   9.656
  575   2HB   GLN  13          2HB       GLN  13  -2.078   8.041   8.261
  576   1HG   GLN  13          1HG       GLN  13  -0.770  10.067   8.299
  577   2HG   GLN  13          2HG       GLN  13  -1.781  10.716   9.612
  578   1HE2  GLN  13          2HE2      GLN  13   0.651  10.914  10.441
  579   2HE2  GLN  13          1HE2      GLN  13   1.191   9.542  11.397
  580    H    ALA  14           H        ALA  14  -2.887   8.241   5.723
  581    HA   ALA  14           HA       ALA  14  -1.317  10.179   4.207
  582   1HB   ALA  14          1HB       ALA  14  -1.210   7.733   3.796
  583   2HB   ALA  14          2HB       ALA  14  -2.927   7.725   3.329
  584   3HB   ALA  14          3HB       ALA  14  -1.737   8.607   2.345
  585    H    MET  15           H        MET  15  -4.797   9.401   4.491
  586    HA   MET  15           HA       MET  15  -5.612  11.098   2.328
  587   1HB   MET  15          1HB       MET  15  -7.076   9.364   3.320
  588   2HB   MET  15          2HB       MET  15  -7.288  10.333   4.766
  589   1HG   MET  15          1HG       MET  15  -8.699  11.818   3.841
  590   2HG   MET  15          2HG       MET  15  -7.861  11.837   2.294
  591   1HE   MET  15          1HE       MET  15  -9.079   9.102   0.220
  592   2HE   MET  15          2HE       MET  15  -7.699  10.079   0.776
  593   3HE   MET  15          3HE       MET  15  -8.021   8.526   1.540
  594    H    LYS  16           H        LYS  16  -5.443  11.910   5.850
  595    HA   LYS  16           HA       LYS  16  -6.205  14.667   5.517
  596   1HB   LYS  16          1HB       LYS  16  -4.607  13.148   7.592
  597   2HB   LYS  16          2HB       LYS  16  -4.707  14.918   7.630
  598   1HG   LYS  16          1HG       LYS  16  -7.235  14.722   7.522
  599   2HG   LYS  16          2HG       LYS  16  -7.059  12.977   7.776
  600   1HD   LYS  16          1HD       LYS  16  -6.005  13.372   9.956
  601   2HD   LYS  16          2HD       LYS  16  -5.963  15.125   9.651
  602   1HE   LYS  16          1HE       LYS  16  -8.460  15.131   9.484
  603   2HE   LYS  16          2HE       LYS  16  -8.476  13.417   9.915
  604   1HZ   LYS  16          1HZ       LYS  16  -7.439  14.022  12.046
  605   2HZ   LYS  16          2HZ       LYS  16  -7.418  15.604  11.635
  606   3HZ   LYS  16          3HZ       LYS  16  -8.839  14.840  11.859
  607    H    LEU  17           H        LEU  17  -2.985  13.121   5.376
  608    HA   LEU  17           HA       LEU  17  -1.506  15.452   4.693
  609   1HB   LEU  17          1HB       LEU  17  -1.261  12.495   4.444
  610   2HB   LEU  17          2HB       LEU  17  -0.338  13.355   3.268
  611    HG   LEU  17           HG       LEU  17  -0.195  13.858   6.277
  612   1HD1  LEU  17          1HD1      LEU  17   0.540  11.591   5.640
  613   2HD1  LEU  17          2HD1      LEU  17   1.668  12.284   4.452
  614   3HD1  LEU  17          3HD1      LEU  17   1.898  12.588   6.194
  615   1HD2  LEU  17          1HD2      LEU  17   1.637  14.760   4.002
  616   2HD2  LEU  17          2HD2      LEU  17   0.602  15.816   4.986
  617   3HD2  LEU  17          3HD2      LEU  17   1.962  14.978   5.735
  618    H    TYR  18           H        TYR  18  -3.245  13.207   2.506
  619    HA   TYR  18           HA       TYR  18  -2.780  14.598   0.097
  620   1HB   TYR  18          1HB       TYR  18  -4.651  12.481   1.069
  621   2HB   TYR  18          2HB       TYR  18  -5.100  13.267  -0.394
  622    HD1  TYR  18           1HD      TYR  18  -3.084  13.574  -2.154
  623    HD2  TYR  18           2HD      TYR  18  -3.342  10.488   0.825
  624    HE1  TYR  18           1HE      TYR  18  -1.321  12.277  -3.342
  625    HE2  TYR  18           2HE      TYR  18  -1.491   9.242  -0.275
  626    HH   TYR  18           HH       TYR  18  -0.061   9.171  -2.052
  627    H    ARG  19           H        ARG  19  -5.444  15.151   2.457
  628    HA   ARG  19           HA       ARG  19  -6.802  17.178   0.917
  629   1HB   ARG  19          1HB       ARG  19  -6.632  16.538   3.876
  630   2HB   ARG  19          2HB       ARG  19  -7.269  18.091   3.366
  631   1HG   ARG  19          1HG       ARG  19  -8.895  16.817   1.841
  632   2HG   ARG  19          2HG       ARG  19  -8.378  15.350   2.687
  633   1HD   ARG  19          1HD       ARG  19 -10.404  16.186   3.733
  634   2HD   ARG  19          2HD       ARG  19  -9.051  16.413   4.854
  635    HE   ARG  19           HE       ARG  19  -9.692  18.718   3.116
  636   1HH1  ARG  19          1HH2      ARG  19 -10.375  17.334   6.263
  637   2HH1  ARG  19          2HH2      ARG  19 -10.779  18.884   6.949
  638   1HH2  ARG  19          1HH1      ARG  19 -10.203  20.654   4.063
  639   2HH2  ARG  19          2HH1      ARG  19 -10.695  20.704   5.728
  640    H    GLU  20           H        GLU  20  -4.070  17.530   3.222
  641    HA   GLU  20           HA       GLU  20  -4.008  20.428   2.839
  642   1HB   GLU  20          1HB       GLU  20  -3.121  18.711   4.767
  643   2HB   GLU  20          2HB       GLU  20  -1.618  18.971   3.909
  644   1HG   GLU  20          1HG       GLU  20  -1.906  21.441   4.139
  645   2HG   GLU  20          2HG       GLU  20  -3.441  21.187   4.970
  646    H    ALA  21           H        ALA  21  -2.126  17.723   1.596
  647    HA   ALA  21           HA       ALA  21  -0.366  19.113  -0.146
  648   1HB   ALA  21          1HB       ALA  21  -0.247  16.687   0.239
  649   2HB   ALA  21          2HB       ALA  21  -1.805  16.469  -0.598
  650   3HB   ALA  21          3HB       ALA  21  -0.394  17.049  -1.494
  651    H    SER  22           H        SER  22  -3.847  18.272  -0.664
  652    HA   SER  22           HA       SER  22  -4.120  19.272  -3.272
  653   1HB   SER  22          1HB       SER  22  -5.836  18.026  -1.856
  654   2HB   SER  22          2HB       SER  22  -6.262  19.610  -1.178
  655    HG   SER  22           HG       SER  22  -6.445  18.721  -3.870
  656    H    GLU  23           H        GLU  23  -3.980  21.206  -0.247
  657    HA   GLU  23           HA       GLU  23  -4.853  23.699  -1.442
  658   1HB   GLU  23          1HB       GLU  23  -4.557  22.945   1.069
  659   2HB   GLU  23          2HB       GLU  23  -2.891  23.429   0.854
  660   1HG   GLU  23          1HG       GLU  23  -4.037  25.268   1.850
  661   2HG   GLU  23          2HG       GLU  23  -3.634  25.726   0.202
  662    H    LYS  24           H        LYS  24  -1.668  22.179  -1.038
  663    HA   LYS  24           HA       LYS  24  -0.117  24.297  -2.391
  664   1HB   LYS  24          1HB       LYS  24   0.479  21.415  -1.588
  665   2HB   LYS  24          2HB       LYS  24   1.521  22.281  -2.703
  666   1HG   LYS  24          1HG       LYS  24   2.558  22.549  -0.670
  667   2HG   LYS  24          2HG       LYS  24   1.794  24.106  -0.984
  668   1HD   LYS  24          1HD       LYS  24  -0.012  23.539   0.633
  669   2HD   LYS  24          2HD       LYS  24   0.716  21.931   0.876
  670   1HE   LYS  24          1HE       LYS  24   2.843  23.059   1.612
  671   2HE   LYS  24          2HE       LYS  24   2.036  24.624   1.464
  672   1HZ   LYS  24          1HZ       LYS  24   0.457  23.882   3.180
  673   2HZ   LYS  24          2HZ       LYS  24   1.230  22.444   3.322
  674   3HZ   LYS  24          3HZ       LYS  24   1.986  23.824   3.747
  675    H    ALA  25           H        ALA  25  -1.432  21.159  -3.387
  676    HA   ALA  25           HA       ALA  25  -0.660  21.335  -6.149
  677   1HB   ALA  25          1HB       ALA  25  -2.535  19.481  -4.634
  678   2HB   ALA  25          2HB       ALA  25  -1.969  19.205  -6.272
  679   3HB   ALA  25          3HB       ALA  25  -0.804  19.221  -4.934
  680    H    ARG  26           H        ARG  26  -2.559  23.461  -5.072
  681    HA   ARG  26           HA       ARG  26  -5.076  23.644  -6.306
  682   1HB   ARG  26          1HB       ARG  26  -4.716  26.009  -6.033
  683   2HB   ARG  26          2HB       ARG  26  -3.910  25.186  -4.714
  684   1HG   ARG  26          1HG       ARG  26  -1.846  25.281  -6.565
  685   2HG   ARG  26          2HG       ARG  26  -2.717  26.740  -7.011
  686   1HD   ARG  26          1HD       ARG  26  -1.906  26.059  -4.170
  687   2HD   ARG  26          2HD       ARG  26  -0.779  26.765  -5.312
  688    HE   ARG  26           HE       ARG  26  -2.128  28.761  -5.475
  689   1HH1  ARG  26          1HH2      ARG  26  -3.045  26.723  -2.746
  690   2HH1  ARG  26          2HH2      ARG  26  -3.788  28.067  -1.917
  691   1HH2  ARG  26          1HH1      ARG  26  -3.041  30.395  -4.341
  692   2HH2  ARG  26          2HH1      ARG  26  -3.755  30.099  -2.784
  693    H    ASN  27           H        ASN  27  -1.977  23.641  -7.980
  694    HA   ASN  27           HA       ASN  27  -2.944  24.766 -10.464
  695   1HB   ASN  27          1HB       ASN  27  -0.545  24.732  -9.685
  696   2HB   ASN  27          2HB       ASN  27  -0.519  22.985  -9.929
  697   1HD2  ASN  27          2HD2      ASN  27   0.184  22.341 -11.973
  698   2HD2  ASN  27          1HD2      ASN  27   0.176  23.397 -13.376
  699    HA   PRO  28           HA       PRO  28  -5.540  21.407 -11.264
  700   1HB   PRO  28          1HB       PRO  28  -6.095  21.589 -13.968
  701   2HB   PRO  28          2HB       PRO  28  -6.724  22.691 -12.708
  702   1HG   PRO  28          1HG       PRO  28  -4.318  23.094 -14.502
  703   2HG   PRO  28          2HG       PRO  28  -5.634  24.255 -14.131
  704   1HD   PRO  28          1HD       PRO  28  -3.259  24.357 -12.845
  705   2HD   PRO  28          2HD       PRO  28  -4.785  24.654 -11.954
  706    H    GLU  29           H        GLU  29  -2.646  21.446 -13.264
  707    HA   GLU  29           HA       GLU  29  -2.682  18.842 -14.330
  708   1HB   GLU  29          1HB       GLU  29  -1.021  20.816 -14.672
  709   2HB   GLU  29          2HB       GLU  29  -0.201  20.222 -13.246
  710   1HG   GLU  29          1HG       GLU  29   0.974  19.290 -15.055
  711   2HG   GLU  29          2HG       GLU  29   0.016  17.959 -14.424
  712    H    LYS  30           H        LYS  30  -1.382  19.888 -11.243
  713    HA   LYS  30           HA       LYS  30  -0.914  17.147 -10.235
  714   1HB   LYS  30          1HB       LYS  30  -0.350  19.921  -9.207
  715   2HB   LYS  30          2HB       LYS  30  -0.801  18.733  -8.013
  716   1HG   LYS  30          1HG       LYS  30   1.273  18.102  -7.865
  717   2HG   LYS  30          2HG       LYS  30   1.092  17.284  -9.401
  718   1HD   LYS  30          1HD       LYS  30   2.092  20.145  -9.015
  719   2HD   LYS  30          2HD       LYS  30   3.114  18.718  -9.217
  720   1HE   LYS  30          1HE       LYS  30   2.099  18.307 -11.456
  721   2HE   LYS  30          2HE       LYS  30   1.138  19.780 -11.277
  722   1HZ   LYS  30          1HZ       LYS  30   3.248  21.034 -11.122
  723   2HZ   LYS  30          2HZ       LYS  30   4.113  19.664 -11.304
  724   3HZ   LYS  30          3HZ       LYS  30   3.189  20.207 -12.530
  725    H    LYS  31           H        LYS  31  -3.384  19.681  -9.686
  726    HA   LYS  31           HA       LYS  31  -4.810  18.270  -7.740
  727   1HB   LYS  31          1HB       LYS  31  -5.208  20.661  -8.611
  728   2HB   LYS  31          2HB       LYS  31  -6.264  19.921  -9.815
  729   1HG   LYS  31          1HG       LYS  31  -7.782  19.129  -8.183
  730   2HG   LYS  31          2HG       LYS  31  -6.593  19.231  -6.875
  731   1HD   LYS  31          1HD       LYS  31  -6.654  21.672  -6.922
  732   2HD   LYS  31          2HD       LYS  31  -7.832  21.645  -8.258
  733   1HE   LYS  31          1HE       LYS  31  -9.463  20.479  -6.855
  734   2HE   LYS  31          2HE       LYS  31  -8.281  20.297  -5.552
  735   1HZ   LYS  31          1HZ       LYS  31  -8.278  22.696  -5.268
  736   2HZ   LYS  31          2HZ       LYS  31  -9.320  22.910  -6.513
  737   3HZ   LYS  31          3HZ       LYS  31  -9.809  22.152  -5.153
  738    H    SER  32           H        SER  32  -4.896  17.743 -11.179
  739    HA   SER  32           HA       SER  32  -6.938  15.634 -10.934
  740   1HB   SER  32          1HB       SER  32  -5.331  16.454 -13.397
  741   2HB   SER  32          2HB       SER  32  -6.821  15.495 -13.369
  742    HG   SER  32           HG       SER  32  -6.447  18.243 -12.789
  743    H    VAL  33           H        VAL  33  -3.801  15.528 -10.188
  744    HA   VAL  33           HA       VAL  33  -3.457  12.664 -11.045
  745    HB   VAL  33           HB       VAL  33  -1.420  14.774 -10.281
  746   1HG1  VAL  33          1HG1      VAL  33  -0.689  12.751  -9.113
  747   2HG1  VAL  33          2HG1      VAL  33  -0.970  11.771 -10.573
  748   3HG1  VAL  33          3HG1      VAL  33   0.311  13.003 -10.541
  749   1HG2  VAL  33          1HG2      VAL  33  -1.658  12.919 -12.697
  750   2HG2  VAL  33          2HG2      VAL  33  -2.200  14.605 -12.673
  751   3HG2  VAL  33          3HG2      VAL  33  -0.482  14.234 -12.470
  752    H    LEU  34           H        LEU  34  -3.045  14.851  -8.102
  753    HA   LEU  34           HA       LEU  34  -3.007  12.479  -6.430
  754   1HB   LEU  34          1HB       LEU  34  -2.469  13.759  -4.742
  755   2HB   LEU  34          2HB       LEU  34  -1.927  14.829  -6.022
  756    HG   LEU  34           HG       LEU  34  -4.584  14.946  -4.637
  757   1HD1  LEU  34          1HD1      LEU  34  -2.631  15.470  -3.083
  758   2HD1  LEU  34          2HD1      LEU  34  -2.178  16.783  -4.171
  759   3HD1  LEU  34          3HD1      LEU  34  -3.730  16.831  -3.304
  760   1HD2  LEU  34          1HD2      LEU  34  -3.225  17.056  -6.333
  761   2HD2  LEU  34          2HD2      LEU  34  -4.635  16.080  -6.802
  762   3HD2  LEU  34          3HD2      LEU  34  -4.776  17.250  -5.485
  763    H    GLN  35           H        GLN  35  -5.668  14.261  -7.872
  764    HA   GLN  35           HA       GLN  35  -7.673  13.448  -6.035
  765   1HB   GLN  35          1HB       GLN  35  -8.094  15.143  -7.670
  766   2HB   GLN  35          2HB       GLN  35  -7.861  14.001  -9.014
  767   1HG   GLN  35          1HG       GLN  35  -9.850  12.735  -8.236
  768   2HG   GLN  35          2HG       GLN  35 -10.061  13.856  -6.890
  769   1HE2  GLN  35          2HE2      GLN  35 -11.885  13.127  -9.130
  770   2HE2  GLN  35          1HE2      GLN  35 -12.261  14.669  -9.921
  771    H    LYS  36           H        LYS  36  -6.107  11.621  -8.696
  772    HA   LYS  36           HA       LYS  36  -8.028   9.456  -8.754
  773   1HB   LYS  36          1HB       LYS  36  -5.031   9.569  -9.437
  774   2HB   LYS  36          2HB       LYS  36  -6.036   8.177  -9.784
  775   1HG   LYS  36          1HG       LYS  36  -6.629  10.925 -10.962
  776   2HG   LYS  36          2HG       LYS  36  -5.512   9.770 -11.696
  777   1HD   LYS  36          1HD       LYS  36  -7.351   8.059 -11.746
  778   2HD   LYS  36          2HD       LYS  36  -8.484   9.313 -11.193
  779   1HE   LYS  36          1HE       LYS  36  -7.979  10.675 -13.183
  780   2HE   LYS  36          2HE       LYS  36  -6.733   9.526 -13.687
  781   1HZ   LYS  36          1HZ       LYS  36  -8.470   7.845 -13.968
  782   2HZ   LYS  36          2HZ       LYS  36  -9.632   8.900 -13.509
  783   3HZ   LYS  36          3HZ       LYS  36  -8.800   9.147 -14.891
  784    H    ILE  37           H        ILE  37  -5.017   9.860  -6.941
  785    HA   ILE  37           HA       ILE  37  -5.237   7.362  -5.447
  786    HB   ILE  37           HB       ILE  37  -3.870  10.021  -4.841
  787   1HG1  ILE  37          1HG1      ILE  37  -2.684   7.499  -5.984
  788   2HG1  ILE  37          2HG1      ILE  37  -2.967   9.038  -6.817
  789   1HG2  ILE  37          1HG2      ILE  37  -4.216   8.859  -2.722
  790   2HG2  ILE  37          2HG2      ILE  37  -3.666   7.326  -3.433
  791   3HG2  ILE  37          3HG2      ILE  37  -2.530   8.645  -3.149
  792   1HD1  ILE  37          1HD1      ILE  37  -0.656   8.951  -6.354
  793   2HD1  ILE  37          2HD1      ILE  37  -1.350  10.126  -5.221
  794   3HD1  ILE  37          3HD1      ILE  37  -0.911   8.483  -4.673
  795    H    LEU  38           H        LEU  38  -6.300  10.779  -4.683
  796    HA   LEU  38           HA       LEU  38  -7.551  10.161  -2.241
  797   1HB   LEU  38          1HB       LEU  38  -7.960  12.231  -4.363
  798   2HB   LEU  38          2HB       LEU  38  -9.226  12.076  -3.169
  799    HG   LEU  38           HG       LEU  38  -6.327  12.391  -2.319
  800   1HD1  LEU  38          1HD1      LEU  38  -6.855  14.302  -3.778
  801   2HD1  LEU  38          2HD1      LEU  38  -8.346  14.611  -2.861
  802   3HD1  LEU  38          3HD1      LEU  38  -6.757  14.811  -2.086
  803   1HD2  LEU  38          1HD2      LEU  38  -9.002  13.081  -0.999
  804   2HD2  LEU  38          2HD2      LEU  38  -8.003  11.674  -0.618
  805   3HD2  LEU  38          3HD2      LEU  38  -7.403  13.301  -0.266
  806    H    GLU  39           H        GLU  39  -9.023   9.708  -5.556
  807    HA   GLU  39           HA       GLU  39 -11.499   8.805  -4.331
  808   1HB   GLU  39          1HB       GLU  39 -10.388   8.682  -7.172
  809   2HB   GLU  39          2HB       GLU  39 -11.944   7.970  -6.727
  810   1HG   GLU  39          1HG       GLU  39 -12.752  10.167  -5.925
  811   2HG   GLU  39          2HG       GLU  39 -11.213  10.906  -6.367
  812    H    ASP  40           H        ASP  40  -8.647   7.036  -5.524
  813    HA   ASP  40           HA       ASP  40  -9.658   4.378  -5.121
  814   1HB   ASP  40          1HB       ASP  40  -6.982   5.835  -5.250
  815   2HB   ASP  40          2HB       ASP  40  -7.007   4.226  -4.740
  816    H    GLU  41           H        GLU  41  -8.108   6.762  -2.933
  817    HA   GLU  41           HA       GLU  41  -7.807   4.760  -0.793
  818   1HB   GLU  41          1HB       GLU  41  -7.495   7.772  -0.743
  819   2HB   GLU  41          2HB       GLU  41  -7.190   6.708   0.634
  820   1HG   GLU  41          1HG       GLU  41  -5.527   6.929  -1.898
  821   2HG   GLU  41          2HG       GLU  41  -5.124   7.511  -0.309
  822    H    GLU  42           H        GLU  42 -10.128   7.378  -1.562
  823    HA   GLU  42           HA       GLU  42 -11.786   7.027   0.748
  824   1HB   GLU  42          1HB       GLU  42 -11.927   8.887  -0.970
  825   2HB   GLU  42          2HB       GLU  42 -12.733   7.739  -2.053
  826   1HG   GLU  42          1HG       GLU  42 -14.487   7.401  -0.255
  827   2HG   GLU  42          2HG       GLU  42 -13.675   8.631   0.713
  828    H    LYS  43           H        LYS  43 -11.645   5.240  -2.336
  829    HA   LYS  43           HA       LYS  43 -13.842   3.463  -1.824
  830   1HB   LYS  43          1HB       LYS  43 -12.009   3.875  -3.924
  831   2HB   LYS  43          2HB       LYS  43 -11.593   2.285  -3.359
  832   1HG   LYS  43          1HG       LYS  43 -13.191   2.051  -5.098
  833   2HG   LYS  43          2HG       LYS  43 -14.072   1.682  -3.609
  834   1HD   LYS  43          1HD       LYS  43 -15.115   3.883  -3.600
  835   2HD   LYS  43          2HD       LYS  43 -14.104   4.442  -4.932
  836   1HE   LYS  43          1HE       LYS  43 -16.078   2.124  -5.158
  837   2HE   LYS  43          2HE       LYS  43 -16.509   3.804  -5.492
  838   1HZ   LYS  43          1HZ       LYS  43 -14.808   3.848  -7.229
  839   2HZ   LYS  43          2HZ       LYS  43 -14.411   2.286  -6.950
  840   3HZ   LYS  43          3HZ       LYS  43 -15.887   2.665  -7.527
  841    H    HIS  44           H        HIS  44 -10.304   3.095  -0.932
  842    HA   HIS  44           HA       HIS  44 -10.575   0.586   0.284
  843   1HB   HIS  44          1HB       HIS  44  -8.737   2.950   0.913
  844   2HB   HIS  44          2HB       HIS  44  -8.539   1.288   1.362
  845    HD2  HIS  44           2HD      HIS  44  -9.627   0.765  -1.957
  846    HE1  HIS  44           1HE      HIS  44  -5.529   1.552  -2.624
  847    HE2  HIS  44           2HE      HIS  44  -7.693   0.805  -3.681
  848    H    ILE  45           H        ILE  45 -10.988   3.891   1.611
  849    HA   ILE  45           HA       ILE  45 -11.552   3.082   4.318
  850    HB   ILE  45           HB       ILE  45 -11.821   5.581   2.658
  851   1HG1  ILE  45          1HG1      ILE  45 -10.717   6.510   4.793
  852   2HG1  ILE  45          2HG1      ILE  45 -10.567   4.840   5.329
  853   1HG2  ILE  45          1HG2      ILE  45 -13.993   5.639   3.712
  854   2HG2  ILE  45          2HG2      ILE  45 -13.278   5.268   5.301
  855   3HG2  ILE  45          3HG2      ILE  45 -12.939   6.812   4.482
  856   1HD1  ILE  45          1HD1      ILE  45  -9.146   4.376   3.310
  857   2HD1  ILE  45          2HD1      ILE  45  -9.275   6.113   2.900
  858   3HD1  ILE  45          3HD1      ILE  45  -8.485   5.611   4.395
  859    H    GLU  46           H        GLU  46 -13.798   3.624   1.536
  860    HA   GLU  46           HA       GLU  46 -16.219   3.102   2.898
  861   1HB   GLU  46          1HB       GLU  46 -15.232   2.821   0.073
  862   2HB   GLU  46          2HB       GLU  46 -16.691   1.946   0.480
  863   1HG   GLU  46          1HG       GLU  46 -16.336   4.919   0.976
  864   2HG   GLU  46          2HG       GLU  46 -17.002   4.235  -0.508
  865    H    TRP  47           H        TRP  47 -13.941   0.729   1.466
  866    HA   TRP  47           HA       TRP  47 -15.569  -1.536   2.204
  867   1HB   TRP  47          1HB       TRP  47 -12.617  -1.427   1.501
  868   2HB   TRP  47          2HB       TRP  47 -13.685  -2.799   1.375
  869    HD1  TRP  47           1HD      TRP  47 -15.957  -0.833  -0.296
  870    HE1  TRP  47           1HE      TRP  47 -15.442  -0.328  -2.763
  871    HE3  TRP  47           3HE      TRP  47 -11.012  -2.043  -0.358
  872    HZ2  TRP  47           2HZ      TRP  47 -13.189  -0.592  -4.582
  873    HZ3  TRP  47           3HZ      TRP  47  -9.675  -1.932  -2.451
  874    HH2  TRP  47           2HH      TRP  47 -10.759  -1.179  -4.574
  875    H    LEU  48           H        LEU  48 -12.678   0.000   3.623
  876    HA   LEU  48           HA       LEU  48 -12.171  -1.777   5.766
  877   1HB   LEU  48          1HB       LEU  48 -11.803   1.176   5.220
  878   2HB   LEU  48          2HB       LEU  48 -11.440   0.622   6.814
  879    HG   LEU  48           HG       LEU  48 -10.217  -0.640   4.341
  880   1HD1  LEU  48          1HD1      LEU  48  -9.562   1.713   4.394
  881   2HD1  LEU  48          2HD1      LEU  48  -9.167   1.599   6.114
  882   3HD1  LEU  48          3HD1      LEU  48  -8.190   0.723   4.908
  883   1HD2  LEU  48          1HD2      LEU  48  -9.378  -0.670   7.280
  884   2HD2  LEU  48          2HD2      LEU  48 -10.076  -2.038   6.387
  885   3HD2  LEU  48          3HD2      LEU  48  -8.483  -1.422   5.939
  886    H    GLU  49           H        GLU  49 -14.429   0.983   5.675
  887    HA   GLU  49           HA       GLU  49 -15.492   0.589   8.332
  888   1HB   GLU  49          1HB       GLU  49 -15.849   2.468   6.386
  889   2HB   GLU  49          2HB       GLU  49 -17.294   1.542   6.094
  890   1HG   GLU  49          1HG       GLU  49 -17.903   1.743   8.537
  891   2HG   GLU  49          2HG       GLU  49 -16.504   2.781   8.770
  892    H    THR  50           H        THR  50 -16.044  -1.047   5.387
  893    HA   THR  50           HA       THR  50 -18.605  -2.287   6.246
  894    HB   THR  50           HB       THR  50 -16.951  -2.357   3.721
  895    HG1  THR  50           1HG      THR  50 -19.665  -1.714   4.252
  896   1HG2  THR  50          1HG2      THR  50 -17.726  -4.613   3.880
  897   2HG2  THR  50          2HG2      THR  50 -19.366  -4.064   4.321
  898   3HG2  THR  50          3HG2      THR  50 -18.694  -3.731   2.691
  899    H    ILE  51           H        ILE  51 -15.228  -3.084   6.131
  900    HA   ILE  51           HA       ILE  51 -15.683  -5.810   7.137
  901    HB   ILE  51           HB       ILE  51 -13.292  -4.250   6.158
  902   1HG1  ILE  51          1HG1      ILE  51 -12.893  -6.498   4.974
  903   2HG1  ILE  51          2HG1      ILE  51 -14.423  -7.054   5.643
  904   1HG2  ILE  51          1HG2      ILE  51 -12.415  -5.181   8.246
  905   2HG2  ILE  51          2HG2      ILE  51 -13.027  -6.800   7.795
  906   3HG2  ILE  51          3HG2      ILE  51 -11.739  -6.017   6.849
  907   1HD1  ILE  51          1HD1      ILE  51 -15.569  -5.217   4.364
  908   2HD1  ILE  51          2HD1      ILE  51 -13.978  -4.778   3.682
  909   3HD1  ILE  51          3HD1      ILE  51 -14.702  -6.364   3.347
  910    H    ASN  52           H        ASN  52 -15.191  -2.743   8.458
  911    HA   ASN  52           HA       ASN  52 -14.430  -3.495  11.152
  912   1HB   ASN  52          1HB       ASN  52 -14.147  -1.218  10.220
  913   2HB   ASN  52          2HB       ASN  52 -15.895  -1.056  10.053
  914   1HD2  ASN  52          2HD2      ASN  52 -13.250  -1.303  12.421
  915   2HD2  ASN  52          1HD2      ASN  52 -14.185  -0.603  13.733
  916    H    GLY  53           H        GLY  53 -15.729  -3.655  13.030
  917   1HA   GLY  53          1HA       GLY  53 -18.495  -3.375  13.300
  918   2HA   GLY  53          2HA       GLY  53 -18.248  -5.053  12.818
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1  12.253  15.745   2.390
    2   2H    MET   1          2H        MET   1  11.024  16.185   3.373
    3   3H    MET   1          3H        MET   1  12.496  16.871   3.558
    4    HA   MET   1           HA       MET   1  10.997  18.411   2.472
    5   1HB   MET   1          1HB       MET   1  13.189  17.332   0.639
    6   2HB   MET   1          2HB       MET   1  12.289  18.824   0.359
    7   1HG   MET   1          1HG       MET   1  13.108  19.735   2.518
    8   2HG   MET   1          2HG       MET   1  14.085  18.276   2.748
    9   1HE   MET   1          1HE       MET   1  15.268  21.221   2.897
   10   2HE   MET   1          2HE       MET   1  16.258  19.756   3.108
   11   3HE   MET   1          3HE       MET   1  16.777  21.026   1.978
   12    H    ASP   2           H        ASP   2   9.514  18.865   0.959
   13    HA   ASP   2           HA       ASP   2   8.175  18.827  -0.816
   14   1HB   ASP   2          1HB       ASP   2   9.121  16.057  -1.607
   15   2HB   ASP   2          2HB       ASP   2   8.154  17.171  -2.552
   16    H    TYR   3           H        TYR   3   6.080  18.551  -1.022
   17    HA   TYR   3           HA       TYR   3   4.546  17.001   0.882
   18   1HB   TYR   3          1HB       TYR   3   2.631  18.142  -0.159
   19   2HB   TYR   3          2HB       TYR   3   3.896  19.228   0.355
   20    HD1  TYR   3           1HD      TYR   3   2.216  17.755  -2.632
   21    HD2  TYR   3           2HD      TYR   3   5.078  20.656  -1.195
   22    HE1  TYR   3           1HE      TYR   3   2.261  18.832  -4.872
   23    HE2  TYR   3           2HE      TYR   3   5.110  21.728  -3.433
   24    HH   TYR   3           HH       TYR   3   4.274  21.723  -5.543
   25    H    LEU   4           H        LEU   4   6.105  15.444  -1.043
   26    HA   LEU   4           HA       LEU   4   3.965  13.632  -1.971
   27   1HB   LEU   4          1HB       LEU   4   5.011  13.180  -4.078
   28   2HB   LEU   4          2HB       LEU   4   4.720  14.899  -3.909
   29    HG   LEU   4           HG       LEU   4   7.282  14.767  -2.960
   30   1HD1  LEU   4          1HD1      LEU   4   8.626  13.331  -4.425
   31   2HD1  LEU   4          2HD1      LEU   4   7.500  12.327  -3.504
   32   3HD1  LEU   4          3HD1      LEU   4   7.157  12.704  -5.202
   33   1HD2  LEU   4          1HD2      LEU   4   6.505  15.019  -5.887
   34   2HD2  LEU   4          2HD2      LEU   4   6.486  16.321  -4.678
   35   3HD2  LEU   4          3HD2      LEU   4   8.023  15.582  -5.155
   36    H    ARG   5           H        ARG   5   7.377  13.943  -1.011
   37    HA   ARG   5           HA       ARG   5   7.904  11.151  -0.518
   38   1HB   ARG   5          1HB       ARG   5   9.196  13.728  -0.205
   39   2HB   ARG   5          2HB       ARG   5   9.300  12.902   1.341
   40   1HG   ARG   5          1HG       ARG   5  10.424  11.014   0.374
   41   2HG   ARG   5          2HG       ARG   5  10.094  11.564  -1.275
   42   1HD   ARG   5          1HD       ARG   5  11.779  13.137   0.726
   43   2HD   ARG   5          2HD       ARG   5  12.467  11.995  -0.422
   44    HE   ARG   5           HE       ARG   5  11.415  14.680  -0.992
   45   1HH1  ARG   5          1HH2      ARG   5  12.230  11.615  -2.478
   46   2HH1  ARG   5          2HH2      ARG   5  12.068  12.255  -4.098
   47   1HH2  ARG   5          1HH1      ARG   5  11.575  15.498  -3.060
   48   2HH2  ARG   5          2HH1      ARG   5  11.892  14.412  -4.402
   49    H    GLU   6           H        GLU   6   6.603  13.748   1.488
   50    HA   GLU   6           HA       GLU   6   6.216  12.290   3.892
   51   1HB   GLU   6          1HB       GLU   6   6.137  14.791   3.462
   52   2HB   GLU   6          2HB       GLU   6   4.506  14.585   2.829
   53   1HG   GLU   6          1HG       GLU   6   3.684  13.843   4.980
   54   2HG   GLU   6          2HG       GLU   6   5.321  13.619   5.602
   55    H    LEU   7           H        LEU   7   4.123  12.615   1.049
   56    HA   LEU   7           HA       LEU   7   1.858  11.151   2.110
   57   1HB   LEU   7          1HB       LEU   7   2.708  11.481  -0.802
   58   2HB   LEU   7          2HB       LEU   7   1.137  10.955  -0.227
   59    HG   LEU   7           HG       LEU   7   2.340  13.717   0.209
   60   1HD1  LEU   7          1HD1      LEU   7   1.695  13.279  -2.137
   61   2HD1  LEU   7          2HD1      LEU   7   0.092  12.753  -1.601
   62   3HD1  LEU   7          3HD1      LEU   7   0.594  14.443  -1.384
   63   1HD2  LEU   7          1HD2      LEU   7  -0.426  12.635   0.879
   64   2HD2  LEU   7          2HD2      LEU   7   0.826  13.153   2.037
   65   3HD2  LEU   7          3HD2      LEU   7   0.068  14.341   0.972
   66    H    TYR   8           H        TYR   8   4.512  10.146  -0.063
   67    HA   TYR   8           HA       TYR   8   3.937   7.458  -0.531
   68   1HB   TYR   8          1HB       TYR   8   5.984   9.261  -1.034
   69   2HB   TYR   8          2HB       TYR   8   6.789   8.282   0.119
   70    HD1  TYR   8           1HD      TYR   8   6.720   8.856  -3.177
   71    HD2  TYR   8           2HD      TYR   8   6.268   5.514  -0.486
   72    HE1  TYR   8           1HE      TYR   8   7.507   7.304  -4.959
   73    HE2  TYR   8           2HE      TYR   8   7.038   3.975  -2.275
   74    HH   TYR   8           HH       TYR   8   7.803   3.777  -4.425
   75    H    LYS   9           H        LYS   9   5.667   8.775   2.312
   76    HA   LYS   9           HA       LYS   9   6.248   6.190   3.390
   77   1HB   LYS   9          1HB       LYS   9   6.678   8.965   4.207
   78   2HB   LYS   9          2HB       LYS   9   6.004   8.083   5.569
   79   1HG   LYS   9          1HG       LYS   9   8.370   7.951   5.739
   80   2HG   LYS   9          2HG       LYS   9   7.783   6.341   5.306
   81   1HD   LYS   9          1HD       LYS   9   8.447   6.748   2.931
   82   2HD   LYS   9          2HD       LYS   9   8.997   8.380   3.375
   83   1HE   LYS   9          1HE       LYS   9  10.619   7.380   4.982
   84   2HE   LYS   9          2HE       LYS   9  10.077   5.762   4.523
   85   1HZ   LYS   9          1HZ       LYS   9  10.861   6.215   2.257
   86   2HZ   LYS   9          2HZ       LYS   9  11.368   7.711   2.687
   87   3HZ   LYS   9          3HZ       LYS   9  12.085   6.391   3.320
   88    H    LEU  10           H        LEU  10   3.656   8.342   4.608
   89    HA   LEU  10           HA       LEU  10   2.412   6.330   6.047
   90   1HB   LEU  10          1HB       LEU  10   1.247   8.848   4.814
   91   2HB   LEU  10          2HB       LEU  10   0.355   7.754   5.872
   92    HG   LEU  10           HG       LEU  10   2.571   8.035   7.395
   93   1HD1  LEU  10          1HD1      LEU  10   3.802   9.591   6.056
   94   2HD1  LEU  10          2HD1      LEU  10   2.404  10.670   5.926
   95   3HD1  LEU  10          3HD1      LEU  10   3.219  10.434   7.486
   96   1HD2  LEU  10          1HD2      LEU  10   0.264  10.026   7.325
   97   2HD2  LEU  10          2HD2      LEU  10   0.251   8.439   8.126
   98   3HD2  LEU  10          3HD2      LEU  10   1.328   9.711   8.715
   99    H    GLU  11           H        GLU  11   2.046   7.053   2.601
  100    HA   GLU  11           HA       GLU  11   0.097   5.070   1.946
  101   1HB   GLU  11          1HB       GLU  11   2.217   6.681   0.595
  102   2HB   GLU  11          2HB       GLU  11   1.833   5.301  -0.297
  103   1HG   GLU  11          1HG       GLU  11  -0.194   7.374   0.718
  104   2HG   GLU  11          2HG       GLU  11   0.562   7.410  -0.870
  105    H    GLN  12           H        GLN  12   3.699   4.633   2.406
  106    HA   GLN  12           HA       GLN  12   3.371   1.783   1.943
  107   1HB   GLN  12          1HB       GLN  12   5.684   3.578   2.672
  108   2HB   GLN  12          2HB       GLN  12   5.810   1.810   2.642
  109   1HG   GLN  12          1HG       GLN  12   4.930   1.793   0.319
  110   2HG   GLN  12          2HG       GLN  12   4.946   3.538   0.299
  111   1HE2  GLN  12          2HE2      GLN  12   6.637   1.089  -0.975
  112   2HE2  GLN  12          1HE2      GLN  12   8.273   1.716  -0.836
  113    H    GLN  13           H        GLN  13   2.867   3.735   4.734
  114    HA   GLN  13           HA       GLN  13   3.669   1.677   6.681
  115   1HB   GLN  13          1HB       GLN  13   2.274   4.353   6.789
  116   2HB   GLN  13          2HB       GLN  13   1.878   3.190   8.028
  117   1HG   GLN  13          1HG       GLN  13   3.573   4.516   8.927
  118   2HG   GLN  13          2HG       GLN  13   4.272   2.930   8.608
  119   1HE2  GLN  13          2HE2      GLN  13   5.854   2.761   6.794
  120   2HE2  GLN  13          1HE2      GLN  13   6.631   4.231   6.229
  121    H    ALA  14           H        ALA  14   0.691   2.481   4.877
  122    HA   ALA  14           HA       ALA  14  -0.867   0.364   6.179
  123   1HB   ALA  14          1HB       ALA  14  -1.918   2.261   4.952
  124   2HB   ALA  14          2HB       ALA  14  -1.152   1.715   3.441
  125   3HB   ALA  14          3HB       ALA  14  -2.364   0.697   4.251
  126    H    MET  15           H        MET  15   1.315   0.546   3.332
  127    HA   MET  15           HA       MET  15   0.936  -2.152   2.385
  128   1HB   MET  15          1HB       MET  15   2.056  -0.223   1.199
  129   2HB   MET  15          2HB       MET  15   3.483  -0.499   2.190
  130   1HG   MET  15          1HG       MET  15   4.146  -2.268   0.993
  131   2HG   MET  15          2HG       MET  15   2.544  -2.996   0.973
  132   1HE   MET  15          1HE       MET  15   0.761  -2.694  -0.711
  133   2HE   MET  15          2HE       MET  15   0.652  -0.948  -0.422
  134   3HE   MET  15          3HE       MET  15   0.774  -1.568  -2.086
  135    H    LYS  16           H        LYS  16   3.428  -0.925   4.719
  136    HA   LYS  16           HA       LYS  16   4.571  -3.526   5.225
  137   1HB   LYS  16          1HB       LYS  16   4.612  -0.800   6.512
  138   2HB   LYS  16          2HB       LYS  16   4.934  -2.152   7.586
  139   1HG   LYS  16          1HG       LYS  16   7.029  -1.359   6.803
  140   2HG   LYS  16          2HG       LYS  16   6.742  -2.960   6.115
  141   1HD   LYS  16          1HD       LYS  16   6.015  -1.844   3.967
  142   2HD   LYS  16          2HD       LYS  16   6.457  -0.282   4.664
  143   1HE   LYS  16          1HE       LYS  16   8.334  -2.663   4.259
  144   2HE   LYS  16          2HE       LYS  16   8.207  -1.280   3.168
  145   1HZ   LYS  16          1HZ       LYS  16   8.959   0.149   5.003
  146   2HZ   LYS  16          2HZ       LYS  16   9.110  -1.142   5.998
  147   3HZ   LYS  16          3HZ       LYS  16  10.063  -1.007   4.686
  148    H    LEU  17           H        LEU  17   1.921  -1.805   6.818
  149    HA   LEU  17           HA       LEU  17   1.302  -3.841   8.743
  150   1HB   LEU  17          1HB       LEU  17   0.066  -1.415   7.536
  151   2HB   LEU  17          2HB       LEU  17  -1.095  -2.574   8.020
  152    HG   LEU  17           HG       LEU  17   1.128  -1.585   9.858
  153   1HD1  LEU  17          1HD1      LEU  17  -0.357   0.250   9.126
  154   2HD1  LEU  17          2HD1      LEU  17  -1.769  -0.677   9.667
  155   3HD1  LEU  17          3HD1      LEU  17  -0.553  -0.120  10.842
  156   1HD2  LEU  17          1HD2      LEU  17  -0.306  -2.451  11.663
  157   2HD2  LEU  17          2HD2      LEU  17  -1.505  -3.015  10.476
  158   3HD2  LEU  17          3HD2      LEU  17   0.103  -3.759  10.556
  159    H    TYR  18           H        TYR  18   0.036  -3.299   5.451
  160    HA   TYR  18           HA       TYR  18  -1.679  -5.498   5.320
  161   1HB   TYR  18          1HB       TYR  18  -0.357  -3.648   3.360
  162   2HB   TYR  18          2HB       TYR  18  -1.082  -5.056   2.714
  163    HD1  TYR  18           1HD      TYR  18  -3.517  -5.504   4.212
  164    HD2  TYR  18           2HD      TYR  18  -1.796  -1.797   2.886
  165    HE1  TYR  18           1HE      TYR  18  -5.741  -4.404   4.423
  166    HE2  TYR  18           2HE      TYR  18  -4.000  -0.678   3.151
  167    HH   TYR  18           HH       TYR  18  -6.193  -0.902   3.827
  168    H    ARG  19           H        ARG  19   1.836  -5.453   4.680
  169    HA   ARG  19           HA       ARG  19   2.016  -8.154   3.705
  170   1HB   ARG  19          1HB       ARG  19   3.965  -6.343   5.175
  171   2HB   ARG  19          2HB       ARG  19   4.389  -7.980   4.678
  172   1HG   ARG  19          1HG       ARG  19   3.971  -7.465   2.330
  173   2HG   ARG  19          2HG       ARG  19   3.374  -5.857   2.742
  174   1HD   ARG  19          1HD       ARG  19   5.642  -5.703   1.905
  175   2HD   ARG  19          2HD       ARG  19   5.588  -5.219   3.609
  176    HE   ARG  19           HE       ARG  19   6.213  -7.988   3.515
  177   1HH1  ARG  19          1HH2      ARG  19   7.794  -5.032   2.513
  178   2HH1  ARG  19          2HH2      ARG  19   9.386  -5.673   2.816
  179   1HH2  ARG  19          1HH1      ARG  19   8.266  -8.744   3.884
  180   2HH2  ARG  19          2HH1      ARG  19   9.638  -7.725   3.566
  181    H    GLU  20           H        GLU  20   1.159  -7.132   6.875
  182    HA   GLU  20           HA       GLU  20   1.710  -9.868   7.992
  183   1HB   GLU  20          1HB       GLU  20   2.559  -7.525   8.976
  184   2HB   GLU  20          2HB       GLU  20   0.951  -7.462   9.660
  185   1HG   GLU  20          1HG       GLU  20   1.299  -9.680  10.733
  186   2HG   GLU  20          2HG       GLU  20   2.922  -9.761  10.042
  187    H    ALA  21           H        ALA  21  -0.724  -7.303   7.855
  188    HA   ALA  21           HA       ALA  21  -2.947  -8.749   8.877
  189   1HB   ALA  21          1HB       ALA  21  -2.965  -6.334   8.384
  190   2HB   ALA  21          2HB       ALA  21  -2.925  -6.685   6.638
  191   3HB   ALA  21          3HB       ALA  21  -4.327  -7.168   7.606
  192    H    SER  22           H        SER  22  -1.510  -8.880   5.587
  193    HA   SER  22           HA       SER  22  -3.388 -10.653   4.381
  194   1HB   SER  22          1HB       SER  22  -1.630  -9.372   3.204
  195   2HB   SER  22          2HB       SER  22  -0.387 -10.392   3.951
  196    HG   SER  22           HG       SER  22  -0.854 -11.109   1.882
  197    H    GLU  23           H        GLU  23  -0.708 -11.370   6.646
  198    HA   GLU  23           HA       GLU  23  -0.827 -14.260   6.278
  199   1HB   GLU  23          1HB       GLU  23   1.104 -12.831   7.218
  200   2HB   GLU  23          2HB       GLU  23   0.188 -12.788   8.720
  201   1HG   GLU  23          1HG       GLU  23   0.173 -15.273   8.793
  202   2HG   GLU  23          2HG       GLU  23   1.100 -15.318   7.292
  203    H    LYS  24           H        LYS  24  -2.100 -11.971   8.701
  204    HA   LYS  24           HA       LYS  24  -3.531 -13.929  10.247
  205   1HB   LYS  24          1HB       LYS  24  -3.044 -11.114  10.388
  206   2HB   LYS  24          2HB       LYS  24  -4.791 -11.287  10.398
  207   1HG   LYS  24          1HG       LYS  24  -2.875 -12.774  12.247
  208   2HG   LYS  24          2HG       LYS  24  -3.725 -11.279  12.659
  209   1HD   LYS  24          1HD       LYS  24  -5.898 -12.388  12.527
  210   2HD   LYS  24          2HD       LYS  24  -5.159 -13.860  11.895
  211   1HE   LYS  24          1HE       LYS  24  -5.649 -14.251  14.190
  212   2HE   LYS  24          2HE       LYS  24  -3.898 -14.181  13.992
  213   1HZ   LYS  24          1HZ       LYS  24  -3.956 -11.907  14.876
  214   2HZ   LYS  24          2HZ       LYS  24  -5.588 -11.964  15.031
  215   3HZ   LYS  24          3HZ       LYS  24  -4.642 -12.933  15.939
  216    H    ALA  25           H        ALA  25  -4.601 -11.908   7.545
  217    HA   ALA  25           HA       ALA  25  -7.331 -12.924   7.584
  218   1HB   ALA  25          1HB       ALA  25  -6.723 -10.557   7.054
  219   2HB   ALA  25          2HB       ALA  25  -5.883 -11.124   5.592
  220   3HB   ALA  25          3HB       ALA  25  -7.632 -11.340   5.748
  221    H    ARG  26           H        ARG  26  -5.282 -15.047   7.068
  222    HA   ARG  26           HA       ARG  26  -5.043 -15.616   4.302
  223   1HB   ARG  26          1HB       ARG  26  -4.293 -17.848   5.043
  224   2HB   ARG  26          2HB       ARG  26  -3.476 -16.499   5.795
  225   1HG   ARG  26          1HG       ARG  26  -3.841 -18.315   7.361
  226   2HG   ARG  26          2HG       ARG  26  -4.662 -16.854   7.910
  227   1HD   ARG  26          1HD       ARG  26  -6.804 -17.720   7.424
  228   2HD   ARG  26          2HD       ARG  26  -6.142 -18.925   6.306
  229    HE   ARG  26           HE       ARG  26  -5.316 -19.229   9.114
  230   1HH1  ARG  26          1HH2      ARG  26  -7.698 -20.253   6.747
  231   2HH1  ARG  26          2HH2      ARG  26  -8.112 -21.680   7.655
  232   1HH2  ARG  26          1HH1      ARG  26  -5.890 -21.081  10.204
  233   2HH2  ARG  26          2HH1      ARG  26  -7.117 -22.127   9.554
  234    H    ASN  27           H        ASN  27  -7.893 -15.897   6.081
  235    HA   ASN  27           HA       ASN  27  -9.185 -18.059   4.668
  236   1HB   ASN  27          1HB       ASN  27  -9.908 -17.170   6.871
  237   2HB   ASN  27          2HB       ASN  27 -10.302 -15.618   6.130
  238   1HD2  ASN  27          2HD2      ASN  27 -11.696 -18.458   7.192
  239   2HD2  ASN  27          1HD2      ASN  27 -13.121 -18.417   6.164
  240    HA   PRO  28           HA       PRO  28  -9.266 -16.016   0.778
  241   1HB   PRO  28          1HB       PRO  28 -11.215 -17.374  -0.614
  242   2HB   PRO  28          2HB       PRO  28  -9.595 -18.023  -0.222
  243   1HG   PRO  28          1HG       PRO  28 -12.191 -18.463   1.279
  244   2HG   PRO  28          2HG       PRO  28 -10.976 -19.685   0.778
  245   1HD   PRO  28          1HD       PRO  28 -11.024 -18.672   3.290
  246   2HD   PRO  28          2HD       PRO  28  -9.465 -19.001   2.467
  247    H    GLU  29           H        GLU  29 -12.255 -16.004   2.642
  248    HA   GLU  29           HA       GLU  29 -13.837 -14.267   1.043
  249   1HB   GLU  29          1HB       GLU  29 -14.224 -15.691   3.281
  250   2HB   GLU  29          2HB       GLU  29 -13.869 -14.172   4.063
  251   1HG   GLU  29          1HG       GLU  29 -16.240 -14.312   3.862
  252   2HG   GLU  29          2HG       GLU  29 -15.715 -13.094   2.709
  253    H    LYS  30           H        LYS  30 -11.236 -13.615   3.204
  254    HA   LYS  30           HA       LYS  30 -11.434 -10.674   2.744
  255   1HB   LYS  30          1HB       LYS  30 -11.901 -11.418   5.048
  256   2HB   LYS  30          2HB       LYS  30 -10.270 -12.085   5.168
  257   1HG   LYS  30          1HG       LYS  30  -9.272  -9.919   5.206
  258   2HG   LYS  30          2HG       LYS  30 -10.677  -9.151   4.474
  259   1HD   LYS  30          1HD       LYS  30 -10.446  -8.582   6.852
  260   2HD   LYS  30          2HD       LYS  30 -11.981  -9.384   6.492
  261   1HE   LYS  30          1HE       LYS  30 -11.108 -11.522   7.362
  262   2HE   LYS  30          2HE       LYS  30  -9.529 -10.784   7.646
  263   1HZ   LYS  30          1HZ       LYS  30 -10.605  -9.291   9.262
  264   2HZ   LYS  30          2HZ       LYS  30 -12.059 -10.005   9.007
  265   3HZ   LYS  30          3HZ       LYS  30 -10.831 -10.845   9.683
  266    H    LYS  31           H        LYS  31  -9.149 -13.381   2.688
  267    HA   LYS  31           HA       LYS  31  -6.869 -11.942   1.885
  268   1HB   LYS  31          1HB       LYS  31  -7.161 -14.484   2.388
  269   2HB   LYS  31          2HB       LYS  31  -7.658 -14.622   0.710
  270   1HG   LYS  31          1HG       LYS  31  -5.358 -15.247   0.930
  271   2HG   LYS  31          2HG       LYS  31  -5.442 -13.760  -0.016
  272   1HD   LYS  31          1HD       LYS  31  -4.682 -12.437   1.918
  273   2HD   LYS  31          2HD       LYS  31  -4.857 -13.831   2.980
  274   1HE   LYS  31          1HE       LYS  31  -2.543 -13.637   2.553
  275   2HE   LYS  31          2HE       LYS  31  -3.100 -15.031   1.619
  276   1HZ   LYS  31          1HZ       LYS  31  -3.152 -13.538  -0.352
  277   2HZ   LYS  31          2HZ       LYS  31  -2.588 -12.300   0.572
  278   3HZ   LYS  31          3HZ       LYS  31  -1.655 -13.606   0.301
  279    H    SER  32           H        SER  32  -9.719 -12.618   0.033
  280    HA   SER  32           HA       SER  32  -8.518 -11.438  -2.417
  281   1HB   SER  32          1HB       SER  32 -11.311 -12.608  -2.086
  282   2HB   SER  32          2HB       SER  32 -10.456 -12.262  -3.597
  283    HG   SER  32           HG       SER  32 -10.070 -14.328  -1.729
  284    H    VAL  33           H        VAL  33  -9.760 -10.072   0.203
  285    HA   VAL  33           HA       VAL  33 -11.137  -7.860  -1.300
  286    HB   VAL  33           HB       VAL  33 -11.407  -8.679   1.609
  287   1HG1  VAL  33          1HG1      VAL  33 -11.476  -6.224   1.489
  288   2HG1  VAL  33          2HG1      VAL  33 -12.633  -6.301   0.142
  289   3HG1  VAL  33          3HG1      VAL  33 -13.096  -6.863   1.763
  290   1HG2  VAL  33          1HG2      VAL  33 -13.434  -8.550  -0.674
  291   2HG2  VAL  33          2HG2      VAL  33 -12.718 -10.038  -0.029
  292   3HG2  VAL  33          3HG2      VAL  33 -13.763  -9.051   0.999
  293    H    LEU  34           H        LEU  34  -8.671  -8.513   1.357
  294    HA   LEU  34           HA       LEU  34  -7.794  -5.752   1.208
  295   1HB   LEU  34          1HB       LEU  34  -6.434  -6.171   2.863
  296   2HB   LEU  34          2HB       LEU  34  -7.567  -7.478   3.160
  297    HG   LEU  34           HG       LEU  34  -4.990  -7.698   1.634
  298   1HD1  LEU  34          1HD1      LEU  34  -3.922  -8.552   3.602
  299   2HD1  LEU  34          2HD1      LEU  34  -4.827  -7.145   4.174
  300   3HD1  LEU  34          3HD1      LEU  34  -5.472  -8.753   4.459
  301   1HD2  LEU  34          1HD2      LEU  34  -6.669  -9.914   2.828
  302   2HD2  LEU  34          2HD2      LEU  34  -6.538  -9.535   1.096
  303   3HD2  LEU  34          3HD2      LEU  34  -5.118 -10.112   1.977
  304    H    GLN  35           H        GLN  35  -7.178  -8.537  -0.809
  305    HA   GLN  35           HA       GLN  35  -4.796  -7.645  -2.063
  306   1HB   GLN  35          1HB       GLN  35  -5.771  -9.912  -2.243
  307   2HB   GLN  35          2HB       GLN  35  -7.124  -9.263  -3.170
  308   1HG   GLN  35          1HG       GLN  35  -5.638 -10.308  -4.697
  309   2HG   GLN  35          2HG       GLN  35  -5.465  -8.588  -4.972
  310   1HE2  GLN  35          2HE2      GLN  35  -3.751 -11.499  -4.395
  311   2HE2  GLN  35          1HE2      GLN  35  -2.202 -10.758  -4.015
  312    H    LYS  36           H        LYS  36  -8.174  -6.616  -2.500
  313    HA   LYS  36           HA       LYS  36  -7.707  -5.294  -5.053
  314   1HB   LYS  36          1HB       LYS  36  -9.906  -6.268  -4.109
  315   2HB   LYS  36          2HB       LYS  36 -10.015  -4.812  -3.110
  316   1HG   LYS  36          1HG       LYS  36 -10.002  -3.421  -5.184
  317   2HG   LYS  36          2HG       LYS  36  -9.836  -4.891  -6.161
  318   1HD   LYS  36          1HD       LYS  36 -12.002  -5.731  -5.280
  319   2HD   LYS  36          2HD       LYS  36 -12.190  -4.246  -4.324
  320   1HE   LYS  36          1HE       LYS  36 -12.166  -2.896  -6.400
  321   2HE   LYS  36          2HE       LYS  36 -11.916  -4.358  -7.364
  322   1HZ   LYS  36          1HZ       LYS  36 -14.083  -5.163  -6.593
  323   2HZ   LYS  36          2HZ       LYS  36 -14.320  -3.814  -5.699
  324   3HZ   LYS  36          3HZ       LYS  36 -14.258  -3.719  -7.328
  325    H    ILE  37           H        ILE  37  -7.804  -4.178  -1.687
  326    HA   ILE  37           HA       ILE  37  -7.035  -1.406  -2.217
  327    HB   ILE  37           HB       ILE  37  -6.708  -3.326   0.097
  328   1HG1  ILE  37          1HG1      ILE  37  -8.042  -0.759   0.660
  329   2HG1  ILE  37          2HG1      ILE  37  -8.858  -1.725  -0.534
  330   1HG2  ILE  37          1HG2      ILE  37  -4.731  -1.903   0.297
  331   2HG2  ILE  37          2HG2      ILE  37  -5.699  -0.452  -0.076
  332   3HG2  ILE  37          3HG2      ILE  37  -5.919  -1.304   1.454
  333   1HD1  ILE  37          1HD1      ILE  37  -8.988  -3.628   1.009
  334   2HD1  ILE  37          2HD1      ILE  37  -7.991  -2.763   2.199
  335   3HD1  ILE  37          3HD1      ILE  37  -9.617  -2.174   1.813
  336    H    LEU  38           H        LEU  38  -5.031  -4.400  -1.539
  337    HA   LEU  38           HA       LEU  38  -2.553  -3.127  -1.843
  338   1HB   LEU  38          1HB       LEU  38  -3.476  -5.952  -2.397
  339   2HB   LEU  38          2HB       LEU  38  -1.825  -5.494  -2.738
  340    HG   LEU  38           HG       LEU  38  -3.098  -5.172   0.016
  341   1HD1  LEU  38          1HD1      LEU  38  -2.970  -7.555  -0.628
  342   2HD1  LEU  38          2HD1      LEU  38  -1.255  -7.356  -1.050
  343   3HD1  LEU  38          3HD1      LEU  38  -1.796  -7.168   0.636
  344   1HD2  LEU  38          1HD2      LEU  38  -0.273  -4.888  -1.093
  345   2HD2  LEU  38          2HD2      LEU  38  -1.230  -3.695  -0.172
  346   3HD2  LEU  38          3HD2      LEU  38  -0.586  -5.134   0.622
  347    H    GLU  39           H        GLU  39  -4.578  -4.404  -4.542
  348    HA   GLU  39           HA       GLU  39  -2.635  -3.682  -6.538
  349   1HB   GLU  39          1HB       GLU  39  -4.480  -5.349  -6.844
  350   2HB   GLU  39          2HB       GLU  39  -5.665  -4.038  -6.773
  351   1HG   GLU  39          1HG       GLU  39  -4.712  -3.048  -8.829
  352   2HG   GLU  39          2HG       GLU  39  -3.457  -4.289  -8.862
  353    H    ASP  40           H        ASP  40  -5.366  -1.838  -5.171
  354    HA   ASP  40           HA       ASP  40  -5.094   0.515  -6.800
  355   1HB   ASP  40          1HB       ASP  40  -6.317  -0.350  -4.177
  356   2HB   ASP  40          2HB       ASP  40  -6.104   1.327  -4.426
  357    H    GLU  41           H        GLU  41  -3.436  -0.600  -3.816
  358    HA   GLU  41           HA       GLU  41  -2.180   2.031  -3.396
  359   1HB   GLU  41          1HB       GLU  41  -1.493  -0.639  -2.117
  360   2HB   GLU  41          2HB       GLU  41  -0.833   0.920  -1.649
  361   1HG   GLU  41          1HG       GLU  41  -3.670  -0.053  -1.239
  362   2HG   GLU  41          2HG       GLU  41  -2.441   0.191  -0.029
  363    H    GLU  42           H        GLU  42  -1.179  -1.050  -4.878
  364    HA   GLU  42           HA       GLU  42   1.500  -0.276  -5.528
  365   1HB   GLU  42          1HB       GLU  42   0.584  -2.574  -5.711
  366   2HB   GLU  42          2HB       GLU  42  -0.416  -2.066  -7.078
  367   1HG   GLU  42          1HG       GLU  42   1.604  -1.545  -8.391
  368   2HG   GLU  42          2HG       GLU  42   2.628  -1.914  -7.001
  369    H    LYS  43           H        LYS  43  -1.604   0.413  -7.160
  370    HA   LYS  43           HA       LYS  43  -0.415   1.764  -9.415
  371   1HB   LYS  43          1HB       LYS  43  -2.958   0.896  -8.846
  372   2HB   LYS  43          2HB       LYS  43  -3.154   2.605  -8.528
  373   1HG   LYS  43          1HG       LYS  43  -3.714   2.319 -10.810
  374   2HG   LYS  43          2HG       LYS  43  -2.080   2.999 -10.846
  375   1HD   LYS  43          1HD       LYS  43  -1.186   0.627 -11.092
  376   2HD   LYS  43          2HD       LYS  43  -2.847   0.058 -11.215
  377   1HE   LYS  43          1HE       LYS  43  -1.532   2.089 -13.084
  378   2HE   LYS  43          2HE       LYS  43  -1.631   0.358 -13.400
  379   1HZ   LYS  43          1HZ       LYS  43  -4.058   0.537 -13.380
  380   2HZ   LYS  43          2HZ       LYS  43  -3.983   2.150 -13.113
  381   3HZ   LYS  43          3HZ       LYS  43  -3.424   1.524 -14.511
  382    H    HIS  44           H        HIS  44  -1.527   3.066  -6.201
  383    HA   HIS  44           HA       HIS  44  -0.949   5.759  -6.756
  384   1HB   HIS  44          1HB       HIS  44  -0.725   4.146  -4.170
  385   2HB   HIS  44          2HB       HIS  44  -0.837   5.865  -4.359
  386    HD2  HIS  44           2HD      HIS  44  -3.265   5.121  -6.760
  387    HE1  HIS  44           1HE      HIS  44  -5.537   4.507  -3.233
  388    HE2  HIS  44           2HE      HIS  44  -5.631   4.722  -5.768
  389    H    ILE  45           H        ILE  45   1.147   3.139  -5.473
  390    HA   ILE  45           HA       ILE  45   3.511   4.748  -5.236
  391    HB   ILE  45           HB       ILE  45   2.813   1.850  -5.115
  392   1HG1  ILE  45          1HG1      ILE  45   4.360   1.972  -3.140
  393   2HG1  ILE  45          2HG1      ILE  45   4.687   3.659  -3.526
  394   1HG2  ILE  45          1HG2      ILE  45   4.629   1.619  -6.718
  395   2HG2  ILE  45          2HG2      ILE  45   5.680   2.660  -5.721
  396   3HG2  ILE  45          3HG2      ILE  45   5.147   1.073  -5.128
  397   1HD1  ILE  45          1HD1      ILE  45   2.284   4.197  -3.088
  398   2HD1  ILE  45          2HD1      ILE  45   1.998   2.482  -2.707
  399   3HD1  ILE  45          3HD1      ILE  45   3.079   3.451  -1.693
  400    H    GLU  46           H        GLU  46   2.298   2.886  -8.100
  401    HA   GLU  46           HA       GLU  46   4.496   3.403  -9.807
  402   1HB   GLU  46          1HB       GLU  46   1.521   3.055 -10.233
  403   2HB   GLU  46          2HB       GLU  46   2.520   3.557 -11.569
  404   1HG   GLU  46          1HG       GLU  46   3.031   1.048  -9.950
  405   2HG   GLU  46          2HG       GLU  46   2.040   1.110 -11.409
  406    H    TRP  47           H        TRP  47   1.643   5.504  -9.166
  407    HA   TRP  47           HA       TRP  47   2.588   7.531 -10.967
  408   1HB   TRP  47          1HB       TRP  47   0.636   7.836  -8.624
  409   2HB   TRP  47          2HB       TRP  47   0.716   8.818 -10.064
  410    HD1  TRP  47           1HD      TRP  47   0.657   6.086 -12.005
  411    HE1  TRP  47           1HE      TRP  47  -1.625   4.947 -12.369
  412    HE3  TRP  47           3HE      TRP  47  -1.902   8.078  -8.068
  413    HZ2  TRP  47           2HZ      TRP  47  -4.238   4.970 -11.168
  414    HZ3  TRP  47           3HZ      TRP  47  -4.306   7.533  -7.704
  415    HH2  TRP  47           2HH      TRP  47  -5.474   5.963  -9.236
  416    H    LEU  48           H        LEU  48   2.718   7.156  -7.433
  417    HA   LEU  48           HA       LEU  48   3.973   9.588  -6.724
  418   1HB   LEU  48          1HB       LEU  48   3.920   6.766  -5.646
  419   2HB   LEU  48          2HB       LEU  48   4.935   7.927  -4.870
  420    HG   LEU  48           HG       LEU  48   1.975   8.402  -5.290
  421   1HD1  LEU  48          1HD1      LEU  48   2.284   6.410  -3.891
  422   2HD1  LEU  48          2HD1      LEU  48   3.428   7.284  -2.852
  423   3HD1  LEU  48          3HD1      LEU  48   1.712   7.761  -2.908
  424   1HD2  LEU  48          1HD2      LEU  48   3.991   9.681  -3.380
  425   2HD2  LEU  48          2HD2      LEU  48   3.292  10.458  -4.817
  426   3HD2  LEU  48          3HD2      LEU  48   2.253  10.042  -3.450
  427    H    GLU  49           H        GLU  49   5.463   6.536  -7.830
  428    HA   GLU  49           HA       GLU  49   8.178   7.488  -7.727
  429   1HB   GLU  49          1HB       GLU  49   7.270   5.069  -8.027
  430   2HB   GLU  49          2HB       GLU  49   7.156   5.441  -9.737
  431   1HG   GLU  49          1HG       GLU  49   9.585   6.047  -9.754
  432   2HG   GLU  49          2HG       GLU  49   9.687   5.650  -8.039
  433    H    THR  50           H        THR  50   5.915   7.312 -10.523
  434    HA   THR  50           HA       THR  50   7.490   8.619 -12.439
  435    HB   THR  50           HB       THR  50   4.508   8.394 -11.969
  436    HG1  THR  50           1HG      THR  50   4.723   6.858 -13.558
  437   1HG2  THR  50          1HG2      THR  50   4.704  10.353 -13.357
  438   2HG2  THR  50          2HG2      THR  50   5.891   9.533 -14.412
  439   3HG2  THR  50          3HG2      THR  50   4.193   8.980 -14.348
  440    H    ILE  51           H        ILE  51   5.638  10.027  -9.850
  441    HA   ILE  51           HA       ILE  51   6.156  12.795 -10.712
  442    HB   ILE  51           HB       ILE  51   4.663  11.530  -8.402
  443   1HG1  ILE  51          1HG1      ILE  51   3.559  11.462 -10.630
  444   2HG1  ILE  51          2HG1      ILE  51   2.658  12.356  -9.424
  445   1HG2  ILE  51          1HG2      ILE  51   5.464  13.522  -7.385
  446   2HG2  ILE  51          2HG2      ILE  51   5.051  14.510  -8.803
  447   3HG2  ILE  51          3HG2      ILE  51   3.773  13.786  -7.801
  448   1HD1  ILE  51          1HD1      ILE  51   3.367  14.497 -10.457
  449   2HD1  ILE  51          2HD1      ILE  51   4.327  13.598 -11.659
  450   3HD1  ILE  51          3HD1      ILE  51   2.566  13.435 -11.622
  451    H    ASN  52           H        ASN  52   7.863  10.566  -8.907
  452    HA   ASN  52           HA       ASN  52   9.339  12.602  -7.312
  453   1HB   ASN  52          1HB       ASN  52   8.408  10.677  -6.123
  454   2HB   ASN  52          2HB       ASN  52   9.313   9.573  -7.163
  455   1HD2  ASN  52          2HD2      ASN  52  10.095   8.785  -5.030
  456   2HD2  ASN  52          1HD2      ASN  52  11.488   9.594  -4.340
  457    H    GLY  53           H        GLY  53  10.297  13.497  -9.254
  458   1HA   GLY  53          1HA       GLY  53  13.020  12.511  -9.653
  459   2HA   GLY  53          2HA       GLY  53  12.029  12.406 -11.109
  460   1H    MET   1          1H        MET   1  -2.626  -6.995  17.697
  461   2H    MET   1          2H        MET   1  -2.923  -5.995  18.950
  462   3H    MET   1          3H        MET   1  -2.635  -7.588  19.224
  463    HA   MET   1           HA       MET   1  -4.635  -8.203  18.036
  464   1HB   MET   1          1HB       MET   1  -6.264  -7.587  19.709
  465   2HB   MET   1          2HB       MET   1  -4.737  -7.994  20.475
  466   1HG   MET   1          1HG       MET   1  -4.250  -5.554  20.753
  467   2HG   MET   1          2HG       MET   1  -5.822  -5.182  20.031
  468   1HE   MET   1          1HE       MET   1  -4.837  -4.038  22.839
  469   2HE   MET   1          2HE       MET   1  -6.420  -3.665  22.116
  470   3HE   MET   1          3HE       MET   1  -6.320  -4.219  23.802
  471    H    ASP   2           H        ASP   2  -6.834  -7.423  17.359
  472    HA   ASP   2           HA       ASP   2  -8.003  -6.415  15.705
  473   1HB   ASP   2          1HB       ASP   2  -7.234  -3.956  17.300
  474   2HB   ASP   2          2HB       ASP   2  -8.534  -4.037  16.109
  475    H    TYR   3           H        TYR   3  -5.982  -7.186  14.442
  476    HA   TYR   3           HA       TYR   3  -4.142  -5.585  13.136
  477   1HB   TYR   3          1HB       TYR   3  -3.848  -7.359  11.651
  478   2HB   TYR   3          2HB       TYR   3  -4.367  -8.107  13.141
  479    HD1  TYR   3           1HD      TYR   3  -6.726  -9.092  13.296
  480    HD2  TYR   3           2HD      TYR   3  -5.138  -7.504   9.605
  481    HE1  TYR   3           1HE      TYR   3  -8.441 -10.345  12.007
  482    HE2  TYR   3           2HE      TYR   3  -6.830  -8.783   8.331
  483    HH   TYR   3           HH       TYR   3  -8.534 -10.267   8.431
  484    H    LEU   4           H        LEU   4  -7.370  -5.112  12.743
  485    HA   LEU   4           HA       LEU   4  -7.276  -4.117   9.969
  486   1HB   LEU   4          1HB       LEU   4  -9.693  -4.143  10.082
  487   2HB   LEU   4          2HB       LEU   4  -8.932  -5.734  10.258
  488    HG   LEU   4           HG       LEU   4  -9.617  -4.292  12.775
  489   1HD1  LEU   4          1HD1      LEU   4 -11.624  -3.818  11.441
  490   2HD1  LEU   4          2HD1      LEU   4 -11.766  -5.537  11.004
  491   3HD1  LEU   4          3HD1      LEU   4 -11.983  -5.022  12.693
  492   1HD2  LEU   4          1HD2      LEU   4 -10.106  -7.169  11.879
  493   2HD2  LEU   4          2HD2      LEU   4  -8.679  -6.634  12.772
  494   3HD2  LEU   4          3HD2      LEU   4 -10.276  -6.537  13.529
  495    H    ARG   5           H        ARG   5  -7.362  -2.868  13.158
  496    HA   ARG   5           HA       ARG   5  -8.731  -0.307  12.381
  497   1HB   ARG   5          1HB       ARG   5  -8.229  -1.699  14.902
  498   2HB   ARG   5          2HB       ARG   5  -7.463  -0.125  14.972
  499   1HG   ARG   5          1HG       ARG   5 -10.400  -0.615  14.302
  500   2HG   ARG   5          2HG       ARG   5  -9.757  -0.154  15.880
  501   1HD   ARG   5          1HD       ARG   5  -8.788   1.941  14.745
  502   2HD   ARG   5          2HD       ARG   5  -9.746   1.509  13.332
  503    HE   ARG   5           HE       ARG   5 -11.736   2.031  14.466
  504   1HH1  ARG   5          1HH2      ARG   5  -9.076   2.390  16.730
  505   2HH1  ARG   5          2HH2      ARG   5 -10.051   3.284  17.862
  506   1HH2  ARG   5          1HH1      ARG   5 -12.916   3.159  15.976
  507   2HH2  ARG   5          2HH1      ARG   5 -12.158   3.695  17.446
  508    H    GLU   6           H        GLU   6  -5.662  -1.674  13.184
  509    HA   GLU   6           HA       GLU   6  -3.870   0.441  12.782
  510   1HB   GLU   6          1HB       GLU   6  -3.758  -2.276  13.383
  511   2HB   GLU   6          2HB       GLU   6  -3.140  -2.280  11.753
  512   1HG   GLU   6          1HG       GLU   6  -1.265  -2.031  13.225
  513   2HG   GLU   6          2HG       GLU   6  -1.498  -0.444  12.490
  514    H    LEU   7           H        LEU   7  -5.458  -1.586  10.322
  515    HA   LEU   7           HA       LEU   7  -4.105  -0.478   8.026
  516   1HB   LEU   7          1HB       LEU   7  -6.955  -1.568   8.109
  517   2HB   LEU   7          2HB       LEU   7  -5.932  -1.388   6.695
  518    HG   LEU   7           HG       LEU   7  -5.491  -3.293   9.001
  519   1HD1  LEU   7          1HD1      LEU   7  -7.425  -3.905   7.604
  520   2HD1  LEU   7          2HD1      LEU   7  -6.411  -3.812   6.156
  521   3HD1  LEU   7          3HD1      LEU   7  -6.091  -5.054   7.391
  522   1HD2  LEU   7          1HD2      LEU   7  -3.973  -3.011   6.383
  523   2HD2  LEU   7          2HD2      LEU   7  -3.394  -2.644   8.031
  524   3HD2  LEU   7          3HD2      LEU   7  -3.754  -4.313   7.582
  525    H    TYR   8           H        TYR   8  -7.377   0.151   9.237
  526    HA   TYR   8           HA       TYR   8  -8.180   2.209   7.517
  527   1HB   TYR   8          1HB       TYR   8  -9.234   0.730   9.588
  528   2HB   TYR   8          2HB       TYR   8  -8.915   2.143  10.501
  529    HD1  TYR   8           1HD      TYR   8 -11.510   1.020  10.490
  530    HD2  TYR   8           2HD      TYR   8  -9.833   3.859   7.697
  531    HE1  TYR   8           1HE      TYR   8 -13.777   1.945  10.066
  532    HE2  TYR   8           2HE      TYR   8 -12.107   4.781   7.304
  533    HH   TYR   8           HH       TYR   8 -14.999   3.579   8.995
  534    H    LYS   9           H        LYS   9  -6.615   2.578  10.715
  535    HA   LYS   9           HA       LYS   9  -6.706   5.431  10.639
  536   1HB   LYS   9          1HB       LYS   9  -4.977   3.419  12.172
  537   2HB   LYS   9          2HB       LYS   9  -4.647   5.150  12.289
  538   1HG   LYS   9          1HG       LYS   9  -7.080   5.512  12.937
  539   2HG   LYS   9          2HG       LYS   9  -7.261   3.759  12.975
  540   1HD   LYS   9          1HD       LYS   9  -6.957   4.393  15.193
  541   2HD   LYS   9          2HD       LYS   9  -5.401   3.708  14.739
  542   1HE   LYS   9          1HE       LYS   9  -5.964   6.711  14.622
  543   2HE   LYS   9          2HE       LYS   9  -5.553   5.924  16.143
  544   1HZ   LYS   9          1HZ       LYS   9  -3.455   5.189  15.151
  545   2HZ   LYS   9          2HZ       LYS   9  -3.792   5.978  13.754
  546   3HZ   LYS   9          3HZ       LYS   9  -3.577   6.813  15.133
  547    H    LEU  10           H        LEU  10  -3.954   3.396   9.621
  548    HA   LEU  10           HA       LEU  10  -2.491   5.651   8.724
  549   1HB   LEU  10          1HB       LEU  10  -2.241   2.673   8.346
  550   2HB   LEU  10          2HB       LEU  10  -1.170   3.764   7.464
  551    HG   LEU  10           HG       LEU  10  -1.520   4.112  10.467
  552   1HD1  LEU  10          1HD1      LEU  10  -0.950   1.811  10.291
  553   2HD1  LEU  10          2HD1      LEU  10   0.341   2.136   9.120
  554   3HD1  LEU  10          3HD1      LEU  10   0.491   2.696  10.803
  555   1HD2  LEU  10          1HD2      LEU  10   0.790   4.689   8.563
  556   2HD2  LEU  10          2HD2      LEU  10  -0.337   5.888   9.226
  557   3HD2  LEU  10          3HD2      LEU  10   0.760   5.025  10.307
  558    H    GLU  11           H        GLU  11  -4.761   3.489   7.098
  559    HA   GLU  11           HA       GLU  11  -4.780   4.634   4.492
  560   1HB   GLU  11          1HB       GLU  11  -6.579   3.046   6.253
  561   2HB   GLU  11          2HB       GLU  11  -7.432   3.803   5.024
  562   1HG   GLU  11          1HG       GLU  11  -4.988   1.971   4.674
  563   2HG   GLU  11          2HG       GLU  11  -6.664   1.471   4.515
  564    H    GLN  12           H        GLN  12  -6.481   5.853   7.517
  565    HA   GLN  12           HA       GLN  12  -7.538   8.096   6.023
  566   1HB   GLN  12          1HB       GLN  12  -7.609   7.213   8.899
  567   2HB   GLN  12          2HB       GLN  12  -8.238   8.787   8.366
  568   1HG   GLN  12          1HG       GLN  12  -9.606   7.677   6.650
  569   2HG   GLN  12          2HG       GLN  12  -9.097   6.102   7.219
  570   1HE2  GLN  12          2HE2      GLN  12 -11.808   7.768   7.232
  571   2HE2  GLN  12          1HE2      GLN  12 -12.370   7.490   8.872
  572    H    GLN  13           H        GLN  13  -4.724   7.673   8.062
  573    HA   GLN  13           HA       GLN  13  -4.079  10.501   8.265
  574   1HB   GLN  13          1HB       GLN  13  -2.356   7.997   8.485
  575   2HB   GLN  13          2HB       GLN  13  -1.698   9.633   8.601
  576   1HG   GLN  13          1HG       GLN  13  -3.323  10.128  10.460
  577   2HG   GLN  13          2HG       GLN  13  -3.795   8.428  10.450
  578   1HE2  GLN  13          2HE2      GLN  13  -1.101  10.694  11.105
  579   2HE2  GLN  13          1HE2      GLN  13  -0.175   9.543  12.055
  580    H    ALA  14           H        ALA  14  -3.445   8.080   5.721
  581    HA   ALA  14           HA       ALA  14  -1.822   9.869   4.085
  582   1HB   ALA  14          1HB       ALA  14  -1.796   7.402   3.808
  583   2HB   ALA  14          2HB       ALA  14  -3.518   7.422   3.368
  584   3HB   ALA  14          3HB       ALA  14  -2.319   8.212   2.319
  585    H    MET  15           H        MET  15  -5.353   9.143   4.350
  586    HA   MET  15           HA       MET  15  -6.115  10.921   2.192
  587   1HB   MET  15          1HB       MET  15  -7.521   9.562   4.487
  588   2HB   MET  15          2HB       MET  15  -8.325  10.946   3.792
  589   1HG   MET  15          1HG       MET  15  -7.417   8.461   2.310
  590   2HG   MET  15          2HG       MET  15  -9.074   8.899   2.721
  591   1HE   MET  15          1HE       MET  15 -10.020  11.384   1.942
  592   2HE   MET  15          2HE       MET  15  -8.487  12.289   1.917
  593   3HE   MET  15          3HE       MET  15  -9.473  12.193   0.448
  594    H    LYS  16           H        LYS  16  -5.778  11.577   5.716
  595    HA   LYS  16           HA       LYS  16  -6.564  14.328   5.503
  596   1HB   LYS  16          1HB       LYS  16  -6.272  12.843   7.621
  597   2HB   LYS  16          2HB       LYS  16  -4.548  13.205   7.491
  598   1HG   LYS  16          1HG       LYS  16  -5.424  14.804   9.029
  599   2HG   LYS  16          2HG       LYS  16  -5.191  15.687   7.522
  600   1HD   LYS  16          1HD       LYS  16  -7.788  14.927   7.165
  601   2HD   LYS  16          2HD       LYS  16  -7.743  14.868   8.917
  602   1HE   LYS  16          1HE       LYS  16  -6.979  17.260   7.170
  603   2HE   LYS  16          2HE       LYS  16  -8.539  17.043   7.968
  604   1HZ   LYS  16          1HZ       LYS  16  -7.389  17.109  10.115
  605   2HZ   LYS  16          2HZ       LYS  16  -5.941  17.327   9.384
  606   3HZ   LYS  16          3HZ       LYS  16  -7.094  18.475   9.273
  607    H    LEU  17           H        LEU  17  -3.371  12.786   5.214
  608    HA   LEU  17           HA       LEU  17  -1.870  15.127   4.582
  609   1HB   LEU  17          1HB       LEU  17  -1.616  12.177   4.346
  610   2HB   LEU  17          2HB       LEU  17  -0.774  13.005   3.096
  611    HG   LEU  17           HG       LEU  17  -0.426  13.593   6.070
  612   1HD1  LEU  17          1HD1      LEU  17   0.292  11.309   5.449
  613   2HD1  LEU  17          2HD1      LEU  17   1.343  11.978   4.183
  614   3HD1  LEU  17          3HD1      LEU  17   1.663  12.339   5.895
  615   1HD2  LEU  17          1HD2      LEU  17   1.262  14.427   3.662
  616   2HD2  LEU  17          2HD2      LEU  17   0.267  15.511   4.652
  617   3HD2  LEU  17          3HD2      LEU  17   1.671  14.714   5.364
  618    H    TYR  18           H        TYR  18  -3.865  13.009   2.476
  619    HA   TYR  18           HA       TYR  18  -3.130  14.317   0.029
  620   1HB   TYR  18          1HB       TYR  18  -5.110  12.267   0.928
  621   2HB   TYR  18          2HB       TYR  18  -5.505  13.062  -0.544
  622    HD1  TYR  18           1HD      TYR  18  -3.292  13.357  -2.184
  623    HD2  TYR  18           2HD      TYR  18  -3.964  10.208   0.667
  624    HE1  TYR  18           1HE      TYR  18  -1.474  12.001  -3.239
  625    HE2  TYR  18           2HE      TYR  18  -2.126   8.884  -0.345
  626    HH   TYR  18           HH       TYR  18  -0.464   8.834  -1.932
  627    H    ARG  19           H        ARG  19  -5.782  14.915   2.316
  628    HA   ARG  19           HA       ARG  19  -7.169  16.914   0.828
  629   1HB   ARG  19          1HB       ARG  19  -7.932  15.748   2.890
  630   2HB   ARG  19          2HB       ARG  19  -6.806  16.687   3.857
  631   1HG   ARG  19          1HG       ARG  19  -8.907  18.041   2.120
  632   2HG   ARG  19          2HG       ARG  19  -9.315  17.363   3.697
  633   1HD   ARG  19          1HD       ARG  19  -7.602  18.788   4.778
  634   2HD   ARG  19          2HD       ARG  19  -7.263  19.558   3.214
  635    HE   ARG  19           HE       ARG  19 -10.035  19.762   3.601
  636   1HH1  ARG  19          1HH2      ARG  19  -7.197  21.034   5.225
  637   2HH1  ARG  19          2HH2      ARG  19  -8.054  22.435   5.806
  638   1HH2  ARG  19          1HH1      ARG  19 -11.056  21.571   4.372
  639   2HH2  ARG  19          2HH1      ARG  19 -10.178  22.727   5.329
  640    H    GLU  20           H        GLU  20  -4.406  17.320   3.084
  641    HA   GLU  20           HA       GLU  20  -4.242  20.200   2.590
  642   1HB   GLU  20          1HB       GLU  20  -3.367  18.650   4.599
  643   2HB   GLU  20          2HB       GLU  20  -1.928  18.515   3.619
  644   1HG   GLU  20          1HG       GLU  20  -1.848  21.060   3.496
  645   2HG   GLU  20          2HG       GLU  20  -3.162  21.097   4.670
  646    H    ALA  21           H        ALA  21  -2.384  17.395   1.498
  647    HA   ALA  21           HA       ALA  21  -0.538  18.714  -0.180
  648   1HB   ALA  21          1HB       ALA  21  -0.403  16.323   0.344
  649   2HB   ALA  21          2HB       ALA  21  -1.849  16.013  -0.651
  650   3HB   ALA  21          3HB       ALA  21  -0.354  16.599  -1.406
  651    H    SER  22           H        SER  22  -3.987  18.025  -0.858
  652    HA   SER  22           HA       SER  22  -3.947  18.918  -3.583
  653   1HB   SER  22          1HB       SER  22  -5.767  17.611  -2.451
  654   2HB   SER  22          2HB       SER  22  -6.240  19.087  -1.589
  655    HG   SER  22           HG       SER  22  -7.441  18.683  -3.535
  656    H    GLU  23           H        GLU  23  -4.022  20.823  -0.548
  657    HA   GLU  23           HA       GLU  23  -4.357  23.373  -2.021
  658   1HB   GLU  23          1HB       GLU  23  -4.938  22.825   0.472
  659   2HB   GLU  23          2HB       GLU  23  -3.228  23.022   0.767
  660   1HG   GLU  23          1HG       GLU  23  -5.013  25.128  -0.528
  661   2HG   GLU  23          2HG       GLU  23  -4.702  25.040   1.200
  662    H    LYS  24           H        LYS  24  -1.721  21.527  -0.594
  663    HA   LYS  24           HA       LYS  24   0.267  23.395  -1.375
  664   1HB   LYS  24          1HB       LYS  24   0.303  21.508   0.366
  665   2HB   LYS  24          2HB       LYS  24   0.794  20.434  -0.952
  666   1HG   LYS  24          1HG       LYS  24   2.825  21.615  -1.303
  667   2HG   LYS  24          2HG       LYS  24   2.283  23.043  -0.410
  668   1HD   LYS  24          1HD       LYS  24   2.604  20.316   0.859
  669   2HD   LYS  24          2HD       LYS  24   3.930  21.491   0.767
  670   1HE   LYS  24          1HE       LYS  24   1.264  21.957   2.182
  671   2HE   LYS  24          2HE       LYS  24   2.744  21.433   2.978
  672   1HZ   LYS  24          1HZ       LYS  24   3.801  23.513   2.268
  673   2HZ   LYS  24          2HZ       LYS  24   2.418  24.021   1.554
  674   3HZ   LYS  24          3HZ       LYS  24   2.479  23.820   3.170
  675    H    ALA  25           H        ALA  25  -1.260  20.962  -3.239
  676    HA   ALA  25           HA       ALA  25   0.490  21.369  -5.612
  677   1HB   ALA  25          1HB       ALA  25   0.213  19.026  -4.683
  678   2HB   ALA  25          2HB       ALA  25  -1.530  19.150  -5.049
  679   3HB   ALA  25          3HB       ALA  25  -0.347  19.222  -6.351
  680    H    ARG  26           H        ARG  26  -1.475  23.362  -4.853
  681    HA   ARG  26           HA       ARG  26  -3.976  23.187  -6.005
  682   1HB   ARG  26          1HB       ARG  26  -2.594  25.111  -4.642
  683   2HB   ARG  26          2HB       ARG  26  -2.566  25.827  -6.234
  684   1HG   ARG  26          1HG       ARG  26  -4.461  26.721  -5.131
  685   2HG   ARG  26          2HG       ARG  26  -5.138  25.526  -6.255
  686   1HD   ARG  26          1HD       ARG  26  -5.264  23.871  -4.417
  687   2HD   ARG  26          2HD       ARG  26  -4.474  25.027  -3.324
  688    HE   ARG  26           HE       ARG  26  -6.661  26.433  -4.115
  689   1HH1  ARG  26          1HH2      ARG  26  -6.433  23.183  -2.802
  690   2HH1  ARG  26          2HH2      ARG  26  -7.888  23.374  -1.862
  691   1HH2  ARG  26          1HH1      ARG  26  -8.526  26.579  -2.924
  692   2HH2  ARG  26          2HH1      ARG  26  -9.058  25.232  -1.963
  693    H    ASN  27           H        ASN  27  -1.034  23.487  -7.836
  694    HA   ASN  27           HA       ASN  27  -1.784  24.486 -10.286
  695   1HB   ASN  27          1HB       ASN  27   0.056  22.172  -9.486
  696   2HB   ASN  27          2HB       ASN  27   0.131  23.088 -10.970
  697   1HD2  ASN  27          2HD2      ASN  27   1.227  25.119 -10.990
  698   2HD2  ASN  27          1HD2      ASN  27   2.022  25.722  -9.545
  699    HA   PRO  28           HA       PRO  28  -4.896  21.462 -11.370
  700   1HB   PRO  28          1HB       PRO  28  -5.237  21.953 -14.064
  701   2HB   PRO  28          2HB       PRO  28  -5.833  23.022 -12.758
  702   1HG   PRO  28          1HG       PRO  28  -3.265  23.281 -14.350
  703   2HG   PRO  28          2HG       PRO  28  -4.481  24.550 -13.995
  704   1HD   PRO  28          1HD       PRO  28  -2.215  24.306 -12.525
  705   2HD   PRO  28          2HD       PRO  28  -3.771  24.725 -11.742
  706    H    GLU  29           H        GLU  29  -1.789  21.445 -13.006
  707    HA   GLU  29           HA       GLU  29  -1.895  18.971 -14.374
  708   1HB   GLU  29          1HB       GLU  29  -0.099  20.922 -14.138
  709   2HB   GLU  29          2HB       GLU  29   0.588  19.898 -12.903
  710   1HG   GLU  29          1HG       GLU  29   0.028  19.047 -15.785
  711   2HG   GLU  29          2HG       GLU  29   1.564  19.690 -15.230
  712    H    LYS  30           H        LYS  30  -1.310  19.686 -11.014
  713    HA   LYS  30           HA       LYS  30  -0.921  16.842 -10.268
  714   1HB   LYS  30          1HB       LYS  30  -0.484  19.428  -8.736
  715   2HB   LYS  30          2HB       LYS  30  -0.254  17.800  -8.061
  716   1HG   LYS  30          1HG       LYS  30   1.513  17.292  -9.615
  717   2HG   LYS  30          2HG       LYS  30   1.251  18.802 -10.509
  718   1HD   LYS  30          1HD       LYS  30   1.939  20.131  -8.577
  719   2HD   LYS  30          2HD       LYS  30   2.151  18.658  -7.601
  720   1HE   LYS  30          1HE       LYS  30   3.915  17.855  -9.063
  721   2HE   LYS  30          2HE       LYS  30   3.622  19.151 -10.229
  722   1HZ   LYS  30          1HZ       LYS  30   4.409  20.752  -8.626
  723   2HZ   LYS  30          2HZ       LYS  30   4.553  19.640  -7.445
  724   3HZ   LYS  30          3HZ       LYS  30   5.544  19.586  -8.751
  725    H    LYS  31           H        LYS  31  -3.187  19.534  -9.498
  726    HA   LYS  31           HA       LYS  31  -4.813  18.039  -7.745
  727   1HB   LYS  31          1HB       LYS  31  -4.558  20.574  -8.168
  728   2HB   LYS  31          2HB       LYS  31  -5.756  20.369  -9.444
  729   1HG   LYS  31          1HG       LYS  31  -7.453  19.762  -7.888
  730   2HG   LYS  31          2HG       LYS  31  -6.278  19.342  -6.625
  731   1HD   LYS  31          1HD       LYS  31  -5.636  21.671  -6.356
  732   2HD   LYS  31          2HD       LYS  31  -6.742  22.184  -7.640
  733   1HE   LYS  31          1HE       LYS  31  -7.588  20.754  -5.075
  734   2HE   LYS  31          2HE       LYS  31  -7.543  22.511  -5.242
  735   1HZ   LYS  31          1HZ       LYS  31  -9.172  22.336  -7.040
  736   2HZ   LYS  31          2HZ       LYS  31  -9.233  20.707  -6.889
  737   3HZ   LYS  31          3HZ       LYS  31  -9.765  21.661  -5.679
  738    H    SER  32           H        SER  32  -4.381  17.249 -10.892
  739    HA   SER  32           HA       SER  32  -6.867  15.597 -10.814
  740   1HB   SER  32          1HB       SER  32  -5.424  16.662 -13.281
  741   2HB   SER  32          2HB       SER  32  -6.794  15.535 -13.303
  742    HG   SER  32           HG       SER  32  -7.420  17.740 -13.606
  743    H    VAL  33           H        VAL  33  -3.829  15.286 -10.017
  744    HA   VAL  33           HA       VAL  33  -3.625  12.456 -11.009
  745    HB   VAL  33           HB       VAL  33  -1.417  14.393 -10.229
  746   1HG1  VAL  33          1HG1      VAL  33  -0.818  12.208  -9.285
  747   2HG1  VAL  33          2HG1      VAL  33  -1.222  11.404 -10.819
  748   3HG1  VAL  33          3HG1      VAL  33   0.155  12.523 -10.719
  749   1HG2  VAL  33          1HG2      VAL  33  -1.942  12.819 -12.794
  750   2HG2  VAL  33          2HG2      VAL  33  -2.259  14.550 -12.577
  751   3HG2  VAL  33          3HG2      VAL  33  -0.600  13.948 -12.503
  752    H    LEU  34           H        LEU  34  -2.998  14.615  -8.085
  753    HA   LEU  34           HA       LEU  34  -3.067  12.258  -6.381
  754   1HB   LEU  34          1HB       LEU  34  -2.375  13.518  -4.749
  755   2HB   LEU  34          2HB       LEU  34  -1.814  14.544  -6.053
  756    HG   LEU  34           HG       LEU  34  -4.440  14.866  -4.613
  757   1HD1  LEU  34          1HD1      LEU  34  -2.385  15.141  -3.106
  758   2HD1  LEU  34          2HD1      LEU  34  -1.905  16.500  -4.132
  759   3HD1  LEU  34          3HD1      LEU  34  -3.435  16.552  -3.222
  760   1HD2  LEU  34          1HD2      LEU  34  -2.920  16.883  -6.288
  761   2HD2  LEU  34          2HD2      LEU  34  -4.417  16.040  -6.755
  762   3HD2  LEU  34          3HD2      LEU  34  -4.435  17.186  -5.410
  763    H    GLN  35           H        GLN  35  -5.521  14.283  -7.766
  764    HA   GLN  35           HA       GLN  35  -7.705  13.770  -5.991
  765   1HB   GLN  35          1HB       GLN  35  -7.614  15.470  -7.775
  766   2HB   GLN  35          2HB       GLN  35  -7.592  14.202  -9.003
  767   1HG   GLN  35          1HG       GLN  35  -9.811  15.148  -8.854
  768   2HG   GLN  35          2HG       GLN  35  -9.866  13.487  -8.295
  769   1HE2  GLN  35          2HE2      GLN  35 -11.289  13.329  -6.557
  770   2HE2  GLN  35          1HE2      GLN  35 -11.474  14.571  -5.329
  771    H    LYS  36           H        LYS  36  -6.206  11.764  -8.543
  772    HA   LYS  36           HA       LYS  36  -8.383   9.808  -8.558
  773   1HB   LYS  36          1HB       LYS  36  -5.498   9.611  -9.596
  774   2HB   LYS  36          2HB       LYS  36  -6.797   8.466  -9.950
  775   1HG   LYS  36          1HG       LYS  36  -8.069  10.232 -11.122
  776   2HG   LYS  36          2HG       LYS  36  -6.793  11.410 -10.763
  777   1HD   LYS  36          1HD       LYS  36  -5.163  10.064 -12.047
  778   2HD   LYS  36          2HD       LYS  36  -6.434   8.878 -12.424
  779   1HE   LYS  36          1HE       LYS  36  -7.749  10.651 -13.561
  780   2HE   LYS  36          2HE       LYS  36  -6.502  11.840 -13.169
  781   1HZ   LYS  36          1HZ       LYS  36  -4.942  10.563 -14.537
  782   2HZ   LYS  36          2HZ       LYS  36  -6.093   9.459 -14.901
  783   3HZ   LYS  36          3HZ       LYS  36  -6.237  10.996 -15.427
  784    H    ILE  37           H        ILE  37  -5.211   9.980  -6.971
  785    HA   ILE  37           HA       ILE  37  -5.480   7.445  -5.548
  786    HB   ILE  37           HB       ILE  37  -4.013  10.015  -4.776
  787   1HG1  ILE  37          1HG1      ILE  37  -2.869   7.578  -6.128
  788   2HG1  ILE  37          2HG1      ILE  37  -3.151   9.175  -6.851
  789   1HG2  ILE  37          1HG2      ILE  37  -4.325   8.742  -2.766
  790   2HG2  ILE  37          2HG2      ILE  37  -4.010   7.212  -3.604
  791   3HG2  ILE  37          3HG2      ILE  37  -2.696   8.334  -3.278
  792   1HD1  ILE  37          1HD1      ILE  37  -1.523  10.140  -5.185
  793   2HD1  ILE  37          2HD1      ILE  37  -1.077   8.461  -4.773
  794   3HD1  ILE  37          3HD1      ILE  37  -0.840   9.059  -6.412
  795    H    LEU  38           H        LEU  38  -6.290  10.877  -4.518
  796    HA   LEU  38           HA       LEU  38  -7.398   9.927  -2.111
  797   1HB   LEU  38          1HB       LEU  38  -7.885  12.023  -1.518
  798   2HB   LEU  38          2HB       LEU  38  -6.618  12.247  -2.707
  799    HG   LEU  38           HG       LEU  38  -8.636  12.482  -4.345
  800   1HD1  LEU  38          1HD1      LEU  38 -10.479  12.058  -2.732
  801   2HD1  LEU  38          2HD1      LEU  38  -9.897  13.388  -1.716
  802   3HD1  LEU  38          3HD1      LEU  38 -10.557  13.713  -3.329
  803   1HD2  LEU  38          1HD2      LEU  38  -7.859  14.673  -2.355
  804   2HD2  LEU  38          2HD2      LEU  38  -6.963  14.255  -3.827
  805   3HD2  LEU  38          3HD2      LEU  38  -8.584  14.958  -3.952
  806    H    GLU  39           H        GLU  39  -9.020  10.086  -5.290
  807    HA   GLU  39           HA       GLU  39 -11.595   9.393  -4.161
  808   1HB   GLU  39          1HB       GLU  39 -11.272  10.470  -6.386
  809   2HB   GLU  39          2HB       GLU  39 -10.464   9.011  -6.976
  810   1HG   GLU  39          1HG       GLU  39 -12.549   7.721  -6.683
  811   2HG   GLU  39          2HG       GLU  39 -13.346   9.138  -5.991
  812    H    ASP  40           H        ASP  40  -8.903   7.397  -5.432
  813    HA   ASP  40           HA       ASP  40 -10.132   4.829  -5.097
  814   1HB   ASP  40          1HB       ASP  40  -7.360   6.045  -5.312
  815   2HB   ASP  40          2HB       ASP  40  -7.474   4.450  -4.780
  816    H    GLU  41           H        GLU  41  -8.425   7.012  -2.826
  817    HA   GLU  41           HA       GLU  41  -8.266   4.926  -0.750
  818   1HB   GLU  41          1HB       GLU  41  -7.852   7.913  -0.570
  819   2HB   GLU  41          2HB       GLU  41  -7.556   6.777   0.746
  820   1HG   GLU  41          1HG       GLU  41  -5.979   7.082  -1.820
  821   2HG   GLU  41          2HG       GLU  41  -5.482   7.509  -0.203
  822    H    GLU  42           H        GLU  42 -10.406   7.723  -1.394
  823    HA   GLU  42           HA       GLU  42 -12.078   7.456   0.888
  824   1HB   GLU  42          1HB       GLU  42 -12.093   9.297  -0.873
  825   2HB   GLU  42          2HB       GLU  42 -12.948   8.179  -1.935
  826   1HG   GLU  42          1HG       GLU  42 -14.610   9.541  -1.003
  827   2HG   GLU  42          2HG       GLU  42 -14.756   8.035  -0.116
  828    H    LYS  43           H        LYS  43 -12.042   5.615  -2.162
  829    HA   LYS  43           HA       LYS  43 -14.361   4.000  -1.607
  830   1HB   LYS  43          1HB       LYS  43 -12.819   4.349  -3.816
  831   2HB   LYS  43          2HB       LYS  43 -12.075   2.877  -3.219
  832   1HG   LYS  43          1HG       LYS  43 -13.747   2.162  -4.708
  833   2HG   LYS  43          2HG       LYS  43 -14.456   1.901  -3.109
  834   1HD   LYS  43          1HD       LYS  43 -15.732   4.043  -3.346
  835   2HD   LYS  43          2HD       LYS  43 -14.995   4.282  -4.944
  836   1HE   LYS  43          1HE       LYS  43 -16.001   2.129  -5.706
  837   2HE   LYS  43          2HE       LYS  43 -16.757   1.928  -4.119
  838   1HZ   LYS  43          1HZ       LYS  43 -17.997   3.992  -4.527
  839   2HZ   LYS  43          2HZ       LYS  43 -17.305   4.167  -5.998
  840   3HZ   LYS  43          3HZ       LYS  43 -18.303   2.911  -5.709
  841    H    HIS  44           H        HIS  44 -10.827   3.402  -0.848
  842    HA   HIS  44           HA       HIS  44 -11.192   0.901   0.359
  843   1HB   HIS  44          1HB       HIS  44  -9.202   3.138   0.971
  844   2HB   HIS  44          2HB       HIS  44  -9.101   1.460   1.377
  845    HD2  HIS  44           2HD      HIS  44 -10.232   0.952  -1.903
  846    HE1  HIS  44           1HE      HIS  44  -6.118   1.786  -2.594
  847    HE2  HIS  44           2HE      HIS  44  -8.295   0.969  -3.654
  848    H    ILE  45           H        ILE  45 -11.501   4.208   1.718
  849    HA   ILE  45           HA       ILE  45 -11.753   3.412   4.457
  850    HB   ILE  45           HB       ILE  45 -12.259   5.877   2.838
  851   1HG1  ILE  45          1HG1      ILE  45 -11.052   6.913   4.799
  852   2HG1  ILE  45          2HG1      ILE  45 -10.932   5.313   5.523
  853   1HG2  ILE  45          1HG2      ILE  45 -14.382   5.851   4.009
  854   2HG2  ILE  45          2HG2      ILE  45 -13.568   5.534   5.563
  855   3HG2  ILE  45          3HG2      ILE  45 -13.337   7.077   4.705
  856   1HD1  ILE  45          1HD1      ILE  45  -9.545   4.586   3.550
  857   2HD1  ILE  45          2HD1      ILE  45  -9.628   6.271   2.959
  858   3HD1  ILE  45          3HD1      ILE  45  -8.840   5.907   4.496
  859    H    GLU  46           H        GLU  46 -14.293   3.788   1.915
  860    HA   GLU  46           HA       GLU  46 -16.498   3.077   3.579
  861   1HB   GLU  46          1HB       GLU  46 -15.953   2.756   0.602
  862   2HB   GLU  46          2HB       GLU  46 -17.479   2.337   1.341
  863   1HG   GLU  46          1HG       GLU  46 -16.274   5.124   1.530
  864   2HG   GLU  46          2HG       GLU  46 -17.340   4.609   0.229
  865    H    TRP  47           H        TRP  47 -14.220   1.016   1.722
  866    HA   TRP  47           HA       TRP  47 -15.602  -1.443   2.294
  867   1HB   TRP  47          1HB       TRP  47 -12.698  -0.947   1.524
  868   2HB   TRP  47          2HB       TRP  47 -13.548  -2.463   1.442
  869    HD1  TRP  47           1HD      TRP  47 -16.057  -0.460  -0.065
  870    HE1  TRP  47           1HE      TRP  47 -15.762  -0.154  -2.604
  871    HE3  TRP  47           3HE      TRP  47 -11.264  -2.114  -0.542
  872    HZ2  TRP  47           2HZ      TRP  47 -13.669  -0.457  -4.564
  873    HZ3  TRP  47           3HZ      TRP  47 -10.113  -2.098  -2.741
  874    HH2  TRP  47           2HH      TRP  47 -11.291  -1.201  -4.755
  875    H    LEU  48           H        LEU  48 -12.897   0.275   3.852
  876    HA   LEU  48           HA       LEU  48 -12.206  -1.640   5.813
  877   1HB   LEU  48          1HB       LEU  48 -11.718   1.188   5.238
  878   2HB   LEU  48          2HB       LEU  48 -12.105   1.038   6.915
  879    HG   LEU  48           HG       LEU  48  -9.828   0.980   6.691
  880   1HD1  LEU  48          1HD1      LEU  48 -10.812  -0.642   8.344
  881   2HD1  LEU  48          2HD1      LEU  48 -10.541  -1.944   7.169
  882   3HD1  LEU  48          3HD1      LEU  48  -9.169  -1.043   7.822
  883   1HD2  LEU  48          1HD2      LEU  48 -10.021  -1.369   4.772
  884   2HD2  LEU  48          2HD2      LEU  48  -9.578   0.300   4.355
  885   3HD2  LEU  48          3HD2      LEU  48  -8.520  -0.658   5.404
  886    H    GLU  49           H        GLU  49 -14.537   1.034   5.989
  887    HA   GLU  49           HA       GLU  49 -15.667   0.359   8.536
  888   1HB   GLU  49          1HB       GLU  49 -16.065   2.440   6.933
  889   2HB   GLU  49          2HB       GLU  49 -17.373   1.477   6.279
  890   1HG   GLU  49          1HG       GLU  49 -18.315   1.204   8.590
  891   2HG   GLU  49          2HG       GLU  49 -17.023   2.224   9.218
  892    H    THR  50           H        THR  50 -16.622  -0.721   5.277
  893    HA   THR  50           HA       THR  50 -18.750  -2.444   6.095
  894    HB   THR  50           HB       THR  50 -16.932  -2.275   3.708
  895    HG1  THR  50           1HG      THR  50 -19.748  -2.109   3.996
  896   1HG2  THR  50          1HG2      THR  50 -17.295  -4.627   3.772
  897   2HG2  THR  50          2HG2      THR  50 -19.038  -4.402   4.094
  898   3HG2  THR  50          3HG2      THR  50 -18.328  -3.912   2.526
  899    H    ILE  51           H        ILE  51 -15.304  -3.057   5.985
  900    HA   ILE  51           HA       ILE  51 -15.471  -5.826   6.836
  901    HB   ILE  51           HB       ILE  51 -13.221  -3.813   6.584
  902   1HG1  ILE  51          1HG1      ILE  51 -13.632  -6.464   5.133
  903   2HG1  ILE  51          2HG1      ILE  51 -14.341  -4.965   4.559
  904   1HG2  ILE  51          1HG2      ILE  51 -12.494  -5.211   8.444
  905   2HG2  ILE  51          2HG2      ILE  51 -12.891  -6.687   7.530
  906   3HG2  ILE  51          3HG2      ILE  51 -11.567  -5.619   7.017
  907   1HD1  ILE  51          1HD1      ILE  51 -12.322  -5.311   3.335
  908   2HD1  ILE  51          2HD1      ILE  51 -12.045  -3.945   4.430
  909   3HD1  ILE  51          3HD1      ILE  51 -11.367  -5.550   4.801
  910    H    ASN  52           H        ASN  52 -15.907  -2.972   8.512
  911    HA   ASN  52           HA       ASN  52 -15.520  -4.304  11.160
  912   1HB   ASN  52          1HB       ASN  52 -13.835  -2.549  10.545
  913   2HB   ASN  52          2HB       ASN  52 -15.140  -1.364  10.458
  914   1HD2  ASN  52          2HD2      ASN  52 -14.064  -3.930  12.807
  915   2HD2  ASN  52          1HD2      ASN  52 -14.159  -2.852  14.188
  916    H    GLY  53           H        GLY  53 -17.955  -4.357   9.554
  917   1HA   GLY  53          1HA       GLY  53 -19.859  -3.738  11.680
  918   2HA   GLY  53          2HA       GLY  53 -20.074  -2.732  10.246
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1   9.658  22.972   0.638
    2   2H    MET   1          2H        MET   1  10.443  23.055  -0.795
    3   3H    MET   1          3H        MET   1   9.744  24.391  -0.164
    4    HA   MET   1           HA       MET   1   7.551  23.485  -0.395
    5   1HB   MET   1          1HB       MET   1   9.196  23.511  -2.951
    6   2HB   MET   1          2HB       MET   1   7.455  23.205  -2.929
    7   1HG   MET   1          1HG       MET   1   7.078  25.350  -1.753
    8   2HG   MET   1          2HG       MET   1   8.804  25.717  -1.882
    9   1HE   MET   1          1HE       MET   1   6.306  27.548  -2.869
   10   2HE   MET   1          2HE       MET   1   8.006  28.069  -2.940
   11   3HE   MET   1          3HE       MET   1   6.976  28.189  -4.384
   12    H    ASP   2           H        ASP   2   9.752  21.203  -2.162
   13    HA   ASP   2           HA       ASP   2   7.993  19.257  -2.761
   14   1HB   ASP   2          1HB       ASP   2  10.437  19.460  -3.330
   15   2HB   ASP   2          2HB       ASP   2  10.819  18.712  -1.783
   16    H    TYR   3           H        TYR   3   6.776  17.755  -1.858
   17    HA   TYR   3           HA       TYR   3   7.220  16.854   0.942
   18   1HB   TYR   3          1HB       TYR   3   4.792  17.220   1.339
   19   2HB   TYR   3          2HB       TYR   3   5.605  18.716   0.907
   20    HD1  TYR   3           1HD      TYR   3   5.055  19.908  -1.145
   21    HD2  TYR   3           2HD      TYR   3   3.336  16.035  -0.357
   22    HE1  TYR   3           1HE      TYR   3   3.584  20.164  -3.131
   23    HE2  TYR   3           2HE      TYR   3   1.881  16.283  -2.374
   24    HH   TYR   3           HH       TYR   3   2.033  19.167  -4.475
   25    H    LEU   4           H        LEU   4   6.838  15.760  -2.142
   26    HA   LEU   4           HA       LEU   4   4.727  13.877  -1.781
   27   1HB   LEU   4          1HB       LEU   4   5.228  13.094  -3.981
   28   2HB   LEU   4          2HB       LEU   4   5.383  14.845  -3.926
   29    HG   LEU   4           HG       LEU   4   7.985  13.983  -3.387
   30   1HD1  LEU   4          1HD1      LEU   4   7.361  11.649  -3.997
   31   2HD1  LEU   4          2HD1      LEU   4   6.845  12.221  -5.598
   32   3HD1  LEU   4          3HD1      LEU   4   8.546  12.346  -5.110
   33   1HD2  LEU   4          1HD2      LEU   4   6.767  14.736  -6.061
   34   2HD2  LEU   4          2HD2      LEU   4   7.417  15.842  -4.842
   35   3HD2  LEU   4          3HD2      LEU   4   8.503  14.728  -5.682
   36    H    ARG   5           H        ARG   5   8.153  13.541  -1.189
   37    HA   ARG   5           HA       ARG   5   8.198  10.637  -0.960
   38   1HB   ARG   5          1HB       ARG   5  10.096  12.502  -1.311
   39   2HB   ARG   5          2HB       ARG   5  10.193  12.429   0.440
   40   1HG   ARG   5          1HG       ARG   5  10.466  10.045  -1.465
   41   2HG   ARG   5          2HG       ARG   5  11.812  11.003  -0.846
   42   1HD   ARG   5          1HD       ARG   5  11.141  10.368   1.486
   43   2HD   ARG   5          2HD       ARG   5   9.955   9.242   0.788
   44    HE   ARG   5           HE       ARG   5  12.169   8.442  -0.502
   45   1HH1  ARG   5          1HH2      ARG   5  11.771   9.024   2.929
   46   2HH1  ARG   5          2HH2      ARG   5  13.025   7.891   3.356
   47   1HH2  ARG   5          1HH1      ARG   5  13.746   7.013   0.110
   48   2HH2  ARG   5          2HH1      ARG   5  14.098   6.773   1.796
   49    H    GLU   6           H        GLU   6   7.440  13.297   1.198
   50    HA   GLU   6           HA       GLU   6   7.383  11.810   3.663
   51   1HB   GLU   6          1HB       GLU   6   7.432  14.400   3.264
   52   2HB   GLU   6          2HB       GLU   6   5.703  14.260   3.004
   53   1HG   GLU   6          1HG       GLU   6   5.964  14.869   5.268
   54   2HG   GLU   6          2HG       GLU   6   5.503  13.173   5.293
   55    H    LEU   7           H        LEU   7   4.942  12.502   1.168
   56    HA   LEU   7           HA       LEU   7   2.734  11.156   2.454
   57   1HB   LEU   7          1HB       LEU   7   3.199  11.518  -0.540
   58   2HB   LEU   7          2HB       LEU   7   1.675  11.171   0.262
   59    HG   LEU   7           HG       LEU   7   3.274  13.751   0.420
   60   1HD1  LEU   7          1HD1      LEU   7   2.033  13.410  -1.675
   61   2HD1  LEU   7          2HD1      LEU   7   0.550  13.087  -0.750
   62   3HD1  LEU   7          3HD1      LEU   7   1.288  14.694  -0.702
   63   1HD2  LEU   7          1HD2      LEU   7   0.642  13.056   1.777
   64   2HD2  LEU   7          2HD2      LEU   7   2.199  13.368   2.589
   65   3HD2  LEU   7          3HD2      LEU   7   1.398  14.668   1.712
   66    H    TYR   8           H        TYR   8   4.995  10.071  -0.049
   67    HA   TYR   8           HA       TYR   8   4.235   7.489  -0.653
   68   1HB   TYR   8          1HB       TYR   8   6.364   9.191  -1.111
   69   2HB   TYR   8          2HB       TYR   8   7.161   8.088  -0.065
   70    HD1  TYR   8           1HD      TYR   8   7.328   8.967  -3.170
   71    HD2  TYR   8           2HD      TYR   8   6.245   5.398  -1.001
   72    HE1  TYR   8           1HE      TYR   8   8.156   7.566  -5.049
   73    HE2  TYR   8           2HE      TYR   8   7.091   4.007  -2.874
   74    HH   TYR   8           HH       TYR   8   8.132   3.989  -4.914
   75    H    LYS   9           H        LYS   9   6.185   8.409   2.182
   76    HA   LYS   9           HA       LYS   9   6.642   5.700   2.963
   77   1HB   LYS   9          1HB       LYS   9   7.984   7.769   3.615
   78   2HB   LYS   9          2HB       LYS   9   6.714   8.173   4.775
   79   1HG   LYS   9          1HG       LYS   9   7.156   6.081   6.011
   80   2HG   LYS   9          2HG       LYS   9   8.328   5.578   4.774
   81   1HD   LYS   9          1HD       LYS   9   9.690   7.618   5.271
   82   2HD   LYS   9          2HD       LYS   9   8.585   8.032   6.582
   83   1HE   LYS   9          1HE       LYS   9  10.185   5.433   6.395
   84   2HE   LYS   9          2HE       LYS   9  10.736   6.874   7.251
   85   1HZ   LYS   9          1HZ       LYS   9   8.785   6.700   8.698
   86   2HZ   LYS   9          2HZ       LYS   9   8.288   5.338   7.935
   87   3HZ   LYS   9          3HZ       LYS   9   9.684   5.343   8.779
   88    H    LEU  10           H        LEU  10   4.285   7.919   4.521
   89    HA   LEU  10           HA       LEU  10   2.970   5.900   5.929
   90   1HB   LEU  10          1HB       LEU  10   1.882   8.524   4.833
   91   2HB   LEU  10          2HB       LEU  10   1.025   7.450   5.932
   92    HG   LEU  10           HG       LEU  10   3.323   7.658   7.333
   93   1HD1  LEU  10          1HD1      LEU  10   4.523   9.182   5.915
   94   2HD1  LEU  10          2HD1      LEU  10   3.145  10.291   5.843
   95   3HD1  LEU  10          3HD1      LEU  10   4.037  10.056   7.361
   96   1HD2  LEU  10          1HD2      LEU  10   1.056   9.699   7.359
   97   2HD2  LEU  10          2HD2      LEU  10   1.071   8.135   8.200
   98   3HD2  LEU  10          3HD2      LEU  10   2.197   9.406   8.693
   99    H    GLU  11           H        GLU  11   2.524   6.961   2.566
  100    HA   GLU  11           HA       GLU  11   0.360   5.259   1.846
  101   1HB   GLU  11          1HB       GLU  11   2.528   6.811   0.523
  102   2HB   GLU  11          2HB       GLU  11   1.938   5.572  -0.478
  103   1HG   GLU  11          1HG       GLU  11   0.208   7.682   0.923
  104   2HG   GLU  11          2HG       GLU  11   0.825   7.829  -0.715
  105    H    GLN  12           H        GLN  12   3.935   4.420   1.958
  106    HA   GLN  12           HA       GLN  12   3.272   1.692   1.180
  107   1HB   GLN  12          1HB       GLN  12   5.787   3.140   2.020
  108   2HB   GLN  12          2HB       GLN  12   5.729   1.378   1.800
  109   1HG   GLN  12          1HG       GLN  12   4.750   1.692  -0.447
  110   2HG   GLN  12          2HG       GLN  12   4.965   3.430  -0.289
  111   1HE2  GLN  12          2HE2      GLN  12   7.507   3.839   0.633
  112   2HE2  GLN  12          1HE2      GLN  12   8.682   3.015  -0.381
  113    H    GLN  13           H        GLN  13   3.600   3.341   4.234
  114    HA   GLN  13           HA       GLN  13   3.973   0.976   5.841
  115   1HB   GLN  13          1HB       GLN  13   2.678   3.675   6.436
  116   2HB   GLN  13          2HB       GLN  13   2.785   2.421   7.658
  117   1HG   GLN  13          1HG       GLN  13   5.289   3.400   6.242
  118   2HG   GLN  13          2HG       GLN  13   4.600   4.261   7.612
  119   1HE2  GLN  13          2HE2      GLN  13   5.223   3.572   9.670
  120   2HE2  GLN  13          1HE2      GLN  13   6.025   2.037   9.963
  121    H    ALA  14           H        ALA  14   1.053   2.268   4.284
  122    HA   ALA  14           HA       ALA  14  -0.735   0.392   5.664
  123   1HB   ALA  14          1HB       ALA  14  -1.546   2.528   4.677
  124   2HB   ALA  14          2HB       ALA  14  -1.041   1.987   3.059
  125   3HB   ALA  14          3HB       ALA  14  -2.333   1.129   3.927
  126    H    MET  15           H        MET  15   0.950   0.444   2.462
  127    HA   MET  15           HA       MET  15   0.131  -2.154   1.504
  128   1HB   MET  15          1HB       MET  15   2.676  -0.484   1.152
  129   2HB   MET  15          2HB       MET  15   2.493  -2.044   0.397
  130   1HG   MET  15          1HG       MET  15   0.683   0.360  -0.022
  131   2HG   MET  15          2HG       MET  15   1.920  -0.227  -1.132
  132   1HE   MET  15          1HE       MET  15   1.906  -2.800  -1.986
  133   2HE   MET  15          2HE       MET  15   1.153  -3.622  -0.594
  134   3HE   MET  15          3HE       MET  15   0.411  -3.739  -2.202
  135    H    LYS  16           H        LYS  16   2.913  -1.285   3.638
  136    HA   LYS  16           HA       LYS  16   3.847  -3.998   3.832
  137   1HB   LYS  16          1HB       LYS  16   5.064  -1.785   4.249
  138   2HB   LYS  16          2HB       LYS  16   4.268  -1.734   5.834
  139   1HG   LYS  16          1HG       LYS  16   5.323  -3.883   6.441
  140   2HG   LYS  16          2HG       LYS  16   5.982  -4.045   4.798
  141   1HD   LYS  16          1HD       LYS  16   7.282  -1.936   5.142
  142   2HD   LYS  16          2HD       LYS  16   6.689  -1.885   6.826
  143   1HE   LYS  16          1HE       LYS  16   7.639  -4.164   7.185
  144   2HE   LYS  16          2HE       LYS  16   8.248  -4.161   5.523
  145   1HZ   LYS  16          1HZ       LYS  16   9.649  -2.244   6.110
  146   2HZ   LYS  16          2HZ       LYS  16   9.091  -2.247   7.646
  147   3HZ   LYS  16          3HZ       LYS  16   9.987  -3.496   7.100
  148    H    LEU  17           H        LEU  17   1.633  -2.061   5.847
  149    HA   LEU  17           HA       LEU  17   1.098  -4.114   7.794
  150   1HB   LEU  17          1HB       LEU  17   0.029  -1.465   7.029
  151   2HB   LEU  17          2HB       LEU  17  -1.230  -2.513   7.510
  152    HG   LEU  17           HG       LEU  17   1.298  -2.036   9.159
  153   1HD1  LEU  17          1HD1      LEU  17  -0.019   0.023   8.903
  154   2HD1  LEU  17          2HD1      LEU  17  -1.471  -0.812   9.492
  155   3HD1  LEU  17          3HD1      LEU  17  -0.074  -0.587  10.567
  156   1HD2  LEU  17          1HD2      LEU  17  -1.369  -3.296   9.954
  157   2HD2  LEU  17          2HD2      LEU  17   0.164  -4.165   9.757
  158   3HD2  LEU  17          3HD2      LEU  17  -0.009  -2.966  11.041
  159    H    TYR  18           H        TYR  18  -0.371  -3.372   4.621
  160    HA   TYR  18           HA       TYR  18  -2.415  -5.315   4.724
  161   1HB   TYR  18          1HB       TYR  18  -1.070  -3.627   2.636
  162   2HB   TYR  18          2HB       TYR  18  -2.017  -4.928   2.040
  163    HD1  TYR  18           1HD      TYR  18  -4.358  -5.119   3.680
  164    HD2  TYR  18           2HD      TYR  18  -2.255  -1.580   2.452
  165    HE1  TYR  18           1HE      TYR  18  -6.324  -3.737   4.333
  166    HE2  TYR  18           2HE      TYR  18  -4.206  -0.188   3.118
  167    HH   TYR  18           HH       TYR  18  -6.290  -0.167   4.052
  168    H    ARG  19           H        ARG  19   0.965  -5.655   3.638
  169    HA   ARG  19           HA       ARG  19   0.770  -8.394   2.763
  170   1HB   ARG  19          1HB       ARG  19   3.071  -6.775   3.929
  171   2HB   ARG  19          2HB       ARG  19   3.254  -8.424   3.331
  172   1HG   ARG  19          1HG       ARG  19   2.649  -7.795   1.082
  173   2HG   ARG  19          2HG       ARG  19   2.113  -6.199   1.593
  174   1HD   ARG  19          1HD       ARG  19   4.246  -5.964   0.527
  175   2HD   ARG  19          2HD       ARG  19   4.423  -5.606   2.252
  176    HE   ARG  19           HE       ARG  19   5.019  -8.378   1.746
  177   1HH1  ARG  19          1HH2      ARG  19   6.481  -5.234   1.234
  178   2HH1  ARG  19          2HH2      ARG  19   8.098  -5.884   1.252
  179   1HH2  ARG  19          1HH1      ARG  19   7.110  -9.136   1.762
  180   2HH2  ARG  19          2HH1      ARG  19   8.436  -8.034   1.539
  181    H    GLU  20           H        GLU  20   1.395  -7.082   6.032
  182    HA   GLU  20           HA       GLU  20   1.641  -9.733   7.247
  183   1HB   GLU  20          1HB       GLU  20   2.475  -7.263   7.967
  184   2HB   GLU  20          2HB       GLU  20   0.944  -7.235   8.802
  185   1HG   GLU  20          1HG       GLU  20   2.513  -7.992  10.398
  186   2HG   GLU  20          2HG       GLU  20   1.591  -9.419   9.939
  187    H    ALA  21           H        ALA  21  -0.900  -7.278   7.222
  188    HA   ALA  21           HA       ALA  21  -2.900  -8.711   8.638
  189   1HB   ALA  21          1HB       ALA  21  -3.084  -6.330   8.060
  190   2HB   ALA  21          2HB       ALA  21  -3.230  -6.746   6.335
  191   3HB   ALA  21          3HB       ALA  21  -4.494  -7.237   7.482
  192    H    SER  22           H        SER  22  -1.912  -9.002   5.183
  193    HA   SER  22           HA       SER  22  -3.949 -10.840   4.434
  194   1HB   SER  22          1HB       SER  22  -2.320  -9.633   2.902
  195   2HB   SER  22          2HB       SER  22  -1.103 -10.834   3.374
  196    HG   SER  22           HG       SER  22  -3.522 -11.146   1.946
  197    H    GLU  23           H        GLU  23  -0.841 -11.437   6.166
  198    HA   GLU  23           HA       GLU  23  -1.139 -14.340   6.148
  199   1HB   GLU  23          1HB       GLU  23   0.976 -12.895   6.618
  200   2HB   GLU  23          2HB       GLU  23   0.311 -12.690   8.228
  201   1HG   GLU  23          1HG       GLU  23   1.858 -14.478   8.366
  202   2HG   GLU  23          2HG       GLU  23   0.257 -15.193   8.492
  203    H    LYS  24           H        LYS  24  -1.946 -11.738   8.423
  204    HA   LYS  24           HA       LYS  24  -3.223 -13.360  10.423
  205   1HB   LYS  24          1HB       LYS  24  -2.489 -10.642  10.128
  206   2HB   LYS  24          2HB       LYS  24  -4.240 -10.593  10.226
  207   1HG   LYS  24          1HG       LYS  24  -3.393 -10.362  12.441
  208   2HG   LYS  24          2HG       LYS  24  -4.079 -11.990  12.345
  209   1HD   LYS  24          1HD       LYS  24  -1.767 -12.913  12.013
  210   2HD   LYS  24          2HD       LYS  24  -1.115 -11.266  12.093
  211   1HE   LYS  24          1HE       LYS  24  -2.011 -11.028  14.397
  212   2HE   LYS  24          2HE       LYS  24  -2.680 -12.664  14.310
  213   1HZ   LYS  24          1HZ       LYS  24  -0.405 -13.511  14.066
  214   2HZ   LYS  24          2HZ       LYS  24   0.214 -12.000  14.146
  215   3HZ   LYS  24          3HZ       LYS  24  -0.531 -12.648  15.444
  216    H    ALA  25           H        ALA  25  -4.434 -12.283   7.413
  217    HA   ALA  25           HA       ALA  25  -7.221 -13.116   8.057
  218   1HB   ALA  25          1HB       ALA  25  -6.761 -10.651   7.614
  219   2HB   ALA  25          2HB       ALA  25  -6.303 -11.106   5.962
  220   3HB   ALA  25          3HB       ALA  25  -7.950 -11.407   6.542
  221    H    ARG  26           H        ARG  26  -5.243 -15.027   7.217
  222    HA   ARG  26           HA       ARG  26  -4.971 -15.607   4.550
  223   1HB   ARG  26          1HB       ARG  26  -4.406 -17.844   5.290
  224   2HB   ARG  26          2HB       ARG  26  -3.819 -16.645   6.434
  225   1HG   ARG  26          1HG       ARG  26  -6.235 -17.214   7.613
  226   2HG   ARG  26          2HG       ARG  26  -5.954 -18.732   6.754
  227   1HD   ARG  26          1HD       ARG  26  -3.602 -18.683   7.830
  228   2HD   ARG  26          2HD       ARG  26  -4.184 -17.356   8.816
  229    HE   ARG  26           HE       ARG  26  -5.546 -18.787  10.054
  230   1HH1  ARG  26          1HH2      ARG  26  -4.185 -20.664   7.420
  231   2HH1  ARG  26          2HH2      ARG  26  -4.723 -22.173   8.103
  232   1HH2  ARG  26          1HH1      ARG  26  -6.202 -20.746  10.859
  233   2HH2  ARG  26          2HH1      ARG  26  -5.831 -22.211   9.997
  234    H    ASN  27           H        ASN  27  -8.035 -15.936   6.191
  235    HA   ASN  27           HA       ASN  27  -9.327 -17.872   4.595
  236   1HB   ASN  27          1HB       ASN  27 -10.170 -15.424   6.226
  237   2HB   ASN  27          2HB       ASN  27 -11.281 -16.591   5.576
  238   1HD2  ASN  27          2HD2      ASN  27 -10.413 -15.808   8.442
  239   2HD2  ASN  27          1HD2      ASN  27 -10.115 -17.376   9.172
  240    HA   PRO  28           HA       PRO  28  -9.352 -15.467   0.840
  241   1HB   PRO  28          1HB       PRO  28 -11.329 -16.718  -0.633
  242   2HB   PRO  28          2HB       PRO  28  -9.686 -17.370  -0.358
  243   1HG   PRO  28          1HG       PRO  28 -12.225 -18.016   1.162
  244   2HG   PRO  28          2HG       PRO  28 -10.999 -19.153   0.513
  245   1HD   PRO  28          1HD       PRO  28 -11.000 -18.401   3.119
  246   2HD   PRO  28          2HD       PRO  28  -9.459 -18.610   2.228
  247    H    GLU  29           H        GLU  29 -12.290 -15.755   2.707
  248    HA   GLU  29           HA       GLU  29 -13.973 -13.823   1.561
  249   1HB   GLU  29          1HB       GLU  29 -13.911 -15.549   3.744
  250   2HB   GLU  29          2HB       GLU  29 -13.867 -14.008   4.535
  251   1HG   GLU  29          1HG       GLU  29 -15.946 -14.920   2.486
  252   2HG   GLU  29          2HG       GLU  29 -16.163 -14.961   4.232
  253    H    LYS  30           H        LYS  30 -11.086 -13.370   3.416
  254    HA   LYS  30           HA       LYS  30 -11.380 -10.422   3.134
  255   1HB   LYS  30          1HB       LYS  30 -10.321 -11.977   5.480
  256   2HB   LYS  30          2HB       LYS  30  -9.461 -10.512   5.007
  257   1HG   LYS  30          1HG       LYS  30 -10.968  -9.735   6.583
  258   2HG   LYS  30          2HG       LYS  30 -11.639  -9.255   5.036
  259   1HD   LYS  30          1HD       LYS  30 -12.953 -11.675   5.448
  260   2HD   LYS  30          2HD       LYS  30 -12.650 -11.164   7.101
  261   1HE   LYS  30          1HE       LYS  30 -14.638 -10.066   6.808
  262   2HE   LYS  30          2HE       LYS  30 -13.562  -8.813   6.180
  263   1HZ   LYS  30          1HZ       LYS  30 -13.995  -9.931   3.915
  264   2HZ   LYS  30          2HZ       LYS  30 -15.165 -10.784   4.638
  265   3HZ   LYS  30          3HZ       LYS  30 -15.297  -9.157   4.575
  266    H    LYS  31           H        LYS  31  -9.066 -13.114   2.838
  267    HA   LYS  31           HA       LYS  31  -6.942 -11.586   1.816
  268   1HB   LYS  31          1HB       LYS  31  -6.898 -13.982   2.586
  269   2HB   LYS  31          2HB       LYS  31  -7.545 -14.450   1.022
  270   1HG   LYS  31          1HG       LYS  31  -5.602 -13.838  -0.139
  271   2HG   LYS  31          2HG       LYS  31  -5.049 -12.751   1.150
  272   1HD   LYS  31          1HD       LYS  31  -4.444 -14.578   2.577
  273   2HD   LYS  31          2HD       LYS  31  -5.249 -15.758   1.534
  274   1HE   LYS  31          1HE       LYS  31  -2.808 -15.860   1.319
  275   2HE   LYS  31          2HE       LYS  31  -3.594 -15.470  -0.212
  276   1HZ   LYS  31          1HZ       LYS  31  -2.919 -13.199   0.021
  277   2HZ   LYS  31          2HZ       LYS  31  -2.416 -13.381   1.554
  278   3HZ   LYS  31          3HZ       LYS  31  -1.589 -14.091   0.327
  279    H    SER  32           H        SER  32  -9.878 -12.247   0.146
  280    HA   SER  32           HA       SER  32  -8.693 -11.109  -2.356
  281   1HB   SER  32          1HB       SER  32 -11.439 -12.380  -2.021
  282   2HB   SER  32          2HB       SER  32 -10.618 -11.962  -3.533
  283    HG   SER  32           HG       SER  32 -10.018 -14.017  -1.681
  284    H    VAL  33           H        VAL  33  -9.858  -9.779   0.287
  285    HA   VAL  33           HA       VAL  33 -11.372  -7.609  -1.140
  286    HB   VAL  33           HB       VAL  33 -11.547  -8.447   1.777
  287   1HG1  VAL  33          1HG1      VAL  33 -11.867  -6.014   1.562
  288   2HG1  VAL  33          2HG1      VAL  33 -13.034  -6.266   0.245
  289   3HG1  VAL  33          3HG1      VAL  33 -13.406  -6.805   1.897
  290   1HG2  VAL  33          1HG2      VAL  33 -13.553  -8.665  -0.515
  291   2HG2  VAL  33          2HG2      VAL  33 -12.737 -10.020   0.298
  292   3HG2  VAL  33          3HG2      VAL  33 -13.893  -9.031   1.190
  293    H    LEU  34           H        LEU  34  -8.888  -8.221   1.503
  294    HA   LEU  34           HA       LEU  34  -8.060  -5.437   1.384
  295   1HB   LEU  34          1HB       LEU  34  -6.839  -5.846   3.148
  296   2HB   LEU  34          2HB       LEU  34  -7.946  -7.189   3.361
  297    HG   LEU  34           HG       LEU  34  -5.257  -7.313   2.020
  298   1HD1  LEU  34          1HD1      LEU  34  -5.258  -6.814   4.580
  299   2HD1  LEU  34          2HD1      LEU  34  -5.944  -8.419   4.791
  300   3HD1  LEU  34          3HD1      LEU  34  -4.335  -8.230   4.056
  301   1HD2  LEU  34          1HD2      LEU  34  -6.934  -9.614   3.054
  302   2HD2  LEU  34          2HD2      LEU  34  -6.697  -9.205   1.339
  303   3HD2  LEU  34          3HD2      LEU  34  -5.326  -9.739   2.315
  304    H    GLN  35           H        GLN  35  -7.457  -8.248  -0.579
  305    HA   GLN  35           HA       GLN  35  -4.965  -7.420  -1.689
  306   1HB   GLN  35          1HB       GLN  35  -5.802  -9.673  -1.890
  307   2HB   GLN  35          2HB       GLN  35  -7.219  -9.126  -2.808
  308   1HG   GLN  35          1HG       GLN  35  -5.694  -8.422  -4.664
  309   2HG   GLN  35          2HG       GLN  35  -4.306  -8.935  -3.700
  310   1HE2  GLN  35          2HE2      GLN  35  -3.524 -10.824  -4.676
  311   2HE2  GLN  35          1HE2      GLN  35  -4.561 -12.146  -5.189
  312    H    LYS  36           H        LYS  36  -8.360  -6.544  -2.495
  313    HA   LYS  36           HA       LYS  36  -7.578  -5.180  -4.940
  314   1HB   LYS  36          1HB       LYS  36  -9.878  -6.201  -4.298
  315   2HB   LYS  36          2HB       LYS  36 -10.183  -4.679  -3.446
  316   1HG   LYS  36          1HG       LYS  36  -9.891  -3.422  -5.538
  317   2HG   LYS  36          2HG       LYS  36  -9.321  -4.879  -6.374
  318   1HD   LYS  36          1HD       LYS  36 -11.566  -5.943  -5.924
  319   2HD   LYS  36          2HD       LYS  36 -12.147  -4.379  -5.339
  320   1HE   LYS  36          1HE       LYS  36 -10.966  -4.914  -8.112
  321   2HE   LYS  36          2HE       LYS  36 -12.692  -4.934  -7.754
  322   1HZ   LYS  36          1HZ       LYS  36 -12.535  -2.596  -7.108
  323   2HZ   LYS  36          2HZ       LYS  36 -10.930  -2.560  -7.444
  324   3HZ   LYS  36          3HZ       LYS  36 -12.013  -2.791  -8.640
  325    H    ILE  37           H        ILE  37  -7.945  -4.136  -1.596
  326    HA   ILE  37           HA       ILE  37  -7.252  -1.321  -2.090
  327    HB   ILE  37           HB       ILE  37  -6.760  -3.146   0.314
  328   1HG1  ILE  37          1HG1      ILE  37  -8.918  -1.093  -0.057
  329   2HG1  ILE  37          2HG1      ILE  37  -9.085  -2.864  -0.053
  330   1HG2  ILE  37          1HG2      ILE  37  -5.117  -1.382   0.445
  331   2HG2  ILE  37          2HG2      ILE  37  -6.299  -0.169  -0.071
  332   3HG2  ILE  37          3HG2      ILE  37  -6.404  -0.883   1.528
  333   1HD1  ILE  37          1HD1      ILE  37  -8.237  -2.854   2.336
  334   2HD1  ILE  37          2HD1      ILE  37  -8.456  -1.081   2.311
  335   3HD1  ILE  37          3HD1      ILE  37  -9.839  -2.143   2.067
  336    H    LEU  38           H        LEU  38  -5.118  -4.190  -1.120
  337    HA   LEU  38           HA       LEU  38  -2.866  -2.551  -1.436
  338   1HB   LEU  38          1HB       LEU  38  -1.506  -4.253  -0.899
  339   2HB   LEU  38          2HB       LEU  38  -3.030  -4.634  -0.136
  340    HG   LEU  38           HG       LEU  38  -3.420  -5.989  -2.347
  341   1HD1  LEU  38          1HD1      LEU  38  -1.296  -5.401  -3.490
  342   2HD1  LEU  38          2HD1      LEU  38  -0.383  -6.088  -2.133
  343   3HD1  LEU  38          3HD1      LEU  38  -1.385  -7.131  -3.164
  344   1HD2  LEU  38          1HD2      LEU  38  -3.335  -6.946  -0.051
  345   2HD2  LEU  38          2HD2      LEU  38  -2.515  -8.014  -1.203
  346   3HD2  LEU  38          3HD2      LEU  38  -1.561  -6.966  -0.128
  347    H    GLU  39           H        GLU  39  -4.599  -4.167  -4.024
  348    HA   GLU  39           HA       GLU  39  -2.542  -3.588  -5.992
  349   1HB   GLU  39          1HB       GLU  39  -4.258  -5.439  -6.048
  350   2HB   GLU  39          2HB       GLU  39  -5.493  -4.240  -6.409
  351   1HG   GLU  39          1HG       GLU  39  -3.076  -4.213  -8.189
  352   2HG   GLU  39          2HG       GLU  39  -3.999  -5.703  -8.223
  353    H    ASP  40           H        ASP  40  -5.481  -1.799  -4.951
  354    HA   ASP  40           HA       ASP  40  -5.245   0.478  -6.747
  355   1HB   ASP  40          1HB       ASP  40  -6.421  -0.207  -4.008
  356   2HB   ASP  40          2HB       ASP  40  -6.333   1.394  -4.451
  357    H    GLU  41           H        GLU  41  -3.850  -0.438  -3.644
  358    HA   GLU  41           HA       GLU  41  -2.859   2.215  -3.085
  359   1HB   GLU  41          1HB       GLU  41  -3.907   0.517  -1.525
  360   2HB   GLU  41          2HB       GLU  41  -2.446  -0.444  -1.668
  361   1HG   GLU  41          1HG       GLU  41  -2.383   0.703   0.374
  362   2HG   GLU  41          2HG       GLU  41  -1.231   1.553  -0.692
  363    H    GLU  42           H        GLU  42  -1.360  -0.845  -4.153
  364    HA   GLU  42           HA       GLU  42   1.322   0.166  -4.423
  365   1HB   GLU  42          1HB       GLU  42   0.776  -2.185  -4.415
  366   2HB   GLU  42          2HB       GLU  42  -0.200  -2.046  -5.867
  367   1HG   GLU  42          1HG       GLU  42   2.761  -1.330  -5.824
  368   2HG   GLU  42          2HG       GLU  42   2.232  -3.000  -5.945
  369    H    LYS  43           H        LYS  43  -1.582   0.544  -6.450
  370    HA   LYS  43           HA       LYS  43  -0.234   1.496  -8.797
  371   1HB   LYS  43          1HB       LYS  43  -2.817   0.887  -8.320
  372   2HB   LYS  43          2HB       LYS  43  -2.958   2.595  -8.058
  373   1HG   LYS  43          1HG       LYS  43  -3.466   2.292 -10.332
  374   2HG   LYS  43          2HG       LYS  43  -1.825   2.923 -10.323
  375   1HD   LYS  43          1HD       LYS  43  -1.941   1.229 -11.973
  376   2HD   LYS  43          2HD       LYS  43  -0.962   0.562 -10.676
  377   1HE   LYS  43          1HE       LYS  43  -3.958   0.043 -10.796
  378   2HE   LYS  43          2HE       LYS  43  -2.871  -0.842 -11.862
  379   1HZ   LYS  43          1HZ       LYS  43  -1.701  -1.697  -9.918
  380   2HZ   LYS  43          2HZ       LYS  43  -2.696  -0.894  -8.892
  381   3HZ   LYS  43          3HZ       LYS  43  -3.313  -2.048  -9.833
  382    H    HIS  44           H        HIS  44  -1.367   3.281  -5.873
  383    HA   HIS  44           HA       HIS  44  -0.727   5.871  -6.690
  384   1HB   HIS  44          1HB       HIS  44  -0.521   4.539  -3.950
  385   2HB   HIS  44          2HB       HIS  44  -0.678   6.229  -4.316
  386    HD2  HIS  44           2HD      HIS  44  -3.067   5.142  -6.636
  387    HE1  HIS  44           1HE      HIS  44  -5.344   4.957  -3.063
  388    HE2  HIS  44           2HE      HIS  44  -5.431   4.829  -5.609
  389    H    ILE  45           H        ILE  45   1.355   3.277  -5.400
  390    HA   ILE  45           HA       ILE  45   3.663   4.985  -4.923
  391    HB   ILE  45           HB       ILE  45   3.048   2.050  -4.821
  392   1HG1  ILE  45          1HG1      ILE  45   4.346   2.267  -2.694
  393   2HG1  ILE  45          2HG1      ILE  45   4.571   3.983  -3.025
  394   1HG2  ILE  45          1HG2      ILE  45   5.053   1.925  -6.186
  395   2HG2  ILE  45          2HG2      ILE  45   5.900   3.054  -5.098
  396   3HG2  ILE  45          3HG2      ILE  45   5.421   1.435  -4.537
  397   1HD1  ILE  45          1HD1      ILE  45   2.114   4.325  -2.855
  398   2HD1  ILE  45          2HD1      ILE  45   1.916   2.574  -2.570
  399   3HD1  ILE  45          3HD1      ILE  45   2.780   3.571  -1.397
  400    H    GLU  46           H        GLU  46   2.578   3.035  -7.779
  401    HA   GLU  46           HA       GLU  46   4.897   3.500  -9.360
  402   1HB   GLU  46          1HB       GLU  46   1.965   3.197 -10.132
  403   2HB   GLU  46          2HB       GLU  46   3.286   3.214 -11.269
  404   1HG   GLU  46          1HG       GLU  46   3.051   1.171  -9.038
  405   2HG   GLU  46          2HG       GLU  46   2.386   0.953 -10.654
  406    H    TRP  47           H        TRP  47   1.945   5.503  -8.935
  407    HA   TRP  47           HA       TRP  47   2.789   7.528 -10.782
  408   1HB   TRP  47          1HB       TRP  47   0.872   7.802  -8.433
  409   2HB   TRP  47          2HB       TRP  47   0.916   8.760  -9.891
  410    HD1  TRP  47           1HD      TRP  47   0.983   5.905 -11.755
  411    HE1  TRP  47           1HE      TRP  47  -1.246   4.668 -12.052
  412    HE3  TRP  47           3HE      TRP  47  -1.699   8.092  -7.981
  413    HZ2  TRP  47           2HZ      TRP  47  -3.889   4.705 -10.885
  414    HZ3  TRP  47           3HZ      TRP  47  -4.095   7.533  -7.625
  415    HH2  TRP  47           2HH      TRP  47  -5.180   5.787  -9.039
  416    H    LEU  48           H        LEU  48   2.939   7.286  -7.205
  417    HA   LEU  48           HA       LEU  48   4.220   9.733  -6.610
  418   1HB   LEU  48          1HB       LEU  48   4.134   6.966  -5.403
  419   2HB   LEU  48          2HB       LEU  48   5.146   8.153  -4.662
  420    HG   LEU  48           HG       LEU  48   2.200   8.662  -5.178
  421   1HD1  LEU  48          1HD1      LEU  48   2.391   6.703  -3.718
  422   2HD1  LEU  48          2HD1      LEU  48   3.558   7.551  -2.692
  423   3HD1  LEU  48          3HD1      LEU  48   1.864   8.102  -2.776
  424   1HD2  LEU  48          1HD2      LEU  48   4.189   9.941  -3.239
  425   2HD2  LEU  48          2HD2      LEU  48   3.566  10.692  -4.723
  426   3HD2  LEU  48          3HD2      LEU  48   2.466  10.350  -3.384
  427    H    GLU  49           H        GLU  49   5.689   6.626  -7.569
  428    HA   GLU  49           HA       GLU  49   8.401   7.590  -7.573
  429   1HB   GLU  49          1HB       GLU  49   7.406   5.137  -7.769
  430   2HB   GLU  49          2HB       GLU  49   7.451   5.440  -9.491
  431   1HG   GLU  49          1HG       GLU  49   9.884   6.036  -9.302
  432   2HG   GLU  49          2HG       GLU  49   9.822   5.682  -7.578
  433    H    THR  50           H        THR  50   5.985   7.372 -10.244
  434    HA   THR  50           HA       THR  50   7.808   8.480 -12.179
  435    HB   THR  50           HB       THR  50   5.451   7.246 -12.429
  436    HG1  THR  50           1HG      THR  50   5.694   7.701 -14.586
  437   1HG2  THR  50          1HG2      THR  50   4.036   9.240 -11.888
  438   2HG2  THR  50          2HG2      THR  50   4.767  10.098 -13.259
  439   3HG2  THR  50          3HG2      THR  50   3.802   8.632 -13.525
  440    H    ILE  51           H        ILE  51   5.966  10.030  -9.739
  441    HA   ILE  51           HA       ILE  51   6.393  12.735 -10.810
  442    HB   ILE  51           HB       ILE  51   4.939  11.620  -8.395
  443   1HG1  ILE  51          1HG1      ILE  51   3.785  13.126 -10.789
  444   2HG1  ILE  51          2HG1      ILE  51   3.985  11.386 -10.806
  445   1HG2  ILE  51          1HG2      ILE  51   5.710  13.815  -7.712
  446   2HG2  ILE  51          2HG2      ILE  51   5.122  14.548  -9.221
  447   3HG2  ILE  51          3HG2      ILE  51   3.989  13.898  -8.015
  448   1HD1  ILE  51          1HD1      ILE  51   2.560  11.234  -8.722
  449   2HD1  ILE  51          2HD1      ILE  51   2.185  12.956  -8.943
  450   3HD1  ILE  51          3HD1      ILE  51   1.742  11.779 -10.195
  451    H    ASN  52           H        ASN  52   8.058  10.646  -8.781
  452    HA   ASN  52           HA       ASN  52   9.616  12.619  -7.280
  453   1HB   ASN  52          1HB       ASN  52   9.255  10.288  -6.482
  454   2HB   ASN  52          2HB       ASN  52  10.136   9.672  -7.881
  455   1HD2  ASN  52          2HD2      ASN  52  10.595  11.891  -5.055
  456   2HD2  ASN  52          1HD2      ASN  52  12.285  11.460  -4.871
  457    H    GLY  53           H        GLY  53  11.991  12.866  -7.568
  458   1HA   GLY  53          1HA       GLY  53  13.099  12.589 -10.302
  459   2HA   GLY  53          2HA       GLY  53  12.877  14.227  -9.684
  460   1H    MET   1          1H        MET   1  -4.602  -8.962  18.772
  461   2H    MET   1          2H        MET   1  -4.059  -9.750  17.445
  462   3H    MET   1          3H        MET   1  -4.184 -10.543  18.868
  463    HA   MET   1           HA       MET   1  -5.951 -11.197  17.413
  464   1HB   MET   1          1HB       MET   1  -6.364 -11.185  19.841
  465   2HB   MET   1          2HB       MET   1  -6.993  -9.536  19.741
  466   1HG   MET   1          1HG       MET   1  -8.832 -10.296  18.302
  467   2HG   MET   1          2HG       MET   1  -8.113 -11.902  18.184
  468   1HE   MET   1          1HE       MET   1  -8.588  -9.620  21.474
  469   2HE   MET   1          2HE       MET   1 -10.021  -9.337  20.456
  470   3HE   MET   1          3HE       MET   1 -10.176 -10.218  21.991
  471    H    ASP   2           H        ASP   2  -6.962  -7.817  18.338
  472    HA   ASP   2           HA       ASP   2  -8.077  -7.295  15.710
  473   1HB   ASP   2          1HB       ASP   2  -8.881  -6.077  17.640
  474   2HB   ASP   2          2HB       ASP   2  -7.254  -5.505  18.022
  475    H    TYR   3           H        TYR   3  -7.198  -6.326  13.978
  476    HA   TYR   3           HA       TYR   3  -4.660  -4.884  14.121
  477   1HB   TYR   3          1HB       TYR   3  -3.683  -6.117  12.163
  478   2HB   TYR   3          2HB       TYR   3  -3.851  -7.122  13.584
  479    HD1  TYR   3           1HD      TYR   3  -5.241  -6.445  10.180
  480    HD2  TYR   3           2HD      TYR   3  -5.322  -9.037  13.630
  481    HE1  TYR   3           1HE      TYR   3  -6.590  -8.115   8.909
  482    HE2  TYR   3           2HE      TYR   3  -6.664 -10.695  12.362
  483    HH   TYR   3           HH       TYR   3  -7.702 -11.186  10.399
  484    H    LEU   4           H        LEU   4  -7.775  -4.850  13.121
  485    HA   LEU   4           HA       LEU   4  -7.287  -3.851  10.391
  486   1HB   LEU   4          1HB       LEU   4  -9.563  -4.257   9.910
  487   2HB   LEU   4          2HB       LEU   4  -8.837  -5.647  10.697
  488    HG   LEU   4           HG       LEU   4  -9.889  -4.477  12.875
  489   1HD1  LEU   4          1HD1      LEU   4 -10.926  -2.563  11.652
  490   2HD1  LEU   4          2HD1      LEU   4 -11.846  -3.708  10.667
  491   3HD1  LEU   4          3HD1      LEU   4 -12.137  -3.593  12.413
  492   1HD2  LEU   4          1HD2      LEU   4 -11.459  -6.190  10.908
  493   2HD2  LEU   4          2HD2      LEU   4 -10.325  -6.778  12.144
  494   3HD2  LEU   4          3HD2      LEU   4 -11.830  -5.990  12.636
  495    H    ARG   5           H        ARG   5  -8.554  -2.630  13.448
  496    HA   ARG   5           HA       ARG   5  -9.344  -0.008  12.461
  497   1HB   ARG   5          1HB       ARG   5  -9.989  -1.229  14.641
  498   2HB   ARG   5          2HB       ARG   5  -8.433  -0.696  15.286
  499   1HG   ARG   5          1HG       ARG   5  -9.108   1.670  14.948
  500   2HG   ARG   5          2HG       ARG   5 -10.613   1.136  14.167
  501   1HD   ARG   5          1HD       ARG   5 -11.251  -0.052  16.268
  502   2HD   ARG   5          2HD       ARG   5  -9.793   0.588  17.053
  503    HE   ARG   5           HE       ARG   5 -11.215   2.793  15.988
  504   1HH1  ARG   5          1HH2      ARG   5 -11.771   0.397  18.485
  505   2HH1  ARG   5          2HH2      ARG   5 -12.842   1.441  19.379
  506   1HH2  ARG   5          1HH1      ARG   5 -12.589   4.077  17.185
  507   2HH2  ARG   5          2HH1      ARG   5 -13.284   3.467  18.657
  508    H    GLU   6           H        GLU   6  -6.304  -1.404  13.435
  509    HA   GLU   6           HA       GLU   6  -4.693   0.956  13.574
  510   1HB   GLU   6          1HB       GLU   6  -4.149  -1.351  14.428
  511   2HB   GLU   6          2HB       GLU   6  -3.900  -1.887  12.774
  512   1HG   GLU   6          1HG       GLU   6  -2.035  -0.340  12.481
  513   2HG   GLU   6          2HG       GLU   6  -2.379   0.438  14.028
  514    H    LEU   7           H        LEU   7  -5.498  -1.214  10.863
  515    HA   LEU   7           HA       LEU   7  -3.866  -0.073   8.817
  516   1HB   LEU   7          1HB       LEU   7  -6.609  -1.405   8.600
  517   2HB   LEU   7          2HB       LEU   7  -5.582  -1.038   7.232
  518    HG   LEU   7           HG       LEU   7  -4.851  -2.958   9.461
  519   1HD1  LEU   7          1HD1      LEU   7  -6.765  -3.755   8.092
  520   2HD1  LEU   7          2HD1      LEU   7  -5.803  -3.508   6.620
  521   3HD1  LEU   7          3HD1      LEU   7  -5.309  -4.725   7.819
  522   1HD2  LEU   7          1HD2      LEU   7  -3.552  -2.435   6.764
  523   2HD2  LEU   7          2HD2      LEU   7  -2.886  -2.016   8.364
  524   3HD2  LEU   7          3HD2      LEU   7  -3.095  -3.713   7.918
  525    H    TYR   8           H        TYR   8  -7.281   0.525   9.494
  526    HA   TYR   8           HA       TYR   8  -7.967   2.483   7.617
  527   1HB   TYR   8          1HB       TYR   8  -9.163   1.092   9.642
  528   2HB   TYR   8          2HB       TYR   8  -8.855   2.479  10.583
  529    HD1  TYR   8           1HD      TYR   8 -11.462   1.391  10.424
  530    HD2  TYR   8           2HD      TYR   8  -9.622   4.268   7.776
  531    HE1  TYR   8           1HE      TYR   8 -13.698   2.334   9.894
  532    HE2  TYR   8           2HE      TYR   8 -11.866   5.216   7.284
  533    HH   TYR   8           HH       TYR   8 -14.856   3.975   8.768
  534    H    LYS   9           H        LYS   9  -6.693   3.048  10.897
  535    HA   LYS   9           HA       LYS   9  -6.712   5.894  10.678
  536   1HB   LYS   9          1HB       LYS   9  -5.247   3.922  12.497
  537   2HB   LYS   9          2HB       LYS   9  -4.981   5.665  12.653
  538   1HG   LYS   9          1HG       LYS   9  -7.431   6.026  12.918
  539   2HG   LYS   9          2HG       LYS   9  -7.698   4.283  12.860
  540   1HD   LYS   9          1HD       LYS   9  -6.007   5.732  14.950
  541   2HD   LYS   9          2HD       LYS   9  -7.698   5.251  15.159
  542   1HE   LYS   9          1HE       LYS   9  -7.063   2.868  14.795
  543   2HE   LYS   9          2HE       LYS   9  -5.368   3.348  14.652
  544   1HZ   LYS   9          1HZ       LYS   9  -5.474   4.192  16.936
  545   2HZ   LYS   9          2HZ       LYS   9  -7.044   3.768  17.075
  546   3HZ   LYS   9          3HZ       LYS   9  -5.898   2.617  16.917
  547    H    LEU  10           H        LEU  10  -3.955   3.740   9.986
  548    HA   LEU  10           HA       LEU  10  -2.318   5.896   9.144
  549   1HB   LEU  10          1HB       LEU  10  -2.236   2.907   8.784
  550   2HB   LEU  10          2HB       LEU  10  -1.087   3.919   7.911
  551    HG   LEU  10           HG       LEU  10  -1.452   4.209  10.922
  552   1HD1  LEU  10          1HD1      LEU  10  -0.852   1.880  10.486
  553   2HD1  LEU  10          2HD1      LEU  10   0.526   2.407   9.482
  554   3HD1  LEU  10          3HD1      LEU  10   0.496   2.756  11.226
  555   1HD2  LEU  10          1HD2      LEU  10   0.879   4.844   9.052
  556   2HD2  LEU  10          2HD2      LEU  10  -0.233   6.040   9.742
  557   3HD2  LEU  10          3HD2      LEU  10   0.836   5.124  10.805
  558    H    GLU  11           H        GLU  11  -4.572   3.794   7.381
  559    HA   GLU  11           HA       GLU  11  -4.320   4.939   4.790
  560   1HB   GLU  11          1HB       GLU  11  -6.162   3.219   6.310
  561   2HB   GLU  11          2HB       GLU  11  -7.064   4.085   5.192
  562   1HG   GLU  11          1HG       GLU  11  -4.516   2.459   4.565
  563   2HG   GLU  11          2HG       GLU  11  -6.134   1.793   4.542
  564    H    GLN  12           H        GLN  12  -6.070   6.324   7.648
  565    HA   GLN  12           HA       GLN  12  -6.897   8.583   5.991
  566   1HB   GLN  12          1HB       GLN  12  -7.324   7.767   8.864
  567   2HB   GLN  12          2HB       GLN  12  -7.870   9.318   8.198
  568   1HG   GLN  12          1HG       GLN  12  -9.082   8.150   6.407
  569   2HG   GLN  12          2HG       GLN  12  -8.623   6.597   7.060
  570   1HE2  GLN  12          2HE2      GLN  12 -11.333   8.237   6.784
  571   2HE2  GLN  12          1HE2      GLN  12 -12.040   7.991   8.372
  572    H    GLN  13           H        GLN  13  -4.189   7.986   8.087
  573    HA   GLN  13           HA       GLN  13  -3.475  10.811   8.424
  574   1HB   GLN  13          1HB       GLN  13  -1.854   8.222   8.556
  575   2HB   GLN  13          2HB       GLN  13  -1.120   9.819   8.742
  576   1HG   GLN  13          1HG       GLN  13  -2.560  10.318  10.673
  577   2HG   GLN  13          2HG       GLN  13  -3.365   8.761  10.502
  578   1HE2  GLN  13          2HE2      GLN  13  -2.712   8.123  12.668
  579   2HE2  GLN  13          1HE2      GLN  13  -1.036   7.696  12.989
  580    H    ALA  14           H        ALA  14  -2.889   8.467   5.790
  581    HA   ALA  14           HA       ALA  14  -1.216  10.298   4.260
  582   1HB   ALA  14          1HB       ALA  14  -1.331   7.863   3.793
  583   2HB   ALA  14          2HB       ALA  14  -3.056   8.011   3.380
  584   3HB   ALA  14          3HB       ALA  14  -1.825   8.811   2.377
  585    H    MET  15           H        MET  15  -4.730   9.759   4.575
  586    HA   MET  15           HA       MET  15  -5.543  11.510   2.441
  587   1HB   MET  15          1HB       MET  15  -6.983   9.770   3.453
  588   2HB   MET  15          2HB       MET  15  -7.057  10.665   4.960
  589   1HG   MET  15          1HG       MET  15  -8.604  12.110   4.241
  590   2HG   MET  15          2HG       MET  15  -7.846  12.327   2.668
  591   1HE   MET  15          1HE       MET  15  -8.078  11.058   0.707
  592   2HE   MET  15          2HE       MET  15  -7.716   9.465   1.379
  593   3HE   MET  15          3HE       MET  15  -9.180   9.696   0.386
  594    H    LYS  16           H        LYS  16  -5.136  12.180   5.962
  595    HA   LYS  16           HA       LYS  16  -5.858  14.971   5.756
  596   1HB   LYS  16          1HB       LYS  16  -4.251  13.362   7.765
  597   2HB   LYS  16          2HB       LYS  16  -4.535  15.110   7.930
  598   1HG   LYS  16          1HG       LYS  16  -6.989  14.740   7.761
  599   2HG   LYS  16          2HG       LYS  16  -6.726  12.991   7.667
  600   1HD   LYS  16          1HD       LYS  16  -5.731  12.990   9.908
  601   2HD   LYS  16          2HD       LYS  16  -5.893  14.766   9.998
  602   1HE   LYS  16          1HE       LYS  16  -8.347  14.561   9.724
  603   2HE   LYS  16          2HE       LYS  16  -8.203  12.801   9.633
  604   1HZ   LYS  16          1HZ       LYS  16  -7.344  12.821  11.919
  605   2HZ   LYS  16          2HZ       LYS  16  -7.463  14.450  11.998
  606   3HZ   LYS  16          3HZ       LYS  16  -8.809  13.540  11.875
  607    H    LEU  17           H        LEU  17  -2.670  13.347   5.532
  608    HA   LEU  17           HA       LEU  17  -1.162  15.681   4.933
  609   1HB   LEU  17          1HB       LEU  17  -0.813  12.806   4.817
  610   2HB   LEU  17          2HB       LEU  17  -0.243  13.450   3.305
  611    HG   LEU  17           HG       LEU  17   0.613  14.378   6.078
  612   1HD1  LEU  17          1HD1      LEU  17   1.373  12.106   5.523
  613   2HD1  LEU  17          2HD1      LEU  17   2.078  12.691   4.001
  614   3HD1  LEU  17          3HD1      LEU  17   2.738  13.231   5.562
  615   1HD2  LEU  17          1HD2      LEU  17   1.737  15.117   3.332
  616   2HD2  LEU  17          2HD2      LEU  17   0.906  16.217   4.446
  617   3HD2  LEU  17          3HD2      LEU  17   2.476  15.541   4.890
  618    H    TYR  18           H        TYR  18  -3.030  13.609   2.743
  619    HA   TYR  18           HA       TYR  18  -2.420  14.908   0.297
  620   1HB   TYR  18          1HB       TYR  18  -4.416  12.938   1.294
  621   2HB   TYR  18          2HB       TYR  18  -4.932  13.824  -0.097
  622    HD1  TYR  18           1HD      TYR  18  -3.149  14.029  -2.058
  623    HD2  TYR  18           2HD      TYR  18  -3.148  10.983   0.964
  624    HE1  TYR  18           1HE      TYR  18  -1.811  12.590  -3.547
  625    HE2  TYR  18           2HE      TYR  18  -1.542   9.672  -0.329
  626    HH   TYR  18           HH       TYR  18  -0.425   9.467  -2.390
  627    H    ARG  19           H        ARG  19  -5.122  15.568   2.557
  628    HA   ARG  19           HA       ARG  19  -6.430  17.507   0.943
  629   1HB   ARG  19          1HB       ARG  19  -7.241  16.382   3.064
  630   2HB   ARG  19          2HB       ARG  19  -6.286  17.530   3.996
  631   1HG   ARG  19          1HG       ARG  19  -8.270  18.497   1.906
  632   2HG   ARG  19          2HG       ARG  19  -8.860  17.928   3.463
  633   1HD   ARG  19          1HD       ARG  19  -7.750  19.620   4.680
  634   2HD   ARG  19          2HD       ARG  19  -6.751  20.104   3.310
  635    HE   ARG  19           HE       ARG  19  -8.978  20.717   2.174
  636   1HH1  ARG  19          1HH2      ARG  19  -8.489  21.192   5.618
  637   2HH1  ARG  19          2HH2      ARG  19  -9.617  22.520   5.672
  638   1HH2  ARG  19          1HH1      ARG  19 -10.384  22.399   2.324
  639   2HH2  ARG  19          2HH1      ARG  19 -10.653  23.183   3.853
  640    H    GLU  20           H        GLU  20  -3.630  17.894   3.081
  641    HA   GLU  20           HA       GLU  20  -3.440  20.782   2.573
  642   1HB   GLU  20          1HB       GLU  20  -2.617  19.109   4.589
  643   2HB   GLU  20          2HB       GLU  20  -1.123  19.252   3.690
  644   1HG   GLU  20          1HG       GLU  20  -1.261  21.732   3.810
  645   2HG   GLU  20          2HG       GLU  20  -2.795  21.611   4.675
  646    H    ALA  21           H        ALA  21  -1.790  17.864   1.458
  647    HA   ALA  21           HA       ALA  21   0.145  19.041  -0.236
  648   1HB   ALA  21          1HB       ALA  21  -0.040  16.614   0.284
  649   2HB   ALA  21          2HB       ALA  21  -1.441  16.515  -0.815
  650   3HB   ALA  21          3HB       ALA  21   0.149  16.952  -1.447
  651    H    SER  22           H        SER  22  -3.338  18.534  -0.882
  652    HA   SER  22           HA       SER  22  -3.460  19.565  -3.519
  653   1HB   SER  22          1HB       SER  22  -5.310  18.525  -2.063
  654   2HB   SER  22          2HB       SER  22  -5.543  20.144  -1.388
  655    HG   SER  22           HG       SER  22  -5.978  20.897  -3.505
  656    H    GLU  23           H        GLU  23  -3.061  21.351  -0.463
  657    HA   GLU  23           HA       GLU  23  -3.467  23.989  -1.687
  658   1HB   GLU  23          1HB       GLU  23  -3.863  23.196   0.795
  659   2HB   GLU  23          2HB       GLU  23  -2.143  23.508   0.982
  660   1HG   GLU  23          1HG       GLU  23  -2.465  25.835   0.161
  661   2HG   GLU  23          2HG       GLU  23  -4.190  25.527  -0.034
  662    H    LYS  24           H        LYS  24  -0.728  21.976  -0.625
  663    HA   LYS  24           HA       LYS  24   1.400  23.765  -1.443
  664   1HB   LYS  24          1HB       LYS  24   1.309  20.724  -1.268
  665   2HB   LYS  24          2HB       LYS  24   2.745  21.638  -1.728
  666   1HG   LYS  24          1HG       LYS  24   2.677  22.877   0.410
  667   2HG   LYS  24          2HG       LYS  24   1.287  21.903   0.933
  668   1HD   LYS  24          1HD       LYS  24   2.600  19.853   0.797
  669   2HD   LYS  24          2HD       LYS  24   3.979  20.714   0.107
  670   1HE   LYS  24          1HE       LYS  24   2.846  21.301   2.876
  671   2HE   LYS  24          2HE       LYS  24   4.129  20.124   2.579
  672   1HZ   LYS  24          1HZ       LYS  24   5.488  21.915   1.641
  673   2HZ   LYS  24          2HZ       LYS  24   4.320  23.021   1.944
  674   3HZ   LYS  24          3HZ       LYS  24   5.069  22.263   3.176
  675    H    ALA  25           H        ALA  25  -0.444  21.365  -3.312
  676    HA   ALA  25           HA       ALA  25   0.821  21.811  -5.850
  677   1HB   ALA  25          1HB       ALA  25  -1.985  20.879  -5.101
  678   2HB   ALA  25          2HB       ALA  25  -1.299  20.830  -6.727
  679   3HB   ALA  25          3HB       ALA  25  -0.578  19.861  -5.425
  680    H    ARG  26           H        ARG  26  -2.341  23.037  -4.746
  681    HA   ARG  26           HA       ARG  26  -3.755  24.545  -5.664
  682   1HB   ARG  26          1HB       ARG  26  -1.829  25.802  -4.204
  683   2HB   ARG  26          2HB       ARG  26  -1.606  26.642  -5.718
  684   1HG   ARG  26          1HG       ARG  26  -3.130  27.944  -4.454
  685   2HG   ARG  26          2HG       ARG  26  -4.147  27.131  -5.651
  686   1HD   ARG  26          1HD       ARG  26  -4.754  25.411  -3.912
  687   2HD   ARG  26          2HD       ARG  26  -3.689  26.220  -2.771
  688    HE   ARG  26           HE       ARG  26  -5.232  27.929  -2.461
  689   1HH1  ARG  26          1HH2      ARG  26  -6.432  25.930  -5.086
  690   2HH1  ARG  26          2HH2      ARG  26  -8.011  26.663  -5.030
  691   1HH2  ARG  26          1HH1      ARG  26  -7.262  28.804  -2.450
  692   2HH2  ARG  26          2HH1      ARG  26  -8.460  28.244  -3.579
  693    H    ASN  27           H        ASN  27  -2.323  23.033  -7.689
  694    HA   ASN  27           HA       ASN  27  -2.538  24.828 -10.070
  695   1HB   ASN  27          1HB       ASN  27  -0.195  24.496  -9.422
  696   2HB   ASN  27          2HB       ASN  27  -0.422  22.752  -9.326
  697   1HD2  ASN  27          2HD2      ASN  27   0.503  25.324 -11.408
  698   2HD2  ASN  27          1HD2      ASN  27   0.527  24.362 -12.878
  699    HA   PRO  28           HA       PRO  28  -5.476  21.835 -11.279
  700   1HB   PRO  28          1HB       PRO  28  -5.654  22.150 -14.003
  701   2HB   PRO  28          2HB       PRO  28  -6.257  23.336 -12.806
  702   1HG   PRO  28          1HG       PRO  28  -3.596  23.350 -14.262
  703   2HG   PRO  28          2HG       PRO  28  -4.764  24.700 -14.073
  704   1HD   PRO  28          1HD       PRO  28  -2.613  24.469 -12.453
  705   2HD   PRO  28          2HD       PRO  28  -4.191  24.993 -11.794
  706    H    GLU  29           H        GLU  29  -2.255  21.520 -12.672
  707    HA   GLU  29           HA       GLU  29  -2.726  19.031 -14.074
  708   1HB   GLU  29          1HB       GLU  29  -0.857  20.781 -14.382
  709   2HB   GLU  29          2HB       GLU  29  -0.045  20.017 -13.030
  710   1HG   GLU  29          1HG       GLU  29  -0.922  18.613 -15.597
  711   2HG   GLU  29          2HG       GLU  29   0.678  19.292 -15.339
  712    H    LYS  30           H        LYS  30  -1.203  19.794 -10.998
  713    HA   LYS  30           HA       LYS  30  -1.149  17.059  -9.993
  714   1HB   LYS  30          1HB       LYS  30  -0.821  19.750  -8.613
  715   2HB   LYS  30          2HB       LYS  30  -0.819  18.213  -7.746
  716   1HG   LYS  30          1HG       LYS  30   1.403  18.350  -8.027
  717   2HG   LYS  30          2HG       LYS  30   1.041  17.555  -9.555
  718   1HD   LYS  30          1HD       LYS  30   1.084  19.806 -10.685
  719   2HD   LYS  30          2HD       LYS  30   1.456  20.552  -9.111
  720   1HE   LYS  30          1HE       LYS  30   3.483  19.041  -8.961
  721   2HE   LYS  30          2HE       LYS  30   3.136  18.485 -10.603
  722   1HZ   LYS  30          1HZ       LYS  30   3.413  20.796 -11.360
  723   2HZ   LYS  30          2HZ       LYS  30   3.757  21.292  -9.837
  724   3HZ   LYS  30          3HZ       LYS  30   4.766  20.275 -10.614
  725    H    LYS  31           H        LYS  31  -3.460  19.771  -9.464
  726    HA   LYS  31           HA       LYS  31  -5.149  18.441  -7.675
  727   1HB   LYS  31          1HB       LYS  31  -5.243  20.821  -8.204
  728   2HB   LYS  31          2HB       LYS  31  -5.929  20.459  -9.787
  729   1HG   LYS  31          1HG       LYS  31  -7.350  19.409  -7.342
  730   2HG   LYS  31          2HG       LYS  31  -7.411  21.142  -7.668
  731   1HD   LYS  31          1HD       LYS  31  -8.407  20.804  -9.854
  732   2HD   LYS  31          2HD       LYS  31  -8.198  19.061  -9.748
  733   1HE   LYS  31          1HE       LYS  31 -10.489  19.497  -9.294
  734   2HE   LYS  31          2HE       LYS  31  -9.732  18.976  -7.790
  735   1HZ   LYS  31          1HZ       LYS  31  -9.647  21.319  -7.103
  736   2HZ   LYS  31          2HZ       LYS  31 -10.315  21.805  -8.517
  737   3HZ   LYS  31          3HZ       LYS  31 -11.182  20.908  -7.468
  738    H    SER  32           H        SER  32  -5.065  18.023 -11.139
  739    HA   SER  32           HA       SER  32  -7.321  16.104 -11.021
  740   1HB   SER  32          1HB       SER  32  -7.007  17.911 -12.828
  741   2HB   SER  32          2HB       SER  32  -5.701  16.906 -13.475
  742    HG   SER  32           HG       SER  32  -7.269  15.203 -13.668
  743    H    VAL  33           H        VAL  33  -4.288  15.689 -10.145
  744    HA   VAL  33           HA       VAL  33  -4.103  12.888 -11.214
  745    HB   VAL  33           HB       VAL  33  -1.961  14.904 -10.522
  746   1HG1  VAL  33          1HG1      VAL  33  -1.212  12.879  -9.383
  747   2HG1  VAL  33          2HG1      VAL  33  -1.581  11.896 -10.825
  748   3HG1  VAL  33          3HG1      VAL  33  -0.293  13.122 -10.866
  749   1HG2  VAL  33          1HG2      VAL  33  -2.377  13.051 -12.917
  750   2HG2  VAL  33          2HG2      VAL  33  -2.856  14.757 -12.870
  751   3HG2  VAL  33          3HG2      VAL  33  -1.146  14.325 -12.753
  752    H    LEU  34           H        LEU  34  -3.612  14.906  -8.177
  753    HA   LEU  34           HA       LEU  34  -3.608  12.480  -6.586
  754   1HB   LEU  34          1HB       LEU  34  -3.335  13.697  -4.775
  755   2HB   LEU  34          2HB       LEU  34  -2.646  14.811  -5.949
  756    HG   LEU  34           HG       LEU  34  -5.450  14.838  -4.904
  757   1HD1  LEU  34          1HD1      LEU  34  -4.331  15.438  -2.972
  758   2HD1  LEU  34          2HD1      LEU  34  -3.046  16.321  -3.852
  759   3HD1  LEU  34          3HD1      LEU  34  -4.678  16.998  -3.665
  760   1HD2  LEU  34          1HD2      LEU  34  -3.925  17.066  -6.283
  761   2HD2  LEU  34          2HD2      LEU  34  -5.164  16.046  -7.053
  762   3HD2  LEU  34          3HD2      LEU  34  -5.624  17.136  -5.748
  763    H    GLN  35           H        GLN  35  -6.222  14.324  -8.099
  764    HA   GLN  35           HA       GLN  35  -8.363  13.521  -6.456
  765   1HB   GLN  35          1HB       GLN  35  -8.487  15.198  -8.212
  766   2HB   GLN  35          2HB       GLN  35  -8.280  13.965  -9.466
  767   1HG   GLN  35          1HG       GLN  35 -10.438  12.945  -8.806
  768   2HG   GLN  35          2HG       GLN  35 -10.617  14.119  -7.500
  769   1HE2  GLN  35          2HE2      GLN  35 -12.029  13.480 -10.310
  770   2HE2  GLN  35          1HE2      GLN  35 -12.258  15.110 -10.927
  771    H    LYS  36           H        LYS  36  -6.690  11.629  -8.970
  772    HA   LYS  36           HA       LYS  36  -8.656   9.483  -9.006
  773   1HB   LYS  36          1HB       LYS  36  -7.034  10.189 -10.860
  774   2HB   LYS  36          2HB       LYS  36  -5.732   9.450  -9.922
  775   1HG   LYS  36          1HG       LYS  36  -6.901   7.247 -10.090
  776   2HG   LYS  36          2HG       LYS  36  -8.204   8.023 -11.014
  777   1HD   LYS  36          1HD       LYS  36  -6.563   8.704 -12.757
  778   2HD   LYS  36          2HD       LYS  36  -5.263   7.910 -11.844
  779   1HE   LYS  36          1HE       LYS  36  -6.414   5.733 -12.079
  780   2HE   LYS  36          2HE       LYS  36  -7.745   6.515 -12.945
  781   1HZ   LYS  36          1HZ       LYS  36  -6.165   7.133 -14.691
  782   2HZ   LYS  36          2HZ       LYS  36  -4.927   6.423 -13.894
  783   3HZ   LYS  36          3HZ       LYS  36  -6.150   5.517 -14.486
  784    H    ILE  37           H        ILE  37  -5.525   9.889  -7.388
  785    HA   ILE  37           HA       ILE  37  -5.575   7.408  -5.850
  786    HB   ILE  37           HB       ILE  37  -4.310  10.146  -5.419
  787   1HG1  ILE  37          1HG1      ILE  37  -3.064   7.580  -6.360
  788   2HG1  ILE  37          2HG1      ILE  37  -3.378   9.051  -7.293
  789   1HG2  ILE  37          1HG2      ILE  37  -4.584   9.217  -3.190
  790   2HG2  ILE  37          2HG2      ILE  37  -3.995   7.632  -3.732
  791   3HG2  ILE  37          3HG2      ILE  37  -2.905   9.024  -3.613
  792   1HD1  ILE  37          1HD1      ILE  37  -1.774  10.275  -5.781
  793   2HD1  ILE  37          2HD1      ILE  37  -1.307   8.686  -5.117
  794   3HD1  ILE  37          3HD1      ILE  37  -1.058   9.033  -6.827
  795    H    LEU  38           H        LEU  38  -6.845  10.737  -5.145
  796    HA   LEU  38           HA       LEU  38  -7.883  10.087  -2.584
  797   1HB   LEU  38          1HB       LEU  38  -8.688  12.140  -4.670
  798   2HB   LEU  38          2HB       LEU  38  -9.521  12.018  -3.136
  799    HG   LEU  38           HG       LEU  38  -6.526  12.557  -3.370
  800   1HD1  LEU  38          1HD1      LEU  38  -7.884  14.409  -4.305
  801   2HD1  LEU  38          2HD1      LEU  38  -8.844  14.457  -2.810
  802   3HD1  LEU  38          3HD1      LEU  38  -7.115  14.870  -2.781
  803   1HD2  LEU  38          1HD2      LEU  38  -8.484  12.593  -1.042
  804   2HD2  LEU  38          2HD2      LEU  38  -7.016  11.591  -1.228
  805   3HD2  LEU  38          3HD2      LEU  38  -6.879  13.335  -0.993
  806    H    GLU  39           H        GLU  39  -9.490   9.695  -5.811
  807    HA   GLU  39           HA       GLU  39 -11.936   8.787  -4.597
  808   1HB   GLU  39          1HB       GLU  39 -11.705   9.705  -6.925
  809   2HB   GLU  39          2HB       GLU  39 -10.829   8.243  -7.397
  810   1HG   GLU  39          1HG       GLU  39 -12.831   6.874  -6.928
  811   2HG   GLU  39          2HG       GLU  39 -13.689   8.300  -6.336
  812    H    ASP  40           H        ASP  40  -9.057   7.018  -5.693
  813    HA   ASP  40           HA       ASP  40  -9.967   4.367  -5.052
  814   1HB   ASP  40          1HB       ASP  40  -7.386   5.883  -5.513
  815   2HB   ASP  40          2HB       ASP  40  -7.280   4.355  -4.773
  816    H    GLU  41           H        GLU  41  -8.473   6.982  -3.071
  817    HA   GLU  41           HA       GLU  41  -8.101   5.179  -0.776
  818   1HB   GLU  41          1HB       GLU  41  -7.984   8.217  -0.884
  819   2HB   GLU  41          2HB       GLU  41  -7.705   7.248   0.547
  820   1HG   GLU  41          1HG       GLU  41  -5.808   7.817  -1.706
  821   2HG   GLU  41          2HG       GLU  41  -5.551   7.878  -0.013
  822    H    GLU  42           H        GLU  42 -10.598   7.527  -1.769
  823    HA   GLU  42           HA       GLU  42 -12.279   7.248   0.525
  824   1HB   GLU  42          1HB       GLU  42 -12.550   8.960  -1.250
  825   2HB   GLU  42          2HB       GLU  42 -13.074   7.704  -2.380
  826   1HG   GLU  42          1HG       GLU  42 -15.032   7.214  -0.960
  827   2HG   GLU  42          2HG       GLU  42 -14.470   8.375   0.247
  828    H    LYS  43           H        LYS  43 -12.023   5.239  -2.423
  829    HA   LYS  43           HA       LYS  43 -14.094   3.374  -1.747
  830   1HB   LYS  43          1HB       LYS  43 -12.368   3.719  -3.912
  831   2HB   LYS  43          2HB       LYS  43 -11.746   2.251  -3.190
  832   1HG   LYS  43          1HG       LYS  43 -13.305   1.580  -4.810
  833   2HG   LYS  43          2HG       LYS  43 -14.160   1.371  -3.275
  834   1HD   LYS  43          1HD       LYS  43 -15.367   3.487  -3.617
  835   2HD   LYS  43          2HD       LYS  43 -14.459   3.814  -5.094
  836   1HE   LYS  43          1HE       LYS  43 -16.266   1.384  -4.692
  837   2HE   LYS  43          2HE       LYS  43 -16.811   2.907  -5.394
  838   1HZ   LYS  43          1HZ       LYS  43 -15.171   2.627  -7.169
  839   2HZ   LYS  43          2HZ       LYS  43 -14.668   1.201  -6.545
  840   3HZ   LYS  43          3HZ       LYS  43 -16.183   1.351  -7.127
  841    H    HIS  44           H        HIS  44 -10.538   3.302  -0.872
  842    HA   HIS  44           HA       HIS  44 -10.634   0.878   0.523
  843   1HB   HIS  44          1HB       HIS  44  -8.913   3.375   0.898
  844   2HB   HIS  44          2HB       HIS  44  -8.622   1.769   1.491
  845    HD2  HIS  44           2HD      HIS  44  -9.742   0.835  -1.709
  846    HE1  HIS  44           1HE      HIS  44  -5.757   1.908  -2.631
  847    HE2  HIS  44           2HE      HIS  44  -7.864   0.816  -3.491
  848    H    ILE  45           H        ILE  45 -11.070   4.248   1.740
  849    HA   ILE  45           HA       ILE  45 -11.541   3.532   4.451
  850    HB   ILE  45           HB       ILE  45 -11.983   5.935   2.705
  851   1HG1  ILE  45          1HG1      ILE  45 -10.803   7.050   4.640
  852   2HG1  ILE  45          2HG1      ILE  45 -10.702   5.487   5.439
  853   1HG2  ILE  45          1HG2      ILE  45 -14.122   5.946   3.836
  854   2HG2  ILE  45          2HG2      ILE  45 -13.337   5.687   5.414
  855   3HG2  ILE  45          3HG2      ILE  45 -13.093   7.202   4.510
  856   1HD1  ILE  45          1HD1      ILE  45  -9.260   4.662   3.559
  857   2HD1  ILE  45          2HD1      ILE  45  -9.341   6.303   2.853
  858   3HD1  ILE  45          3HD1      ILE  45  -8.587   6.050   4.428
  859    H    GLU  46           H        GLU  46 -13.946   3.784   1.751
  860    HA   GLU  46           HA       GLU  46 -16.238   3.163   3.318
  861   1HB   GLU  46          1HB       GLU  46 -15.470   2.689   0.418
  862   2HB   GLU  46          2HB       GLU  46 -17.000   2.136   1.052
  863   1HG   GLU  46          1HG       GLU  46 -16.110   5.036   1.206
  864   2HG   GLU  46          2HG       GLU  46 -17.016   4.358  -0.145
  865    H    TRP  47           H        TRP  47 -13.885   0.954   1.741
  866    HA   TRP  47           HA       TRP  47 -15.322  -1.446   2.450
  867   1HB   TRP  47          1HB       TRP  47 -12.422  -1.012   1.682
  868   2HB   TRP  47          2HB       TRP  47 -13.268  -2.539   1.722
  869    HD1  TRP  47           1HD      TRP  47 -15.820  -0.712   0.097
  870    HE1  TRP  47           1HE      TRP  47 -15.543  -0.582  -2.464
  871    HE3  TRP  47           3HE      TRP  47 -10.974  -2.087  -0.221
  872    HZ2  TRP  47           2HZ      TRP  47 -13.425  -1.066  -4.415
  873    HZ3  TRP  47           3HZ      TRP  47  -9.764  -2.194  -2.397
  874    HH2  TRP  47           2HH      TRP  47 -10.996  -1.671  -4.513
  875    H    LEU  48           H        LEU  48 -12.617   0.358   3.931
  876    HA   LEU  48           HA       LEU  48 -12.011  -1.385   6.082
  877   1HB   LEU  48          1HB       LEU  48 -11.621   1.462   5.348
  878   2HB   LEU  48          2HB       LEU  48 -11.875   1.285   7.047
  879    HG   LEU  48           HG       LEU  48  -9.616   1.315   6.646
  880   1HD1  LEU  48          1HD1      LEU  48 -10.446  -0.361   8.360
  881   2HD1  LEU  48          2HD1      LEU  48 -10.153  -1.638   7.164
  882   3HD1  LEU  48          3HD1      LEU  48  -8.807  -0.656   7.750
  883   1HD2  LEU  48          1HD2      LEU  48  -9.904  -1.030   4.735
  884   2HD2  LEU  48          2HD2      LEU  48  -9.461   0.640   4.321
  885   3HD2  LEU  48          3HD2      LEU  48  -8.366  -0.343   5.300
  886    H    GLU  49           H        GLU  49 -14.329   1.310   5.961
  887    HA   GLU  49           HA       GLU  49 -15.578   0.844   8.475
  888   1HB   GLU  49          1HB       GLU  49 -15.929   2.746   6.651
  889   2HB   GLU  49          2HB       GLU  49 -17.226   1.715   6.079
  890   1HG   GLU  49          1HG       GLU  49 -18.193   1.676   8.401
  891   2HG   GLU  49          2HG       GLU  49 -16.928   2.787   8.920
  892    H    THR  50           H        THR  50 -16.442  -0.565   5.284
  893    HA   THR  50           HA       THR  50 -18.560  -2.217   6.210
  894    HB   THR  50           HB       THR  50 -16.626  -2.420   3.892
  895    HG1  THR  50           1HG      THR  50 -19.393  -1.806   4.044
  896   1HG2  THR  50          1HG2      THR  50 -17.341  -4.669   4.198
  897   2HG2  THR  50          2HG2      THR  50 -19.038  -4.154   4.423
  898   3HG2  THR  50          3HG2      THR  50 -18.229  -3.963   2.837
  899    H    ILE  51           H        ILE  51 -15.108  -2.785   6.314
  900    HA   ILE  51           HA       ILE  51 -15.348  -5.508   7.333
  901    HB   ILE  51           HB       ILE  51 -13.002  -3.619   6.986
  902   1HG1  ILE  51          1HG1      ILE  51 -13.544  -6.276   5.583
  903   2HG1  ILE  51          2HG1      ILE  51 -14.185  -4.766   4.968
  904   1HG2  ILE  51          1HG2      ILE  51 -12.405  -5.059   8.878
  905   2HG2  ILE  51          2HG2      ILE  51 -12.882  -6.508   7.967
  906   3HG2  ILE  51          3HG2      ILE  51 -11.479  -5.535   7.473
  907   1HD1  ILE  51          1HD1      ILE  51 -12.170  -5.236   3.770
  908   2HD1  ILE  51          2HD1      ILE  51 -11.856  -3.842   4.819
  909   3HD1  ILE  51          3HD1      ILE  51 -11.237  -5.454   5.256
  910    H    ASN  52           H        ASN  52 -15.322  -2.451   8.764
  911    HA   ASN  52           HA       ASN  52 -14.687  -3.304  11.486
  912   1HB   ASN  52          1HB       ASN  52 -14.176  -1.039  10.471
  913   2HB   ASN  52          2HB       ASN  52 -15.893  -0.656  10.598
  914   1HD2  ASN  52          2HD2      ASN  52 -16.818  -0.900  12.890
  915   2HD2  ASN  52          1HD2      ASN  52 -15.758  -0.370  14.202
  916    H    GLY  53           H        GLY  53 -16.368  -5.098  11.134
  917   1HA   GLY  53          1HA       GLY  53 -19.179  -4.426  11.802
  918   2HA   GLY  53          2HA       GLY  53 -18.515  -6.025  11.478
  Start of MODEL   11
    1   1H    MET   1          1H        MET   1   8.727  19.438  -4.920
    2   2H    MET   1          2H        MET   1   8.922  17.820  -5.028
    3   3H    MET   1          3H        MET   1   8.958  18.739  -6.386
    4    HA   MET   1           HA       MET   1   6.622  19.372  -6.035
    5   1HB   MET   1          1HB       MET   1   7.325  16.440  -6.401
    6   2HB   MET   1          2HB       MET   1   5.650  16.981  -6.366
    7   1HG   MET   1          1HG       MET   1   6.445  16.788  -8.638
    8   2HG   MET   1          2HG       MET   1   5.968  18.434  -8.262
    9   1HE   MET   1          1HE       MET   1   7.166  20.165  -9.626
   10   2HE   MET   1          2HE       MET   1   7.696  20.472  -7.958
   11   3HE   MET   1          3HE       MET   1   8.871  20.531  -9.289
   12    H    ASP   2           H        ASP   2   4.810  19.364  -4.783
   13    HA   ASP   2           HA       ASP   2   5.119  19.755  -2.165
   14   1HB   ASP   2          1HB       ASP   2   2.578  18.802  -3.504
   15   2HB   ASP   2          2HB       ASP   2   2.665  19.574  -1.923
   16    H    TYR   3           H        TYR   3   5.999  18.590  -0.727
   17    HA   TYR   3           HA       TYR   3   6.460  17.128   0.842
   18   1HB   TYR   3          1HB       TYR   3   3.586  16.205   0.732
   19   2HB   TYR   3          2HB       TYR   3   4.639  16.290   2.127
   20    HD1  TYR   3           1HD      TYR   3   2.173  18.013   0.162
   21    HD2  TYR   3           2HD      TYR   3   5.295  18.540   3.094
   22    HE1  TYR   3           1HE      TYR   3   1.135  20.159   0.871
   23    HE2  TYR   3           2HE      TYR   3   4.237  20.681   3.823
   24    HH   TYR   3           HH       TYR   3   1.172  21.855   2.430
   25    H    LEU   4           H        LEU   4   6.580  15.824  -1.988
   26    HA   LEU   4           HA       LEU   4   5.152  13.551  -1.956
   27   1HB   LEU   4          1HB       LEU   4   6.267  12.855  -3.921
   28   2HB   LEU   4          2HB       LEU   4   6.358  14.606  -3.884
   29    HG   LEU   4           HG       LEU   4   8.706  13.962  -2.608
   30   1HD1  LEU   4          1HD1      LEU   4   8.388  11.509  -3.032
   31   2HD1  LEU   4          2HD1      LEU   4   8.300  11.842  -4.767
   32   3HD1  LEU   4          3HD1      LEU   4   9.805  12.151  -3.869
   33   1HD2  LEU   4          1HD2      LEU   4   8.351  14.228  -5.599
   34   2HD2  LEU   4          2HD2      LEU   4   8.533  15.547  -4.419
   35   3HD2  LEU   4          3HD2      LEU   4   9.873  14.427  -4.702
   36    H    ARG   5           H        ARG   5   8.438  13.527  -0.645
   37    HA   ARG   5           HA       ARG   5   8.549  10.655  -0.154
   38   1HB   ARG   5          1HB       ARG   5  10.035  12.943   1.219
   39   2HB   ARG   5          2HB       ARG   5  10.431  11.226   1.355
   40   1HG   ARG   5          1HG       ARG   5  10.922  11.129  -1.079
   41   2HG   ARG   5          2HG       ARG   5  10.539  12.859  -1.223
   42   1HD   ARG   5          1HD       ARG   5  12.314  13.359   0.463
   43   2HD   ARG   5          2HD       ARG   5  12.764  11.641   0.459
   44    HE   ARG   5           HE       ARG   5  12.822  12.466  -2.227
   45   1HH1  ARG   5          1HH2      ARG   5  14.587  13.334   0.675
   46   2HH1  ARG   5          2HH2      ARG   5  15.987  13.858  -0.222
   47   1HH2  ARG   5          1HH1      ARG   5  14.633  13.159  -3.308
   48   2HH2  ARG   5          2HH1      ARG   5  16.007  13.751  -2.419
   49    H    GLU   6           H        GLU   6   7.339  13.380   1.649
   50    HA   GLU   6           HA       GLU   6   6.914  12.127   4.187
   51   1HB   GLU   6          1HB       GLU   6   6.950  14.713   3.402
   52   2HB   GLU   6          2HB       GLU   6   5.260  14.432   3.084
   53   1HG   GLU   6          1HG       GLU   6   5.390  15.357   5.261
   54   2HG   GLU   6          2HG       GLU   6   4.938  13.670   5.461
   55    H    LEU   7           H        LEU   7   4.969  12.427   1.256
   56    HA   LEU   7           HA       LEU   7   2.568  11.187   2.337
   57   1HB   LEU   7          1HB       LEU   7   3.419  11.407  -0.580
   58   2HB   LEU   7          2HB       LEU   7   1.793  11.181   0.048
   59    HG   LEU   7           HG       LEU   7   3.521  13.670   0.219
   60   1HD1  LEU   7          1HD1      LEU   7   2.445  13.225  -1.949
   61   2HD1  LEU   7          2HD1      LEU   7   0.864  13.186  -1.134
   62   3HD1  LEU   7          3HD1      LEU   7   1.818  14.688  -1.152
   63   1HD2  LEU   7          1HD2      LEU   7   0.754  13.227   1.370
   64   2HD2  LEU   7          2HD2      LEU   7   2.253  13.554   2.287
   65   3HD2  LEU   7          3HD2      LEU   7   1.584  14.799   1.226
   66    H    TYR   8           H        TYR   8   5.146  10.027   0.175
   67    HA   TYR   8           HA       TYR   8   4.363   7.390  -0.353
   68   1HB   TYR   8          1HB       TYR   8   6.478   9.079  -0.918
   69   2HB   TYR   8          2HB       TYR   8   7.283   8.069   0.210
   70    HD1  TYR   8           1HD      TYR   8   5.677   5.427  -0.941
   71    HD2  TYR   8           2HD      TYR   8   8.134   8.587  -2.562
   72    HE1  TYR   8           1HE      TYR   8   6.528   3.893  -2.704
   73    HE2  TYR   8           2HE      TYR   8   8.936   7.051  -4.343
   74    HH   TYR   8           HH       TYR   8   8.897   4.892  -5.160
   75    H    LYS   9           H        LYS   9   6.338   8.503   2.419
   76    HA   LYS   9           HA       LYS   9   6.879   5.865   3.329
   77   1HB   LYS   9          1HB       LYS   9   8.110   8.022   3.958
   78   2HB   LYS   9          2HB       LYS   9   6.785   8.394   5.066
   79   1HG   LYS   9          1HG       LYS   9   7.250   6.287   6.317
   80   2HG   LYS   9          2HG       LYS   9   8.532   5.884   5.161
   81   1HD   LYS   9          1HD       LYS   9   9.796   7.910   5.851
   82   2HD   LYS   9          2HD       LYS   9   8.478   8.363   6.938
   83   1HE   LYS   9          1HE       LYS   9  10.177   7.376   8.287
   84   2HE   LYS   9          2HE       LYS   9   8.821   6.248   8.224
   85   1HZ   LYS   9          1HZ       LYS   9  10.067   4.959   6.562
   86   2HZ   LYS   9          2HZ       LYS   9  11.304   6.030   6.593
   87   3HZ   LYS   9          3HZ       LYS   9  10.966   5.131   7.910
   88    H    LEU  10           H        LEU  10   4.326   8.004   4.612
   89    HA   LEU  10           HA       LEU  10   3.161   6.041   6.259
   90   1HB   LEU  10          1HB       LEU  10   2.087   8.523   4.902
   91   2HB   LEU  10          2HB       LEU  10   1.041   7.512   5.897
   92    HG   LEU  10           HG       LEU  10   3.663   8.629   6.977
   93   1HD1  LEU  10          1HD1      LEU  10   2.284  10.489   6.240
   94   2HD1  LEU  10          2HD1      LEU  10   0.874   9.846   7.121
   95   3HD1  LEU  10          3HD1      LEU  10   2.313  10.413   8.009
   96   1HD2  LEU  10          1HD2      LEU  10   1.108   7.648   8.338
   97   2HD2  LEU  10          2HD2      LEU  10   2.652   6.769   8.277
   98   3HD2  LEU  10          3HD2      LEU  10   2.547   8.293   9.160
   99    H    GLU  11           H        GLU  11   2.631   6.830   2.845
  100    HA   GLU  11           HA       GLU  11   0.647   4.904   2.202
  101   1HB   GLU  11          1HB       GLU  11   2.704   6.565   0.832
  102   2HB   GLU  11          2HB       GLU  11   2.265   5.234  -0.119
  103   1HG   GLU  11          1HG       GLU  11   0.340   7.290   1.107
  104   2HG   GLU  11          2HG       GLU  11   1.005   7.372  -0.521
  105    H    GLN  12           H        GLN  12   4.256   4.359   2.457
  106    HA   GLN  12           HA       GLN  12   3.812   1.557   1.801
  107   1HB   GLN  12          1HB       GLN  12   6.217   3.241   2.505
  108   2HB   GLN  12          2HB       GLN  12   6.300   1.480   2.298
  109   1HG   GLN  12          1HG       GLN  12   5.266   1.673   0.073
  110   2HG   GLN  12          2HG       GLN  12   5.239   3.414   0.206
  111   1HE2  GLN  12          2HE2      GLN  12   6.858   1.218  -1.491
  112   2HE2  GLN  12          1HE2      GLN  12   8.480   1.891  -1.430
  113    H    GLN  13           H        GLN  13   4.030   3.335   4.782
  114    HA   GLN  13           HA       GLN  13   4.536   1.043   6.494
  115   1HB   GLN  13          1HB       GLN  13   3.173   3.734   6.964
  116   2HB   GLN  13          2HB       GLN  13   3.312   2.516   8.236
  117   1HG   GLN  13          1HG       GLN  13   5.730   2.561   8.152
  118   2HG   GLN  13          2HG       GLN  13   5.728   3.622   6.746
  119   1HE2  GLN  13          2HE2      GLN  13   4.912   3.490  10.250
  120   2HE2  GLN  13          1HE2      GLN  13   4.990   5.234  10.458
  121    H    ALA  14           H        ALA  14   1.513   2.254   4.999
  122    HA   ALA  14           HA       ALA  14  -0.145   0.259   6.385
  123   1HB   ALA  14          1HB       ALA  14  -1.092   2.342   5.406
  124   2HB   ALA  14          2HB       ALA  14  -0.566   1.833   3.785
  125   3HB   ALA  14          3HB       ALA  14  -1.801   0.898   4.657
  126    H    MET  15           H        MET  15   1.684   0.359   3.285
  127    HA   MET  15           HA       MET  15   0.820  -2.243   2.377
  128   1HB   MET  15          1HB       MET  15   3.346  -0.668   1.771
  129   2HB   MET  15          2HB       MET  15   2.941  -2.185   0.988
  130   1HG   MET  15          1HG       MET  15   1.055   0.192   0.893
  131   2HG   MET  15          2HG       MET  15   2.388  -0.020  -0.229
  132   1HE   MET  15          1HE       MET  15  -0.576  -2.860   0.966
  133   2HE   MET  15          2HE       MET  15  -0.967  -1.121   1.031
  134   3HE   MET  15          3HE       MET  15  -1.636  -2.148  -0.252
  135    H    LYS  16           H        LYS  16   3.622  -1.352   4.442
  136    HA   LYS  16           HA       LYS  16   4.563  -4.072   4.627
  137   1HB   LYS  16          1HB       LYS  16   5.690  -1.727   5.235
  138   2HB   LYS  16          2HB       LYS  16   4.969  -2.027   6.816
  139   1HG   LYS  16          1HG       LYS  16   7.171  -2.906   6.961
  140   2HG   LYS  16          2HG       LYS  16   6.147  -4.331   6.746
  141   1HD   LYS  16          1HD       LYS  16   6.682  -4.160   4.224
  142   2HD   LYS  16          2HD       LYS  16   7.875  -2.935   4.641
  143   1HE   LYS  16          1HE       LYS  16   7.817  -5.810   5.680
  144   2HE   LYS  16          2HE       LYS  16   8.799  -5.241   4.328
  145   1HZ   LYS  16          1HZ       LYS  16   9.949  -3.741   5.872
  146   2HZ   LYS  16          2HZ       LYS  16   9.068  -4.303   7.134
  147   3HZ   LYS  16          3HZ       LYS  16  10.100  -5.292   6.351
  148    H    LEU  17           H        LEU  17   2.329  -2.174   6.639
  149    HA   LEU  17           HA       LEU  17   1.688  -4.241   8.517
  150   1HB   LEU  17          1HB       LEU  17   0.559  -1.651   7.529
  151   2HB   LEU  17          2HB       LEU  17  -0.617  -2.695   8.199
  152    HG   LEU  17           HG       LEU  17   1.938  -1.785   9.602
  153   1HD1  LEU  17          1HD1      LEU  17   0.295   0.004   9.242
  154   2HD1  LEU  17          2HD1      LEU  17  -0.970  -0.973  10.014
  155   3HD1  LEU  17          3HD1      LEU  17   0.427  -0.419  10.961
  156   1HD2  LEU  17          1HD2      LEU  17  -0.414  -3.389  10.704
  157   2HD2  LEU  17          2HD2      LEU  17   1.267  -3.938  10.572
  158   3HD2  LEU  17          3HD2      LEU  17   0.858  -2.641  11.688
  159    H    TYR  18           H        TYR  18   0.282  -3.476   5.329
  160    HA   TYR  18           HA       TYR  18  -1.703  -5.451   5.314
  161   1HB   TYR  18          1HB       TYR  18  -0.368  -3.712   3.306
  162   2HB   TYR  18          2HB       TYR  18  -1.151  -5.104   2.651
  163    HD1  TYR  18           1HD      TYR  18  -3.552  -5.573   3.931
  164    HD2  TYR  18           2HD      TYR  18  -1.740  -1.749   3.207
  165    HE1  TYR  18           1HE      TYR  18  -5.777  -4.480   4.194
  166    HE2  TYR  18           2HE      TYR  18  -3.943  -0.642   3.492
  167    HH   TYR  18           HH       TYR  18  -6.151  -0.915   4.063
  168    H    ARG  19           H        ARG  19   1.749  -5.869   4.455
  169    HA   ARG  19           HA       ARG  19   1.502  -8.555   3.436
  170   1HB   ARG  19          1HB       ARG  19   3.740  -6.995   4.758
  171   2HB   ARG  19          2HB       ARG  19   3.903  -8.733   4.513
  172   1HG   ARG  19          1HG       ARG  19   3.486  -8.487   2.106
  173   2HG   ARG  19          2HG       ARG  19   3.354  -6.725   2.288
  174   1HD   ARG  19          1HD       ARG  19   5.670  -6.531   2.934
  175   2HD   ARG  19          2HD       ARG  19   5.799  -8.257   3.248
  176    HE   ARG  19           HE       ARG  19   6.085  -8.734   1.011
  177   1HH1  ARG  19          1HH2      ARG  19   5.330  -5.317   1.207
  178   2HH1  ARG  19          2HH2      ARG  19   5.898  -5.018  -0.414
  179   1HH2  ARG  19          1HH1      ARG  19   6.768  -8.285  -1.031
  180   2HH2  ARG  19          2HH1      ARG  19   6.677  -6.662  -1.648
  181    H    GLU  20           H        GLU  20   1.717  -7.428   6.806
  182    HA   GLU  20           HA       GLU  20   1.722 -10.176   7.883
  183   1HB   GLU  20          1HB       GLU  20   2.619  -7.797   8.839
  184   2HB   GLU  20          2HB       GLU  20   1.015  -7.751   9.528
  185   1HG   GLU  20          1HG       GLU  20   2.398  -8.706  11.194
  186   2HG   GLU  20          2HG       GLU  20   1.445 -10.036  10.546
  187    H    ALA  21           H        ALA  21  -0.616  -7.525   7.691
  188    HA   ALA  21           HA       ALA  21  -2.861  -8.884   8.785
  189   1HB   ALA  21          1HB       ALA  21  -2.771  -6.458   8.292
  190   2HB   ALA  21          2HB       ALA  21  -2.826  -6.824   6.548
  191   3HB   ALA  21          3HB       ALA  21  -4.205  -7.230   7.582
  192    H    SER  22           H        SER  22  -1.471  -9.114   5.506
  193    HA   SER  22           HA       SER  22  -3.522 -10.748   4.348
  194   1HB   SER  22          1HB       SER  22  -1.773  -9.579   3.053
  195   2HB   SER  22          2HB       SER  22  -0.546 -10.671   3.712
  196    HG   SER  22           HG       SER  22  -1.376 -12.322   2.555
  197    H    GLU  23           H        GLU  23  -0.733 -11.659   6.448
  198    HA   GLU  23           HA       GLU  23  -1.102 -14.509   6.046
  199   1HB   GLU  23          1HB       GLU  23   0.916 -13.183   7.040
  200   2HB   GLU  23          2HB       GLU  23  -0.002 -13.175   8.532
  201   1HG   GLU  23          1HG       GLU  23   1.520 -15.001   8.662
  202   2HG   GLU  23          2HG       GLU  23  -0.088 -15.682   8.477
  203    H    LYS  24           H        LYS  24  -2.300 -12.158   8.396
  204    HA   LYS  24           HA       LYS  24  -3.856 -13.963  10.050
  205   1HB   LYS  24          1HB       LYS  24  -4.077 -10.958   9.616
  206   2HB   LYS  24          2HB       LYS  24  -4.898 -11.870  10.891
  207   1HG   LYS  24          1HG       LYS  24  -2.729 -12.584  11.823
  208   2HG   LYS  24          2HG       LYS  24  -1.864 -11.723  10.539
  209   1HD   LYS  24          1HD       LYS  24  -2.945  -9.596  11.286
  210   2HD   LYS  24          2HD       LYS  24  -3.634 -10.462  12.668
  211   1HE   LYS  24          1HE       LYS  24  -0.654 -10.196  12.022
  212   2HE   LYS  24          2HE       LYS  24  -1.526  -9.170  13.162
  213   1HZ   LYS  24          1HZ       LYS  24  -2.005 -11.160  14.496
  214   2HZ   LYS  24          2HZ       LYS  24  -1.164 -12.106  13.457
  215   3HZ   LYS  24          3HZ       LYS  24  -0.397 -10.959  14.322
  216    H    ALA  25           H        ALA  25  -4.827 -11.820   7.362
  217    HA   ALA  25           HA       ALA  25  -7.591 -12.634   7.318
  218   1HB   ALA  25          1HB       ALA  25  -6.790 -10.364   6.702
  219   2HB   ALA  25          2HB       ALA  25  -5.936 -11.057   5.299
  220   3HB   ALA  25          3HB       ALA  25  -7.701 -11.117   5.385
  221    H    ARG  26           H        ARG  26  -5.736 -14.936   6.902
  222    HA   ARG  26           HA       ARG  26  -5.580 -15.633   4.146
  223   1HB   ARG  26          1HB       ARG  26  -4.901 -17.852   4.984
  224   2HB   ARG  26          2HB       ARG  26  -4.026 -16.510   5.677
  225   1HG   ARG  26          1HG       ARG  26  -4.479 -18.274   7.307
  226   2HG   ARG  26          2HG       ARG  26  -5.161 -16.732   7.813
  227   1HD   ARG  26          1HD       ARG  26  -7.393 -17.443   7.384
  228   2HD   ARG  26          2HD       ARG  26  -6.851 -18.768   6.360
  229    HE   ARG  26           HE       ARG  26  -6.403 -20.097   8.215
  230   1HH1  ARG  26          1HH2      ARG  26  -7.267 -16.913   9.433
  231   2HH1  ARG  26          2HH2      ARG  26  -7.635 -17.543  11.016
  232   1HH2  ARG  26          1HH1      ARG  26  -6.847 -20.795  10.255
  233   2HH2  ARG  26          2HH1      ARG  26  -7.372 -19.671  11.472
  234    H    ASN  27           H        ASN  27  -8.384 -15.600   5.975
  235    HA   ASN  27           HA       ASN  27  -9.932 -17.703   4.735
  236   1HB   ASN  27          1HB       ASN  27 -10.514 -16.544   6.867
  237   2HB   ASN  27          2HB       ASN  27 -10.726 -15.031   5.986
  238   1HD2  ASN  27          2HD2      ASN  27 -12.881 -14.588   5.608
  239   2HD2  ASN  27          1HD2      ASN  27 -14.102 -15.826   5.363
  240    HA   PRO  28           HA       PRO  28  -9.572 -16.038   0.743
  241   1HB   PRO  28          1HB       PRO  28 -11.623 -17.234  -0.680
  242   2HB   PRO  28          2HB       PRO  28 -10.106 -18.031  -0.167
  243   1HG   PRO  28          1HG       PRO  28 -12.802 -18.085   1.208
  244   2HG   PRO  28          2HG       PRO  28 -11.694 -19.455   0.878
  245   1HD   PRO  28          1HD       PRO  28 -11.780 -18.259   3.297
  246   2HD   PRO  28          2HD       PRO  28 -10.214 -18.788   2.605
  247    H    GLU  29           H        GLU  29 -12.812 -15.678   2.128
  248    HA   GLU  29           HA       GLU  29 -13.915 -13.743   0.427
  249   1HB   GLU  29          1HB       GLU  29 -14.883 -15.004   2.503
  250   2HB   GLU  29          2HB       GLU  29 -14.218 -13.689   3.448
  251   1HG   GLU  29          1HG       GLU  29 -16.488 -13.143   3.081
  252   2HG   GLU  29          2HG       GLU  29 -15.573 -12.072   2.027
  253    H    LYS  30           H        LYS  30 -11.872 -13.229   3.222
  254    HA   LYS  30           HA       LYS  30 -11.644 -10.318   2.803
  255   1HB   LYS  30          1HB       LYS  30 -11.849 -11.468   5.069
  256   2HB   LYS  30          2HB       LYS  30 -10.174 -12.005   4.866
  257   1HG   LYS  30          1HG       LYS  30  -9.437  -9.643   4.685
  258   2HG   LYS  30          2HG       LYS  30 -11.109  -9.088   4.787
  259   1HD   LYS  30          1HD       LYS  30  -9.672 -10.635   6.991
  260   2HD   LYS  30          2HD       LYS  30  -9.809  -8.872   6.919
  261   1HE   LYS  30          1HE       LYS  30 -12.295  -9.064   6.945
  262   2HE   LYS  30          2HE       LYS  30 -12.156 -10.822   7.073
  263   1HZ   LYS  30          1HZ       LYS  30 -11.004 -10.521   9.192
  264   2HZ   LYS  30          2HZ       LYS  30 -11.113  -8.894   9.081
  265   3HZ   LYS  30          3HZ       LYS  30 -12.464  -9.796   9.252
  266    H    LYS  31           H        LYS  31  -9.494 -13.130   2.450
  267    HA   LYS  31           HA       LYS  31  -7.232 -11.810   1.493
  268   1HB   LYS  31          1HB       LYS  31  -7.563 -14.306   1.948
  269   2HB   LYS  31          2HB       LYS  31  -8.315 -14.396   0.355
  270   1HG   LYS  31          1HG       LYS  31  -6.060 -15.177   0.223
  271   2HG   LYS  31          2HG       LYS  31  -6.197 -13.686  -0.704
  272   1HD   LYS  31          1HD       LYS  31  -5.155 -12.423   1.164
  273   2HD   LYS  31          2HD       LYS  31  -5.034 -13.899   2.124
  274   1HE   LYS  31          1HE       LYS  31  -3.731 -13.472  -0.609
  275   2HE   LYS  31          2HE       LYS  31  -2.929 -13.136   0.924
  276   1HZ   LYS  31          1HZ       LYS  31  -3.178 -15.485   1.515
  277   2HZ   LYS  31          2HZ       LYS  31  -3.905 -15.814   0.083
  278   3HZ   LYS  31          3HZ       LYS  31  -2.348 -15.336   0.121
  279    H    SER  32           H        SER  32 -10.205 -12.284  -0.242
  280    HA   SER  32           HA       SER  32  -9.121 -10.952  -2.658
  281   1HB   SER  32          1HB       SER  32 -11.806 -12.263  -2.097
  282   2HB   SER  32          2HB       SER  32 -11.358 -11.511  -3.641
  283    HG   SER  32           HG       SER  32 -10.969 -13.801  -3.573
  284    H    VAL  33           H        VAL  33 -10.135  -9.690   0.116
  285    HA   VAL  33           HA       VAL  33 -11.397  -7.287  -1.180
  286    HB   VAL  33           HB       VAL  33 -11.634  -8.349   1.643
  287   1HG1  VAL  33          1HG1      VAL  33 -11.292  -5.946   1.927
  288   2HG1  VAL  33          2HG1      VAL  33 -12.450  -5.595   0.622
  289   3HG1  VAL  33          3HG1      VAL  33 -12.999  -6.321   2.147
  290   1HG2  VAL  33          1HG2      VAL  33 -13.726  -7.492  -0.412
  291   2HG2  VAL  33          2HG2      VAL  33 -13.220  -9.167  -0.147
  292   3HG2  VAL  33          3HG2      VAL  33 -14.024  -8.279   1.155
  293    H    LEU  34           H        LEU  34  -8.841  -8.249   1.297
  294    HA   LEU  34           HA       LEU  34  -7.753  -5.555   1.191
  295   1HB   LEU  34          1HB       LEU  34  -6.249  -6.160   2.698
  296   2HB   LEU  34          2HB       LEU  34  -7.491  -7.346   3.074
  297    HG   LEU  34           HG       LEU  34  -5.099  -7.756   1.320
  298   1HD1  LEU  34          1HD1      LEU  34  -4.542  -7.386   3.774
  299   2HD1  LEU  34          2HD1      LEU  34  -5.506  -8.807   4.162
  300   3HD1  LEU  34          3HD1      LEU  34  -4.045  -8.955   3.151
  301   1HD2  LEU  34          1HD2      LEU  34  -6.912  -9.843   2.556
  302   2HD2  LEU  34          2HD2      LEU  34  -6.876  -9.392   0.834
  303   3HD2  LEU  34          3HD2      LEU  34  -5.465 -10.161   1.568
  304    H    GLN  35           H        GLN  35  -7.543  -8.217  -1.033
  305    HA   GLN  35           HA       GLN  35  -5.147  -7.551  -2.370
  306   1HB   GLN  35          1HB       GLN  35  -7.497  -9.281  -2.676
  307   2HB   GLN  35          2HB       GLN  35  -7.057  -8.600  -4.206
  308   1HG   GLN  35          1HG       GLN  35  -5.108 -10.046  -2.356
  309   2HG   GLN  35          2HG       GLN  35  -5.973 -10.808  -3.688
  310   1HE2  GLN  35          2HE2      GLN  35  -5.446 -10.119  -5.935
  311   2HE2  GLN  35          1HE2      GLN  35  -3.883  -9.374  -6.232
  312    H    LYS  36           H        LYS  36  -8.448  -6.195  -2.675
  313    HA   LYS  36           HA       LYS  36  -7.835  -4.757  -5.145
  314   1HB   LYS  36          1HB       LYS  36 -10.140  -4.557  -3.149
  315   2HB   LYS  36          2HB       LYS  36 -10.069  -3.626  -4.649
  316   1HG   LYS  36          1HG       LYS  36  -9.921  -6.671  -4.595
  317   2HG   LYS  36          2HG       LYS  36 -11.440  -5.787  -4.704
  318   1HD   LYS  36          1HD       LYS  36 -11.007  -4.975  -6.860
  319   2HD   LYS  36          2HD       LYS  36  -9.264  -5.143  -6.705
  320   1HE   LYS  36          1HE       LYS  36 -10.053  -6.798  -8.248
  321   2HE   LYS  36          2HE       LYS  36  -9.405  -7.577  -6.805
  322   1HZ   LYS  36          1HZ       LYS  36 -11.694  -7.916  -6.035
  323   2HZ   LYS  36          2HZ       LYS  36 -12.298  -7.162  -7.359
  324   3HZ   LYS  36          3HZ       LYS  36 -11.505  -8.578  -7.514
  325    H    ILE  37           H        ILE  37  -7.767  -3.901  -1.724
  326    HA   ILE  37           HA       ILE  37  -6.837  -1.149  -2.109
  327    HB   ILE  37           HB       ILE  37  -6.611  -3.240   0.070
  328   1HG1  ILE  37          1HG1      ILE  37  -7.779  -0.648   0.822
  329   2HG1  ILE  37          2HG1      ILE  37  -8.669  -1.463  -0.439
  330   1HG2  ILE  37          1HG2      ILE  37  -4.538  -1.969   0.322
  331   2HG2  ILE  37          2HG2      ILE  37  -5.420  -0.433   0.098
  332   3HG2  ILE  37          3HG2      ILE  37  -5.668  -1.402   1.549
  333   1HD1  ILE  37          1HD1      ILE  37  -8.922  -3.461   0.954
  334   2HD1  ILE  37          2HD1      ILE  37  -7.872  -2.757   2.203
  335   3HD1  ILE  37          3HD1      ILE  37  -9.455  -2.031   1.863
  336    H    LEU  38           H        LEU  38  -5.034  -4.309  -1.669
  337    HA   LEU  38           HA       LEU  38  -2.473  -3.237  -1.981
  338   1HB   LEU  38          1HB       LEU  38  -3.675  -5.920  -2.637
  339   2HB   LEU  38          2HB       LEU  38  -2.011  -5.607  -3.078
  340    HG   LEU  38           HG       LEU  38  -2.930  -5.062  -0.238
  341   1HD1  LEU  38          1HD1      LEU  38  -3.608  -7.377  -0.674
  342   2HD1  LEU  38          2HD1      LEU  38  -2.011  -7.747  -1.356
  343   3HD1  LEU  38          3HD1      LEU  38  -2.184  -7.347   0.371
  344   1HD2  LEU  38          1HD2      LEU  38  -0.266  -6.007  -1.394
  345   2HD2  LEU  38          2HD2      LEU  38  -0.657  -4.314  -1.077
  346   3HD2  LEU  38          3HD2      LEU  38  -0.581  -5.467   0.269
  347    H    GLU  39           H        GLU  39  -4.666  -4.116  -4.715
  348    HA   GLU  39           HA       GLU  39  -2.709  -3.309  -6.684
  349   1HB   GLU  39          1HB       GLU  39  -5.739  -3.692  -6.826
  350   2HB   GLU  39          2HB       GLU  39  -4.732  -3.329  -8.229
  351   1HG   GLU  39          1HG       GLU  39  -3.429  -5.402  -7.857
  352   2HG   GLU  39          2HG       GLU  39  -4.458  -5.813  -6.488
  353    H    ASP  40           H        ASP  40  -5.355  -1.475  -5.138
  354    HA   ASP  40           HA       ASP  40  -5.056   0.953  -6.683
  355   1HB   ASP  40          1HB       ASP  40  -6.182   0.012  -4.018
  356   2HB   ASP  40          2HB       ASP  40  -5.991   1.682  -4.257
  357    H    GLU  41           H        GLU  41  -3.423  -0.348  -3.790
  358    HA   GLU  41           HA       GLU  41  -2.069   2.215  -3.264
  359   1HB   GLU  41          1HB       GLU  41  -1.546  -0.548  -2.142
  360   2HB   GLU  41          2HB       GLU  41  -0.755   0.931  -1.594
  361   1HG   GLU  41          1HG       GLU  41  -3.703   0.259  -1.269
  362   2HG   GLU  41          2HG       GLU  41  -2.486   0.177  -0.025
  363    H    GLU  42           H        GLU  42  -1.238  -0.848  -4.910
  364    HA   GLU  42           HA       GLU  42   1.444  -0.166  -5.588
  365   1HB   GLU  42          1HB       GLU  42   0.413  -2.395  -5.903
  366   2HB   GLU  42          2HB       GLU  42  -0.564  -1.753  -7.232
  367   1HG   GLU  42          1HG       GLU  42   1.474  -1.249  -8.516
  368   2HG   GLU  42          2HG       GLU  42   2.484  -1.742  -7.153
  369    H    LYS  43           H        LYS  43  -1.626   0.782  -7.168
  370    HA   LYS  43           HA       LYS  43  -0.368   2.252  -9.311
  371   1HB   LYS  43          1HB       LYS  43  -2.930   1.500  -8.861
  372   2HB   LYS  43          2HB       LYS  43  -3.060   3.144  -8.290
  373   1HG   LYS  43          1HG       LYS  43  -3.682   3.170 -10.563
  374   2HG   LYS  43          2HG       LYS  43  -2.041   3.830 -10.559
  375   1HD   LYS  43          1HD       LYS  43  -1.126   1.667 -11.286
  376   2HD   LYS  43          2HD       LYS  43  -2.714   0.909 -11.175
  377   1HE   LYS  43          1HE       LYS  43  -2.046   3.235 -13.038
  378   2HE   LYS  43          2HE       LYS  43  -1.920   1.538 -13.501
  379   1HZ   LYS  43          1HZ       LYS  43  -4.299   1.286 -13.056
  380   2HZ   LYS  43          2HZ       LYS  43  -4.440   2.866 -12.654
  381   3HZ   LYS  43          3HZ       LYS  43  -4.050   2.440 -14.179
  382    H    HIS  44           H        HIS  44  -1.452   3.367  -6.003
  383    HA   HIS  44           HA       HIS  44  -0.674   6.045  -6.328
  384   1HB   HIS  44          1HB       HIS  44  -0.541   4.266  -3.847
  385   2HB   HIS  44          2HB       HIS  44  -0.583   5.991  -3.962
  386    HD2  HIS  44           2HD      HIS  44  -3.094   5.375  -6.348
  387    HE1  HIS  44           1HE      HIS  44  -5.289   4.890  -2.751
  388    HE2  HIS  44           2HE      HIS  44  -5.442   5.123  -5.292
  389    H    ILE  45           H        ILE  45   1.195   3.166  -5.298
  390    HA   ILE  45           HA       ILE  45   3.624   4.570  -4.718
  391    HB   ILE  45           HB       ILE  45   2.761   1.726  -5.000
  392   1HG1  ILE  45          1HG1      ILE  45   4.124   1.550  -2.879
  393   2HG1  ILE  45          2HG1      ILE  45   4.510   3.258  -3.034
  394   1HG2  ILE  45          1HG2      ILE  45   4.728   1.604  -6.426
  395   2HG2  ILE  45          2HG2      ILE  45   5.701   2.469  -5.206
  396   3HG2  ILE  45          3HG2      ILE  45   5.055   0.845  -4.874
  397   1HD1  ILE  45          1HD1      ILE  45   2.061   3.787  -2.767
  398   2HD1  ILE  45          2HD1      ILE  45   1.794   2.045  -2.467
  399   3HD1  ILE  45          3HD1      ILE  45   2.809   2.987  -1.375
  400    H    GLU  46           H        GLU  46   2.489   3.110  -7.841
  401    HA   GLU  46           HA       GLU  46   4.787   3.742  -9.386
  402   1HB   GLU  46          1HB       GLU  46   1.812   3.713 -10.032
  403   2HB   GLU  46          2HB       GLU  46   3.016   4.104 -11.225
  404   1HG   GLU  46          1HG       GLU  46   2.894   1.484  -9.730
  405   2HG   GLU  46          2HG       GLU  46   2.184   1.797 -11.316
  406    H    TRP  47           H        TRP  47   1.951   5.800  -8.580
  407    HA   TRP  47           HA       TRP  47   2.857   7.987 -10.185
  408   1HB   TRP  47          1HB       TRP  47   0.914   8.003  -7.851
  409   2HB   TRP  47          2HB       TRP  47   1.061   9.206  -9.100
  410    HD1  TRP  47           1HD      TRP  47   0.911   6.844 -11.560
  411    HE1  TRP  47           1HE      TRP  47  -1.391   5.815 -12.020
  412    HE3  TRP  47           3HE      TRP  47  -1.546   8.351  -7.327
  413    HZ2  TRP  47           2HZ      TRP  47  -4.022   5.807 -10.809
  414    HZ3  TRP  47           3HZ      TRP  47  -3.977   7.903  -7.032
  415    HH2  TRP  47           2HH      TRP  47  -5.208   6.581  -8.752
  416    H    LEU  48           H        LEU  48   3.071   7.243  -6.685
  417    HA   LEU  48           HA       LEU  48   4.301   9.593  -5.738
  418   1HB   LEU  48          1HB       LEU  48   4.027   6.744  -4.917
  419   2HB   LEU  48          2HB       LEU  48   5.533   7.415  -4.401
  420    HG   LEU  48           HG       LEU  48   4.030   7.602  -2.673
  421   1HD1  LEU  48          1HD1      LEU  48   5.575   9.569  -3.088
  422   2HD1  LEU  48          2HD1      LEU  48   4.185  10.442  -3.765
  423   3HD1  LEU  48          3HD1      LEU  48   4.161   9.912  -2.083
  424   1HD2  LEU  48          1HD2      LEU  48   2.145   9.152  -4.489
  425   2HD2  LEU  48          2HD2      LEU  48   1.878   7.540  -3.787
  426   3HD2  LEU  48          3HD2      LEU  48   1.956   8.957  -2.736
  427    H    GLU  49           H        GLU  49   5.848   6.644  -6.960
  428    HA   GLU  49           HA       GLU  49   8.536   7.709  -6.946
  429   1HB   GLU  49          1HB       GLU  49   7.593   5.238  -7.291
  430   2HB   GLU  49          2HB       GLU  49   7.615   5.654  -8.992
  431   1HG   GLU  49          1HG       GLU  49  10.039   6.271  -8.800
  432   2HG   GLU  49          2HG       GLU  49  10.006   5.816  -7.097
  433    H    THR  50           H        THR  50   6.021   7.707  -9.430
  434    HA   THR  50           HA       THR  50   7.578   8.972 -11.486
  435    HB   THR  50           HB       THR  50   4.582   8.950 -10.989
  436    HG1  THR  50           1HG      THR  50   5.340   6.925 -11.333
  437   1HG2  THR  50          1HG2      THR  50   5.025  10.715 -12.531
  438   2HG2  THR  50          2HG2      THR  50   6.157   9.678 -13.455
  439   3HG2  THR  50          3HG2      THR  50   4.404   9.309 -13.418
  440    H    ILE  51           H        ILE  51   5.854  10.324  -8.770
  441    HA   ILE  51           HA       ILE  51   6.184  13.096  -9.570
  442    HB   ILE  51           HB       ILE  51   5.239  11.742  -7.029
  443   1HG1  ILE  51          1HG1      ILE  51   3.618  13.552  -8.870
  444   2HG1  ILE  51          2HG1      ILE  51   3.817  11.858  -9.246
  445   1HG2  ILE  51          1HG2      ILE  51   6.199  13.872  -6.295
  446   2HG2  ILE  51          2HG2      ILE  51   5.284  14.744  -7.546
  447   3HG2  ILE  51          3HG2      ILE  51   4.452  13.945  -6.192
  448   1HD1  ILE  51          1HD1      ILE  51   2.885  11.281  -6.953
  449   2HD1  ILE  51          2HD1      ILE  51   2.476  13.000  -6.766
  450   3HD1  ILE  51          3HD1      ILE  51   1.753  12.049  -8.073
  451    H    ASN  52           H        ASN  52   8.150  10.883  -7.925
  452    HA   ASN  52           HA       ASN  52   9.946  12.769  -6.630
  453   1HB   ASN  52          1HB       ASN  52   9.681  10.278  -6.092
  454   2HB   ASN  52          2HB       ASN  52  10.597   9.953  -7.564
  455   1HD2  ASN  52          2HD2      ASN  52  12.226   8.894  -6.252
  456   2HD2  ASN  52          1HD2      ASN  52  13.358   9.875  -5.336
  457    H    GLY  53           H        GLY  53  12.273  12.995  -7.251
  458   1HA   GLY  53          1HA       GLY  53  12.832  13.157 -10.189
  459   2HA   GLY  53          2HA       GLY  53  12.925  14.622  -9.210
  460   1H    MET   1          1H        MET   1  -6.676 -10.775  18.163
  461   2H    MET   1          2H        MET   1  -8.276 -10.933  18.471
  462   3H    MET   1          3H        MET   1  -7.510 -12.020  17.513
  463    HA   MET   1           HA       MET   1  -7.091 -10.351  15.832
  464   1HB   MET   1          1HB       MET   1 -10.022 -10.554  16.654
  465   2HB   MET   1          2HB       MET   1  -9.444  -9.876  15.130
  466   1HG   MET   1          1HG       MET   1  -9.119 -12.755  16.050
  467   2HG   MET   1          2HG       MET   1 -10.196 -12.140  14.804
  468   1HE   MET   1          1HE       MET   1  -8.557 -14.598  14.043
  469   2HE   MET   1          2HE       MET   1  -9.555 -13.667  12.903
  470   3HE   MET   1          3HE       MET   1  -7.890 -14.106  12.469
  471    H    ASP   2           H        ASP   2  -6.070  -8.432  16.093
  472    HA   ASP   2           HA       ASP   2  -7.611  -6.072  16.954
  473   1HB   ASP   2          1HB       ASP   2  -6.688  -7.060  19.052
  474   2HB   ASP   2          2HB       ASP   2  -5.065  -6.953  18.381
  475    H    TYR   3           H        TYR   3  -7.062  -6.329  14.432
  476    HA   TYR   3           HA       TYR   3  -4.514  -4.889  13.846
  477   1HB   TYR   3          1HB       TYR   3  -3.838  -6.490  12.284
  478   2HB   TYR   3          2HB       TYR   3  -4.297  -7.391  13.706
  479    HD1  TYR   3           1HD      TYR   3  -4.759  -6.997  10.154
  480    HD2  TYR   3           2HD      TYR   3  -6.638  -8.555  13.707
  481    HE1  TYR   3           1HE      TYR   3  -6.198  -8.471   8.751
  482    HE2  TYR   3           2HE      TYR   3  -8.100  -9.989  12.302
  483    HH   TYR   3           HH       TYR   3  -8.600 -10.704  10.210
  484    H    LEU   4           H        LEU   4  -7.493  -4.011  13.632
  485    HA   LEU   4           HA       LEU   4  -7.535  -3.429  10.722
  486   1HB   LEU   4          1HB       LEU   4  -9.462  -4.549  10.898
  487   2HB   LEU   4          2HB       LEU   4  -9.447  -4.489  12.642
  488    HG   LEU   4           HG       LEU   4 -10.381  -2.162  12.522
  489   1HD1  LEU   4          1HD1      LEU   4  -9.953  -1.665  10.092
  490   2HD1  LEU   4          2HD1      LEU   4 -11.020  -3.006   9.646
  491   3HD1  LEU   4          3HD1      LEU   4 -11.679  -1.584  10.475
  492   1HD2  LEU   4          1HD2      LEU   4 -12.086  -4.410  11.391
  493   2HD2  LEU   4          2HD2      LEU   4 -11.699  -4.161  13.108
  494   3HD2  LEU   4          3HD2      LEU   4 -12.654  -2.954  12.248
  495    H    ARG   5           H        ARG   5  -8.284  -1.762  13.851
  496    HA   ARG   5           HA       ARG   5  -8.431   0.850  12.643
  497   1HB   ARG   5          1HB       ARG   5  -7.941  -0.140  15.468
  498   2HB   ARG   5          2HB       ARG   5  -7.676   1.560  15.065
  499   1HG   ARG   5          1HG       ARG   5  -9.973   1.737  14.162
  500   2HG   ARG   5          2HG       ARG   5 -10.301   0.065  14.656
  501   1HD   ARG   5          1HD       ARG   5  -9.983   0.629  16.995
  502   2HD   ARG   5          2HD       ARG   5  -9.350   2.221  16.587
  503    HE   ARG   5           HE       ARG   5 -11.559   2.879  15.751
  504   1HH1  ARG   5          1HH2      ARG   5 -11.602   0.117  17.916
  505   2HH1  ARG   5          2HH2      ARG   5 -13.243   0.432  18.409
  506   1HH2  ARG   5          1HH1      ARG   5 -13.620   3.220  16.437
  507   2HH2  ARG   5          2HH1      ARG   5 -14.347   2.143  17.592
  508    H    GLU   6           H        GLU   6  -5.657  -1.028  13.686
  509    HA   GLU   6           HA       GLU   6  -3.622   0.905  13.622
  510   1HB   GLU   6          1HB       GLU   6  -3.465  -1.519  14.333
  511   2HB   GLU   6          2HB       GLU   6  -3.458  -1.974  12.636
  512   1HG   GLU   6          1HG       GLU   6  -1.196  -1.984  13.341
  513   2HG   GLU   6          2HG       GLU   6  -1.369  -0.551  12.342
  514    H    LEU   7           H        LEU   7  -4.703  -1.171  10.877
  515    HA   LEU   7           HA       LEU   7  -3.281   0.110   8.808
  516   1HB   LEU   7          1HB       LEU   7  -5.697  -1.729   9.055
  517   2HB   LEU   7          2HB       LEU   7  -5.298  -1.003   7.500
  518    HG   LEU   7           HG       LEU   7  -3.024  -1.858   7.657
  519   1HD1  LEU   7          1HD1      LEU   7  -2.590  -2.197   9.983
  520   2HD1  LEU   7          2HD1      LEU   7  -3.914  -3.356  10.109
  521   3HD1  LEU   7          3HD1      LEU   7  -2.472  -3.758   9.163
  522   1HD2  LEU   7          1HD2      LEU   7  -5.077  -4.087   7.978
  523   2HD2  LEU   7          2HD2      LEU   7  -4.930  -3.084   6.523
  524   3HD2  LEU   7          3HD2      LEU   7  -3.584  -4.121   7.002
  525    H    TYR   8           H        TYR   8  -6.726   0.493   9.693
  526    HA   TYR   8           HA       TYR   8  -7.559   2.439   7.839
  527   1HB   TYR   8          1HB       TYR   8  -8.563   1.065  10.029
  528   2HB   TYR   8          2HB       TYR   8  -8.395   2.608  10.772
  529    HD1  TYR   8           1HD      TYR   8 -10.823   0.772  10.316
  530    HD2  TYR   8           2HD      TYR   8  -9.412   4.342   8.344
  531    HE1  TYR   8           1HE      TYR   8 -13.165   1.379   9.745
  532    HE2  TYR   8           2HE      TYR   8 -11.762   4.953   7.802
  533    HH   TYR   8           HH       TYR   8 -13.978   4.365   7.955
  534    H    LYS   9           H        LYS   9  -5.999   3.032  11.017
  535    HA   LYS   9           HA       LYS   9  -6.059   5.876  10.747
  536   1HB   LYS   9          1HB       LYS   9  -4.652   3.902  12.546
  537   2HB   LYS   9          2HB       LYS   9  -3.864   5.463  12.384
  538   1HG   LYS   9          1HG       LYS   9  -5.977   6.629  12.960
  539   2HG   LYS   9          2HG       LYS   9  -6.776   5.060  13.189
  540   1HD   LYS   9          1HD       LYS   9  -5.328   4.533  15.076
  541   2HD   LYS   9          2HD       LYS   9  -4.278   5.907  14.717
  542   1HE   LYS   9          1HE       LYS   9  -5.626   6.503  16.605
  543   2HE   LYS   9          2HE       LYS   9  -6.106   7.489  15.224
  544   1HZ   LYS   9          1HZ       LYS   9  -8.030   6.019  14.927
  545   2HZ   LYS   9          2HZ       LYS   9  -7.569   5.091  16.198
  546   3HZ   LYS   9          3HZ       LYS   9  -8.029   6.636  16.435
  547    H    LEU  10           H        LEU  10  -3.276   3.772   9.951
  548    HA   LEU  10           HA       LEU  10  -1.839   5.946   8.875
  549   1HB   LEU  10          1HB       LEU  10  -1.582   2.962   8.718
  550   2HB   LEU  10          2HB       LEU  10  -0.600   3.944   7.628
  551    HG   LEU  10           HG       LEU  10  -0.681   4.552  10.613
  552   1HD1  LEU  10          1HD1      LEU  10   0.004   2.264  10.466
  553   2HD1  LEU  10          2HD1      LEU  10   1.184   2.631   9.176
  554   3HD1  LEU  10          3HD1      LEU  10   1.418   3.257  10.828
  555   1HD2  LEU  10          1HD2      LEU  10   1.407   5.071   8.444
  556   2HD2  LEU  10          2HD2      LEU  10   0.303   6.284   9.126
  557   3HD2  LEU  10          3HD2      LEU  10   1.532   5.545  10.152
  558    H    GLU  11           H        GLU  11  -4.146   3.742   7.370
  559    HA   GLU  11           HA       GLU  11  -4.123   4.746   4.705
  560   1HB   GLU  11          1HB       GLU  11  -5.917   3.227   6.524
  561   2HB   GLU  11          2HB       GLU  11  -6.815   3.996   5.332
  562   1HG   GLU  11          1HG       GLU  11  -4.391   2.178   4.828
  563   2HG   GLU  11          2HG       GLU  11  -6.055   1.628   4.852
  564    H    GLN  12           H        GLN  12  -5.894   6.104   7.624
  565    HA   GLN  12           HA       GLN  12  -6.830   8.301   5.992
  566   1HB   GLN  12          1HB       GLN  12  -7.066   7.553   8.902
  567   2HB   GLN  12          2HB       GLN  12  -7.665   9.093   8.255
  568   1HG   GLN  12          1HG       GLN  12  -8.969   7.897   6.547
  569   2HG   GLN  12          2HG       GLN  12  -8.471   6.354   7.206
  570   1HE2  GLN  12          2HE2      GLN  12 -11.182   8.050   7.061
  571   2HE2  GLN  12          1HE2      GLN  12 -11.800   7.828   8.690
  572    H    GLN  13           H        GLN  13  -4.036   7.896   8.017
  573    HA   GLN  13           HA       GLN  13  -3.405  10.734   8.224
  574   1HB   GLN  13          1HB       GLN  13  -1.715   8.193   8.377
  575   2HB   GLN  13          2HB       GLN  13  -1.015   9.802   8.558
  576   1HG   GLN  13          1HG       GLN  13  -2.288  10.270  10.534
  577   2HG   GLN  13          2HG       GLN  13  -3.311   8.855  10.319
  578   1HE2  GLN  13          2HE2      GLN  13   0.115   9.810  10.976
  579   2HE2  GLN  13          1HE2      GLN  13   0.478   8.330  11.852
  580    H    ALA  14           H        ALA  14  -2.764   8.304   5.670
  581    HA   ALA  14           HA       ALA  14  -1.232  10.180   4.031
  582   1HB   ALA  14          1HB       ALA  14  -1.139   7.714   3.702
  583   2HB   ALA  14          2HB       ALA  14  -2.868   7.695   3.291
  584   3HB   ALA  14          3HB       ALA  14  -1.710   8.543   2.242
  585    H    MET  15           H        MET  15  -4.695   9.320   4.344
  586    HA   MET  15           HA       MET  15  -5.681  10.962   2.175
  587   1HB   MET  15          1HB       MET  15  -7.057  10.059   4.751
  588   2HB   MET  15          2HB       MET  15  -7.840  10.970   3.496
  589   1HG   MET  15          1HG       MET  15  -6.666   8.824   2.109
  590   2HG   MET  15          2HG       MET  15  -7.254   8.115   3.612
  591   1HE   MET  15          1HE       MET  15  -8.769  11.189   1.499
  592   2HE   MET  15          2HE       MET  15  -8.004  10.029   0.402
  593   3HE   MET  15          3HE       MET  15  -9.770  10.241   0.378
  594    H    LYS  16           H        LYS  16  -5.196  11.730   5.657
  595    HA   LYS  16           HA       LYS  16  -6.247  14.389   5.473
  596   1HB   LYS  16          1HB       LYS  16  -5.668  12.797   7.523
  597   2HB   LYS  16          2HB       LYS  16  -4.058  13.490   7.398
  598   1HG   LYS  16          1HG       LYS  16  -5.308  14.632   9.107
  599   2HG   LYS  16          2HG       LYS  16  -5.069  15.769   7.772
  600   1HD   LYS  16          1HD       LYS  16  -7.370  15.589   7.083
  601   2HD   LYS  16          2HD       LYS  16  -7.602  14.095   7.994
  602   1HE   LYS  16          1HE       LYS  16  -8.754  15.861   9.137
  603   2HE   LYS  16          2HE       LYS  16  -7.404  15.302  10.125
  604   1HZ   LYS  16          1HZ       LYS  16  -6.144  17.260   9.397
  605   2HZ   LYS  16          2HZ       LYS  16  -7.385  17.765   8.455
  606   3HZ   LYS  16          3HZ       LYS  16  -7.548  17.727  10.077
  607    H    LEU  17           H        LEU  17  -2.900  13.146   5.183
  608    HA   LEU  17           HA       LEU  17  -1.698  15.640   4.527
  609   1HB   LEU  17          1HB       LEU  17  -0.959  12.862   4.604
  610   2HB   LEU  17          2HB       LEU  17  -0.524  13.403   3.015
  611    HG   LEU  17           HG       LEU  17   0.180  14.836   5.605
  612   1HD1  LEU  17          1HD1      LEU  17   1.265  12.684   5.535
  613   2HD1  LEU  17          2HD1      LEU  17   1.886  12.982   3.892
  614   3HD1  LEU  17          3HD1      LEU  17   2.479  13.941   5.270
  615   1HD2  LEU  17          1HD2      LEU  17   1.292  15.205   2.775
  616   2HD2  LEU  17          2HD2      LEU  17   0.254  16.360   3.632
  617   3HD2  LEU  17          3HD2      LEU  17   1.885  16.039   4.227
  618    H    TYR  18           H        TYR  18  -3.203  13.221   2.402
  619    HA   TYR  18           HA       TYR  18  -2.789  14.520  -0.071
  620   1HB   TYR  18          1HB       TYR  18  -4.601  12.368   0.982
  621   2HB   TYR  18          2HB       TYR  18  -5.000  13.049  -0.547
  622    HD1  TYR  18           1HD      TYR  18  -2.889  13.364  -2.200
  623    HD2  TYR  18           2HD      TYR  18  -3.384  10.325   0.792
  624    HE1  TYR  18           1HE      TYR  18  -1.124  11.986  -3.310
  625    HE2  TYR  18           2HE      TYR  18  -1.605   8.966  -0.280
  626    HH   TYR  18           HH       TYR  18  -0.083   8.832  -1.981
  627    H    ARG  19           H        ARG  19  -5.588  14.885   2.184
  628    HA   ARG  19           HA       ARG  19  -7.106  16.630   0.453
  629   1HB   ARG  19          1HB       ARG  19  -7.052  16.182   3.465
  630   2HB   ARG  19          2HB       ARG  19  -8.108  17.382   2.710
  631   1HG   ARG  19          1HG       ARG  19  -9.186  15.658   1.336
  632   2HG   ARG  19          2HG       ARG  19  -8.112  14.420   1.986
  633   1HD   ARG  19          1HD       ARG  19 -10.280  14.306   3.108
  634   2HD   ARG  19          2HD       ARG  19  -9.012  14.752   4.242
  635    HE   ARG  19           HE       ARG  19 -10.006  16.812   4.585
  636   1HH1  ARG  19          1HH2      ARG  19 -11.590  15.428   1.777
  637   2HH1  ARG  19          2HH2      ARG  19 -12.785  16.694   1.725
  638   1HH2  ARG  19          1HH1      ARG  19 -11.552  18.388   4.447
  639   2HH2  ARG  19          2HH1      ARG  19 -12.759  18.317   3.200
  640    H    GLU  20           H        GLU  20  -4.682  17.400   2.971
  641    HA   GLU  20           HA       GLU  20  -5.001  20.277   2.580
  642   1HB   GLU  20          1HB       GLU  20  -4.016  18.639   4.560
  643   2HB   GLU  20          2HB       GLU  20  -2.515  19.157   3.840
  644   1HG   GLU  20          1HG       GLU  20  -4.729  20.996   4.870
  645   2HG   GLU  20          2HG       GLU  20  -3.315  20.523   5.798
  646    H    ALA  21           H        ALA  21  -2.654  17.846   1.519
  647    HA   ALA  21           HA       ALA  21  -0.946  19.512   0.000
  648   1HB   ALA  21          1HB       ALA  21  -0.451  17.147   0.411
  649   2HB   ALA  21          2HB       ALA  21  -1.845  16.659  -0.583
  650   3HB   ALA  21          3HB       ALA  21  -0.461  17.480  -1.330
  651    H    SER  22           H        SER  22  -4.118  18.067  -0.984
  652    HA   SER  22           HA       SER  22  -4.128  19.172  -3.611
  653   1HB   SER  22          1HB       SER  22  -5.599  17.346  -2.734
  654   2HB   SER  22          2HB       SER  22  -6.523  18.559  -1.832
  655    HG   SER  22           HG       SER  22  -7.368  17.937  -3.940
  656    H    GLU  23           H        GLU  23  -4.860  20.792  -0.529
  657    HA   GLU  23           HA       GLU  23  -6.141  23.107  -1.757
  658   1HB   GLU  23          1HB       GLU  23  -6.254  22.310   0.701
  659   2HB   GLU  23          2HB       GLU  23  -4.661  23.015   0.880
  660   1HG   GLU  23          1HG       GLU  23  -6.201  24.634   1.664
  661   2HG   GLU  23          2HG       GLU  23  -5.572  25.234   0.139
  662    H    LYS  24           H        LYS  24  -2.851  22.407  -0.575
  663    HA   LYS  24           HA       LYS  24  -1.713  24.945  -1.427
  664   1HB   LYS  24          1HB       LYS  24  -0.929  23.452   0.435
  665   2HB   LYS  24          2HB       LYS  24  -0.278  22.334  -0.754
  666   1HG   LYS  24          1HG       LYS  24   0.538  25.277  -0.635
  667   2HG   LYS  24          2HG       LYS  24   1.269  24.065   0.404
  668   1HD   LYS  24          1HD       LYS  24   1.846  22.755  -1.746
  669   2HD   LYS  24          2HD       LYS  24   1.475  24.243  -2.623
  670   1HE   LYS  24          1HE       LYS  24   3.541  23.914  -0.403
  671   2HE   LYS  24          2HE       LYS  24   3.887  23.977  -2.133
  672   1HZ   LYS  24          1HZ       LYS  24   2.998  26.254  -2.161
  673   2HZ   LYS  24          2HZ       LYS  24   2.721  26.204  -0.547
  674   3HZ   LYS  24          3HZ       LYS  24   4.245  26.134  -1.117
  675    H    ALA  25           H        ALA  25  -1.604  21.684  -2.845
  676    HA   ALA  25           HA       ALA  25  -0.121  22.479  -5.219
  677   1HB   ALA  25          1HB       ALA  25   0.079  20.244  -4.040
  678   2HB   ALA  25          2HB       ALA  25  -1.571  19.867  -4.591
  679   3HB   ALA  25          3HB       ALA  25  -0.285  20.136  -5.773
  680    H    ARG  26           H        ARG  26  -2.531  24.011  -4.944
  681    HA   ARG  26           HA       ARG  26  -4.761  22.931  -6.275
  682   1HB   ARG  26          1HB       ARG  26  -5.576  25.291  -6.376
  683   2HB   ARG  26          2HB       ARG  26  -5.115  24.692  -4.806
  684   1HG   ARG  26          1HG       ARG  26  -4.471  27.040  -5.176
  685   2HG   ARG  26          2HG       ARG  26  -3.100  26.021  -4.753
  686   1HD   ARG  26          1HD       ARG  26  -2.268  26.040  -7.019
  687   2HD   ARG  26          2HD       ARG  26  -3.780  26.713  -7.625
  688    HE   ARG  26           HE       ARG  26  -3.144  28.841  -6.977
  689   1HH1  ARG  26          1HH2      ARG  26  -0.791  26.654  -5.533
  690   2HH1  ARG  26          2HH2      ARG  26   0.373  27.933  -5.333
  691   1HH2  ARG  26          1HH1      ARG  26  -1.627  30.400  -6.630
  692   2HH2  ARG  26          2HH1      ARG  26  -0.105  29.995  -5.894
  693    H    ASN  27           H        ASN  27  -1.906  23.754  -7.798
  694    HA   ASN  27           HA       ASN  27  -2.839  24.565 -10.402
  695   1HB   ASN  27          1HB       ASN  27  -0.547  24.934  -9.541
  696   2HB   ASN  27          2HB       ASN  27  -0.281  23.190  -9.446
  697   1HD2  ASN  27          2HD2      ASN  27   0.224  25.900 -11.407
  698   2HD2  ASN  27          1HD2      ASN  27   0.490  25.022 -12.906
  699    HA   PRO  28           HA       PRO  28  -4.736  20.712 -11.412
  700   1HB   PRO  28          1HB       PRO  28  -4.961  20.840 -14.157
  701   2HB   PRO  28          2HB       PRO  28  -5.907  21.864 -13.018
  702   1HG   PRO  28          1HG       PRO  28  -3.307  22.522 -14.438
  703   2HG   PRO  28          2HG       PRO  28  -4.841  23.499 -14.351
  704   1HD   PRO  28          1HD       PRO  28  -2.744  24.010 -12.755
  705   2HD   PRO  28          2HD       PRO  28  -4.433  24.110 -12.132
  706    H    GLU  29           H        GLU  29  -1.477  21.290 -12.537
  707    HA   GLU  29           HA       GLU  29  -1.075  18.799 -14.018
  708   1HB   GLU  29          1HB       GLU  29   0.278  21.102 -13.806
  709   2HB   GLU  29          2HB       GLU  29   1.110  20.253 -12.526
  710   1HG   GLU  29          1HG       GLU  29   2.403  19.954 -14.504
  711   2HG   GLU  29          2HG       GLU  29   1.647  18.403 -14.167
  712    H    LYS  30           H        LYS  30  -1.201  19.694 -10.775
  713    HA   LYS  30           HA       LYS  30  -0.443  16.980  -9.803
  714   1HB   LYS  30          1HB       LYS  30   1.041  18.958  -9.077
  715   2HB   LYS  30          2HB       LYS  30  -0.360  19.568  -8.197
  716   1HG   LYS  30          1HG       LYS  30   0.932  18.396  -6.595
  717   2HG   LYS  30          2HG       LYS  30  -0.414  17.318  -6.961
  718   1HD   LYS  30          1HD       LYS  30   1.390  16.397  -8.787
  719   2HD   LYS  30          2HD       LYS  30   2.525  17.079  -7.629
  720   1HE   LYS  30          1HE       LYS  30   0.291  15.108  -6.980
  721   2HE   LYS  30          2HE       LYS  30   1.951  14.635  -7.353
  722   1HZ   LYS  30          1HZ       LYS  30   2.692  15.881  -5.364
  723   2HZ   LYS  30          2HZ       LYS  30   1.154  16.315  -5.023
  724   3HZ   LYS  30          3HZ       LYS  30   1.600  14.748  -4.949
  725    H    LYS  31           H        LYS  31  -2.742  19.662  -9.058
  726    HA   LYS  31           HA       LYS  31  -4.373  18.282  -7.340
  727   1HB   LYS  31          1HB       LYS  31  -4.552  20.713  -8.143
  728   2HB   LYS  31          2HB       LYS  31  -5.598  20.087  -9.428
  729   1HG   LYS  31          1HG       LYS  31  -7.089  19.080  -7.691
  730   2HG   LYS  31          2HG       LYS  31  -5.989  19.670  -6.430
  731   1HD   LYS  31          1HD       LYS  31  -6.438  22.013  -7.201
  732   2HD   LYS  31          2HD       LYS  31  -7.550  21.380  -8.408
  733   1HE   LYS  31          1HE       LYS  31  -8.800  22.199  -6.486
  734   2HE   LYS  31          2HE       LYS  31  -8.997  20.450  -6.629
  735   1HZ   LYS  31          1HZ       LYS  31  -7.403  20.158  -4.825
  736   2HZ   LYS  31          2HZ       LYS  31  -7.076  21.742  -4.745
  737   3HZ   LYS  31          3HZ       LYS  31  -8.561  21.193  -4.326
  738    H    SER  32           H        SER  32  -4.551  17.952 -10.831
  739    HA   SER  32           HA       SER  32  -6.726  15.976 -10.607
  740   1HB   SER  32          1HB       SER  32  -5.187  16.885 -13.077
  741   2HB   SER  32          2HB       SER  32  -6.689  15.945 -13.062
  742    HG   SER  32           HG       SER  32  -7.082  18.178 -13.399
  743    H    VAL  33           H        VAL  33  -3.635  15.576  -9.896
  744    HA   VAL  33           HA       VAL  33  -3.504  12.766 -10.952
  745    HB   VAL  33           HB       VAL  33  -1.247  14.577 -10.016
  746   1HG1  VAL  33          1HG1      VAL  33  -0.755  12.262  -9.362
  747   2HG1  VAL  33          2HG1      VAL  33  -1.186  11.685 -10.987
  748   3HG1  VAL  33          3HG1      VAL  33   0.238  12.720 -10.746
  749   1HG2  VAL  33          1HG2      VAL  33  -1.909  13.399 -12.753
  750   2HG2  VAL  33          2HG2      VAL  33  -2.042  15.112 -12.296
  751   3HG2  VAL  33          3HG2      VAL  33  -0.455  14.340 -12.350
  752    H    LEU  34           H        LEU  34  -2.854  14.769  -7.929
  753    HA   LEU  34           HA       LEU  34  -2.913  12.341  -6.339
  754   1HB   LEU  34          1HB       LEU  34  -2.227  13.526  -4.649
  755   2HB   LEU  34          2HB       LEU  34  -1.675  14.609  -5.910
  756    HG   LEU  34           HG       LEU  34  -4.266  14.845  -4.412
  757   1HD1  LEU  34          1HD1      LEU  34  -2.133  15.193  -2.965
  758   2HD1  LEU  34          2HD1      LEU  34  -1.751  16.562  -4.004
  759   3HD1  LEU  34          3HD1      LEU  34  -3.230  16.575  -3.022
  760   1HD2  LEU  34          1HD2      LEU  34  -2.835  16.955  -6.051
  761   2HD2  LEU  34          2HD2      LEU  34  -4.291  16.058  -6.537
  762   3HD2  LEU  34          3HD2      LEU  34  -4.361  17.166  -5.162
  763    H    GLN  35           H        GLN  35  -5.464  14.321  -7.687
  764    HA   GLN  35           HA       GLN  35  -7.497  13.658  -5.841
  765   1HB   GLN  35          1HB       GLN  35  -7.818  15.370  -7.470
  766   2HB   GLN  35          2HB       GLN  35  -7.604  14.234  -8.820
  767   1HG   GLN  35          1HG       GLN  35  -9.735  13.130  -8.214
  768   2HG   GLN  35          2HG       GLN  35  -9.868  14.150  -6.778
  769   1HE2  GLN  35          2HE2      GLN  35 -11.749  15.338  -7.285
  770   2HE2  GLN  35          1HE2      GLN  35 -11.878  16.327  -8.733
  771    H    LYS  36           H        LYS  36  -6.154  11.695  -8.544
  772    HA   LYS  36           HA       LYS  36  -8.258   9.696  -8.456
  773   1HB   LYS  36          1HB       LYS  36  -5.336   9.560  -9.394
  774   2HB   LYS  36          2HB       LYS  36  -6.481   8.242  -9.600
  775   1HG   LYS  36          1HG       LYS  36  -6.824  11.007 -10.837
  776   2HG   LYS  36          2HG       LYS  36  -6.128   9.594 -11.636
  777   1HD   LYS  36          1HD       LYS  36  -8.322   8.358 -11.188
  778   2HD   LYS  36          2HD       LYS  36  -8.981   9.891 -10.608
  779   1HE   LYS  36          1HE       LYS  36  -9.697   9.676 -12.853
  780   2HE   LYS  36          2HE       LYS  36  -8.443  10.919 -12.845
  781   1HZ   LYS  36          1HZ       LYS  36  -6.877   9.234 -13.677
  782   2HZ   LYS  36          2HZ       LYS  36  -8.035   8.078 -13.645
  783   3HZ   LYS  36          3HZ       LYS  36  -8.159   9.332 -14.678
  784    H    ILE  37           H        ILE  37  -5.162   9.934  -6.763
  785    HA   ILE  37           HA       ILE  37  -5.491   7.471  -5.239
  786    HB   ILE  37           HB       ILE  37  -3.958  10.035  -4.648
  787   1HG1  ILE  37          1HG1      ILE  37  -2.964   7.454  -5.831
  788   2HG1  ILE  37          2HG1      ILE  37  -3.128   9.028  -6.631
  789   1HG2  ILE  37          1HG2      ILE  37  -4.348   8.900  -2.534
  790   2HG2  ILE  37          2HG2      ILE  37  -3.960   7.322  -3.257
  791   3HG2  ILE  37          3HG2      ILE  37  -2.699   8.524  -2.988
  792   1HD1  ILE  37          1HD1      ILE  37  -1.421   9.945  -5.023
  793   2HD1  ILE  37          2HD1      ILE  37  -1.113   8.258  -4.518
  794   3HD1  ILE  37          3HD1      ILE  37  -0.828   8.746  -6.185
  795    H    LEU  38           H        LEU  38  -6.376  10.947  -4.482
  796    HA   LEU  38           HA       LEU  38  -7.613  10.443  -2.014
  797   1HB   LEU  38          1HB       LEU  38  -8.154  12.439  -4.209
  798   2HB   LEU  38          2HB       LEU  38  -9.255  12.357  -2.860
  799    HG   LEU  38           HG       LEU  38  -6.267  12.787  -2.489
  800   1HD1  LEU  38          1HD1      LEU  38  -7.175  14.642  -3.820
  801   2HD1  LEU  38          2HD1      LEU  38  -8.502  14.853  -2.654
  802   3HD1  LEU  38          3HD1      LEU  38  -6.818  15.173  -2.175
  803   1HD2  LEU  38          1HD2      LEU  38  -8.733  13.123  -0.707
  804   2HD2  LEU  38          2HD2      LEU  38  -7.337  12.047  -0.449
  805   3HD2  LEU  38          3HD2      LEU  38  -7.149  13.794  -0.302
  806    H    GLU  39           H        GLU  39  -9.184  10.003  -5.272
  807    HA   GLU  39           HA       GLU  39 -11.666   9.175  -4.031
  808   1HB   GLU  39          1HB       GLU  39 -10.545   8.823  -6.856
  809   2HB   GLU  39          2HB       GLU  39 -12.171   8.327  -6.381
  810   1HG   GLU  39          1HG       GLU  39 -12.717  10.659  -5.745
  811   2HG   GLU  39          2HG       GLU  39 -11.120  11.185  -6.271
  812    H    ASP  40           H        ASP  40  -8.871   7.310  -5.205
  813    HA   ASP  40           HA       ASP  40  -9.996   4.698  -4.807
  814   1HB   ASP  40          1HB       ASP  40  -7.281   6.026  -5.084
  815   2HB   ASP  40          2HB       ASP  40  -7.349   4.401  -4.578
  816    H    GLU  41           H        GLU  41  -8.360   7.010  -2.615
  817    HA   GLU  41           HA       GLU  41  -8.052   4.948  -0.515
  818   1HB   GLU  41          1HB       GLU  41  -7.718   7.956  -0.334
  819   2HB   GLU  41          2HB       GLU  41  -7.370   6.805   0.954
  820   1HG   GLU  41          1HG       GLU  41  -5.820   7.163  -1.623
  821   2HG   GLU  41          2HG       GLU  41  -5.322   7.599  -0.010
  822    H    GLU  42           H        GLU  42 -10.336   7.598  -1.231
  823    HA   GLU  42           HA       GLU  42 -12.003   7.257   1.063
  824   1HB   GLU  42          1HB       GLU  42 -12.149   9.124  -0.569
  825   2HB   GLU  42          2HB       GLU  42 -12.809   8.011  -1.776
  826   1HG   GLU  42          1HG       GLU  42 -14.766   7.585  -0.330
  827   2HG   GLU  42          2HG       GLU  42 -14.072   8.600   0.937
  828    H    LYS  43           H        LYS  43 -11.860   5.432  -2.000
  829    HA   LYS  43           HA       LYS  43 -14.071   3.679  -1.462
  830   1HB   LYS  43          1HB       LYS  43 -12.383   4.069  -3.620
  831   2HB   LYS  43          2HB       LYS  43 -11.768   2.552  -2.990
  832   1HG   LYS  43          1HG       LYS  43 -13.378   1.945  -4.577
  833   2HG   LYS  43          2HG       LYS  43 -14.224   1.737  -3.036
  834   1HD   LYS  43          1HD       LYS  43 -15.345   3.936  -3.355
  835   2HD   LYS  43          2HD       LYS  43 -14.429   4.184  -4.856
  836   1HE   LYS  43          1HE       LYS  43 -15.462   2.110  -5.798
  837   2HE   LYS  43          2HE       LYS  43 -16.426   1.937  -4.326
  838   1HZ   LYS  43          1HZ       LYS  43 -17.453   4.097  -4.836
  839   2HZ   LYS  43          2HZ       LYS  43 -16.562   4.245  -6.198
  840   3HZ   LYS  43          3HZ       LYS  43 -17.678   3.062  -6.076
  841    H    HIS  44           H        HIS  44 -10.544   3.341  -0.530
  842    HA   HIS  44           HA       HIS  44 -10.813   0.789   0.630
  843   1HB   HIS  44          1HB       HIS  44  -8.950   3.139   1.222
  844   2HB   HIS  44          2HB       HIS  44  -8.762   1.488   1.706
  845    HD2  HIS  44           2HD      HIS  44  -9.882   0.856  -1.589
  846    HE1  HIS  44           1HE      HIS  44  -5.812   1.783  -2.320
  847    HE2  HIS  44           2HE      HIS  44  -7.975   0.904  -3.337
  848    H    ILE  45           H        ILE  45 -10.989   4.071   2.102
  849    HA   ILE  45           HA       ILE  45 -11.665   3.254   4.732
  850    HB   ILE  45           HB       ILE  45 -11.903   5.755   3.078
  851   1HG1  ILE  45          1HG1      ILE  45 -10.681   6.713   5.048
  852   2HG1  ILE  45          2HG1      ILE  45 -10.708   5.129   5.815
  853   1HG2  ILE  45          1HG2      ILE  45 -14.055   5.833   4.187
  854   2HG2  ILE  45          2HG2      ILE  45 -13.298   5.465   5.758
  855   3HG2  ILE  45          3HG2      ILE  45 -12.963   6.999   4.921
  856   1HD1  ILE  45          1HD1      ILE  45  -9.259   4.245   3.987
  857   2HD1  ILE  45          2HD1      ILE  45  -9.245   5.875   3.261
  858   3HD1  ILE  45          3HD1      ILE  45  -8.531   5.607   4.849
  859    H    GLU  46           H        GLU  46 -13.915   3.717   1.924
  860    HA   GLU  46           HA       GLU  46 -16.305   3.136   3.365
  861   1HB   GLU  46          1HB       GLU  46 -15.406   2.928   0.499
  862   2HB   GLU  46          2HB       GLU  46 -16.872   2.087   0.950
  863   1HG   GLU  46          1HG       GLU  46 -16.417   5.040   1.500
  864   2HG   GLU  46          2HG       GLU  46 -17.133   4.417   0.012
  865    H    TRP  47           H        TRP  47 -13.984   0.853   1.845
  866    HA   TRP  47           HA       TRP  47 -15.542  -1.494   2.495
  867   1HB   TRP  47          1HB       TRP  47 -12.586  -1.217   1.843
  868   2HB   TRP  47          2HB       TRP  47 -13.555  -2.667   1.751
  869    HD1  TRP  47           1HD      TRP  47 -15.913  -0.651   0.202
  870    HE1  TRP  47           1HE      TRP  47 -15.571  -0.257  -2.312
  871    HE3  TRP  47           3HE      TRP  47 -11.054  -2.145  -0.188
  872    HZ2  TRP  47           2HZ      TRP  47 -13.466  -0.645  -4.272
  873    HZ3  TRP  47           3HZ      TRP  47  -9.883  -2.123  -2.368
  874    HH2  TRP  47           2HH      TRP  47 -11.072  -1.351  -4.423
  875    H    LEU  48           H        LEU  48 -12.765   0.134   4.003
  876    HA   LEU  48           HA       LEU  48 -12.312  -1.588   6.212
  877   1HB   LEU  48          1HB       LEU  48 -11.967   1.359   5.623
  878   2HB   LEU  48          2HB       LEU  48 -11.564   0.772   7.200
  879    HG   LEU  48           HG       LEU  48 -10.370  -0.414   4.675
  880   1HD1  LEU  48          1HD1      LEU  48  -9.747   1.945   4.803
  881   2HD1  LEU  48          2HD1      LEU  48  -9.289   1.767   6.506
  882   3HD1  LEU  48          3HD1      LEU  48  -8.355   0.944   5.229
  883   1HD2  LEU  48          1HD2      LEU  48  -9.508  -0.526   7.604
  884   2HD2  LEU  48          2HD2      LEU  48 -10.204  -1.870   6.675
  885   3HD2  LEU  48          3HD2      LEU  48  -8.620  -1.231   6.233
  886    H    GLU  49           H        GLU  49 -14.673   1.059   5.826
  887    HA   GLU  49           HA       GLU  49 -15.814   0.763   8.467
  888   1HB   GLU  49          1HB       GLU  49 -16.105   2.672   6.666
  889   2HB   GLU  49          2HB       GLU  49 -17.427   1.685   6.066
  890   1HG   GLU  49          1HG       GLU  49 -18.427   1.669   8.371
  891   2HG   GLU  49          2HG       GLU  49 -17.123   2.718   8.924
  892    H    THR  50           H        THR  50 -16.753  -0.598   5.299
  893    HA   THR  50           HA       THR  50 -18.938  -2.151   6.287
  894    HB   THR  50           HB       THR  50 -17.749  -1.686   3.776
  895    HG1  THR  50           1HG      THR  50 -19.912  -1.620   4.196
  896   1HG2  THR  50          1HG2      THR  50 -16.555  -3.848   3.828
  897   2HG2  THR  50          2HG2      THR  50 -18.096  -4.686   4.137
  898   3HG2  THR  50          3HG2      THR  50 -17.841  -3.807   2.619
  899    H    ILE  51           H        ILE  51 -15.549  -2.847   6.399
  900    HA   ILE  51           HA       ILE  51 -15.960  -5.570   7.443
  901    HB   ILE  51           HB       ILE  51 -13.515  -3.894   6.799
  902   1HG1  ILE  51          1HG1      ILE  51 -14.688  -4.803   4.836
  903   2HG1  ILE  51          2HG1      ILE  51 -13.082  -5.466   5.015
  904   1HG2  ILE  51          1HG2      ILE  51 -12.729  -5.210   8.618
  905   2HG2  ILE  51          2HG2      ILE  51 -13.503  -6.682   7.988
  906   3HG2  ILE  51          3HG2      ILE  51 -12.117  -5.947   7.139
  907   1HD1  ILE  51          1HD1      ILE  51 -14.050  -7.593   5.874
  908   2HD1  ILE  51          2HD1      ILE  51 -15.685  -6.904   5.711
  909   3HD1  ILE  51          3HD1      ILE  51 -14.683  -7.163   4.279
  910    H    ASN  52           H        ASN  52 -15.867  -2.520   8.799
  911    HA   ASN  52           HA       ASN  52 -14.665  -3.167  11.357
  912   1HB   ASN  52          1HB       ASN  52 -14.850  -0.843  10.454
  913   2HB   ASN  52          2HB       ASN  52 -16.603  -0.929  10.661
  914   1HD2  ASN  52          2HD2      ASN  52 -16.971   0.557  12.299
  915   2HD2  ASN  52          1HD2      ASN  52 -16.171   0.468  13.860
  916    H    GLY  53           H        GLY  53 -15.617  -3.532  13.384
  917   1HA   GLY  53          1HA       GLY  53 -18.357  -3.796  14.018
  918   2HA   GLY  53          2HA       GLY  53 -17.787  -5.384  13.496
  Start of MODEL   12
    1   1H    MET   1          1H        MET   1   7.223  21.842   3.599
    2   2H    MET   1          2H        MET   1   8.844  21.623   3.532
    3   3H    MET   1          3H        MET   1   8.230  23.078   3.961
    4    HA   MET   1           HA       MET   1   7.273  23.422   1.808
    5   1HB   MET   1          1HB       MET   1   9.557  24.263   2.229
    6   2HB   MET   1          2HB       MET   1  10.239  22.755   1.606
    7   1HG   MET   1          1HG       MET   1   9.250  23.203  -0.608
    8   2HG   MET   1          2HG       MET   1   8.405  24.611   0.034
    9   1HE   MET   1          1HE       MET   1  12.241  23.456   0.544
   10   2HE   MET   1          2HE       MET   1  11.804  23.084  -1.142
   11   3HE   MET   1          3HE       MET   1  12.969  24.378  -0.785
   12    H    ASP   2           H        ASP   2   9.508  20.572   1.425
   13    HA   ASP   2           HA       ASP   2   8.267  19.566  -0.915
   14   1HB   ASP   2          1HB       ASP   2   9.518  17.525  -0.405
   15   2HB   ASP   2          2HB       ASP   2  10.511  18.966  -0.225
   16    H    TYR   3           H        TYR   3   6.847  17.860  -1.296
   17    HA   TYR   3           HA       TYR   3   5.125  16.871   0.898
   18   1HB   TYR   3          1HB       TYR   3   3.140  17.891   0.041
   19   2HB   TYR   3          2HB       TYR   3   4.325  19.131   0.357
   20    HD1  TYR   3           1HD      TYR   3   2.165  17.619  -2.133
   21    HD2  TYR   3           2HD      TYR   3   5.547  20.242  -1.594
   22    HE1  TYR   3           1HE      TYR   3   1.817  18.543  -4.412
   23    HE2  TYR   3           2HE      TYR   3   5.193  21.166  -3.875
   24    HH   TYR   3           HH       TYR   3   3.918  21.097  -5.785
   25    H    LEU   4           H        LEU   4   6.854  15.451  -1.010
   26    HA   LEU   4           HA       LEU   4   4.768  13.735  -2.237
   27   1HB   LEU   4          1HB       LEU   4   6.048  13.369  -4.219
   28   2HB   LEU   4          2HB       LEU   4   5.732  15.071  -3.972
   29    HG   LEU   4           HG       LEU   4   8.200  14.823  -2.766
   30   1HD1  LEU   4          1HD1      LEU   4   8.442  12.459  -3.603
   31   2HD1  LEU   4          2HD1      LEU   4   8.284  13.066  -5.259
   32   3HD1  LEU   4          3HD1      LEU   4   9.666  13.556  -4.257
   33   1HD2  LEU   4          1HD2      LEU   4   7.675  15.432  -5.699
   34   2HD2  LEU   4          2HD2      LEU   4   7.549  16.582  -4.348
   35   3HD2  LEU   4          3HD2      LEU   4   9.123  15.895  -4.775
   36    H    ARG   5           H        ARG   5   8.234  13.544  -1.232
   37    HA   ARG   5           HA       ARG   5   8.135  10.706  -0.830
   38   1HB   ARG   5          1HB       ARG   5  10.240  10.953   0.373
   39   2HB   ARG   5          2HB       ARG   5  10.215  11.831  -1.142
   40   1HG   ARG   5          1HG       ARG   5  11.274  13.356   0.171
   41   2HG   ARG   5          2HG       ARG   5   9.623  13.932   0.335
   42   1HD   ARG   5          1HD       ARG   5   9.502  12.635   2.535
   43   2HD   ARG   5          2HD       ARG   5  11.214  12.253   2.319
   44    HE   ARG   5           HE       ARG   5  10.200  15.090   2.355
   45   1HH1  ARG   5          1HH2      ARG   5  12.512  12.823   3.747
   46   2HH1  ARG   5          2HH2      ARG   5  13.341  14.112   4.577
   47   1HH2  ARG   5          1HH1      ARG   5  11.218  16.558   3.347
   48   2HH2  ARG   5          2HH1      ARG   5  12.608  16.230   4.378
   49    H    GLU   6           H        GLU   6   7.114  13.315   1.239
   50    HA   GLU   6           HA       GLU   6   6.752  11.911   3.687
   51   1HB   GLU   6          1HB       GLU   6   6.602  14.406   3.316
   52   2HB   GLU   6          2HB       GLU   6   5.080  14.162   2.478
   53   1HG   GLU   6          1HG       GLU   6   4.520  14.844   4.669
   54   2HG   GLU   6          2HG       GLU   6   4.152  13.129   4.616
   55    H    LEU   7           H        LEU   7   4.358  12.523   1.097
   56    HA   LEU   7           HA       LEU   7   2.316  10.865   2.097
   57   1HB   LEU   7          1HB       LEU   7   2.946  12.040  -0.633
   58   2HB   LEU   7          2HB       LEU   7   1.577  10.959  -0.380
   59    HG   LEU   7           HG       LEU   7   0.753  12.428   1.442
   60   1HD1  LEU   7          1HD1      LEU   7   2.555  13.724   2.221
   61   2HD1  LEU   7          2HD1      LEU   7   2.989  14.258   0.579
   62   3HD1  LEU   7          3HD1      LEU   7   1.520  14.862   1.357
   63   1HD2  LEU   7          1HD2      LEU   7   1.083  13.851  -1.230
   64   2HD2  LEU   7          2HD2      LEU   7  -0.083  12.546  -0.910
   65   3HD2  LEU   7          3HD2      LEU   7  -0.231  14.075  -0.045
   66    H    TYR   8           H        TYR   8   4.818  10.089  -0.353
   67    HA   TYR   8           HA       TYR   8   4.156   7.381  -0.952
   68   1HB   TYR   8          1HB       TYR   8   6.118   9.236  -1.567
   69   2HB   TYR   8          2HB       TYR   8   7.035   8.287  -0.464
   70    HD1  TYR   8           1HD      TYR   8   7.513   8.972  -3.400
   71    HD2  TYR   8           2HD      TYR   8   5.927   5.465  -1.439
   72    HE1  TYR   8           1HE      TYR   8   8.381   7.544  -5.242
   73    HE2  TYR   8           2HE      TYR   8   6.819   4.051  -3.275
   74    HH   TYR   8           HH       TYR   8   7.948   3.994  -5.274
   75    H    LYS   9           H        LYS   9   6.147   8.638   1.766
   76    HA   LYS   9           HA       LYS   9   6.705   6.040   2.808
   77   1HB   LYS   9          1HB       LYS   9   7.123   8.842   3.660
   78   2HB   LYS   9          2HB       LYS   9   6.691   7.858   5.037
   79   1HG   LYS   9          1HG       LYS   9   8.951   7.168   3.111
   80   2HG   LYS   9          2HG       LYS   9   9.144   8.067   4.624
   81   1HD   LYS   9          1HD       LYS   9   8.159   6.122   5.873
   82   2HD   LYS   9          2HD       LYS   9   8.152   5.193   4.358
   83   1HE   LYS   9          1HE       LYS   9  10.603   5.485   4.156
   84   2HE   LYS   9          2HE       LYS   9  10.621   6.472   5.623
   85   1HZ   LYS   9          1HZ       LYS   9   9.848   4.521   6.868
   86   2HZ   LYS   9          2HZ       LYS   9   9.853   3.602   5.511
   87   3HZ   LYS   9          3HZ       LYS   9  11.251   4.189   6.111
   88    H    LEU  10           H        LEU  10   4.147   8.246   3.969
   89    HA   LEU  10           HA       LEU  10   3.078   6.257   5.656
   90   1HB   LEU  10          1HB       LEU  10   1.130   7.712   5.932
   91   2HB   LEU  10          2HB       LEU  10   2.686   8.480   6.170
   92    HG   LEU  10           HG       LEU  10   2.420   9.327   3.709
   93   1HD1  LEU  10          1HD1      LEU  10   0.347   8.050   3.139
   94   2HD1  LEU  10          2HD1      LEU  10  -0.466   8.842   4.504
   95   3HD1  LEU  10          3HD1      LEU  10   0.068   9.788   3.093
   96   1HD2  LEU  10          1HD2      LEU  10   0.723  10.419   5.975
   97   2HD2  LEU  10          2HD2      LEU  10   2.441  10.775   5.669
   98   3HD2  LEU  10          3HD2      LEU  10   1.218  11.290   4.503
   99    H    GLU  11           H        GLU  11   2.464   6.940   2.255
  100    HA   GLU  11           HA       GLU  11   0.440   5.011   1.712
  101   1HB   GLU  11          1HB       GLU  11   2.559   6.494   0.242
  102   2HB   GLU  11          2HB       GLU  11   2.108   5.127  -0.593
  103   1HG   GLU  11          1HG       GLU  11   0.157   7.260   0.448
  104   2HG   GLU  11          2HG       GLU  11   0.869   7.265  -1.156
  105    H    GLN  12           H        GLN  12   4.056   4.526   2.040
  106    HA   GLN  12           HA       GLN  12   3.654   1.696   1.602
  107   1HB   GLN  12          1HB       GLN  12   6.042   3.443   2.180
  108   2HB   GLN  12          2HB       GLN  12   6.143   1.673   2.092
  109   1HG   GLN  12          1HG       GLN  12   5.102   1.696  -0.135
  110   2HG   GLN  12          2HG       GLN  12   5.036   3.443  -0.125
  111   1HE2  GLN  12          2HE2      GLN  12   6.634   1.285  -1.784
  112   2HE2  GLN  12          1HE2      GLN  12   8.264   1.940  -1.744
  113    H    GLN  13           H        GLN  13   3.836   3.664   4.463
  114    HA   GLN  13           HA       GLN  13   4.279   1.459   6.326
  115   1HB   GLN  13          1HB       GLN  13   2.974   4.196   6.655
  116   2HB   GLN  13          2HB       GLN  13   3.150   3.057   7.984
  117   1HG   GLN  13          1HG       GLN  13   5.501   4.146   6.374
  118   2HG   GLN  13          2HG       GLN  13   4.940   4.804   7.905
  119   1HE2  GLN  13          2HE2      GLN  13   6.845   2.268   6.419
  120   2HE2  GLN  13          1HE2      GLN  13   7.296   1.497   7.935
  121    H    ALA  14           H        ALA  14   1.331   2.703   4.736
  122    HA   ALA  14           HA       ALA  14  -0.453   0.895   6.195
  123   1HB   ALA  14          1HB       ALA  14  -1.261   2.949   5.047
  124   2HB   ALA  14          2HB       ALA  14  -0.725   2.297   3.481
  125   3HB   ALA  14          3HB       ALA  14  -2.030   1.494   4.382
  126    H    MET  15           H        MET  15   1.407   0.706   3.130
  127    HA   MET  15           HA       MET  15   0.507  -1.955   2.366
  128   1HB   MET  15          1HB       MET  15   1.665  -0.347   0.853
  129   2HB   MET  15          2HB       MET  15   3.139  -0.484   1.793
  130   1HG   MET  15          1HG       MET  15   3.769  -2.416   0.863
  131   2HG   MET  15          2HG       MET  15   2.153  -3.118   0.934
  132   1HE   MET  15          1HE       MET  15   0.416  -3.064  -0.704
  133   2HE   MET  15          2HE       MET  15   0.280  -1.307  -0.583
  134   3HE   MET  15          3HE       MET  15   0.349  -2.083  -2.186
  135    H    LYS  16           H        LYS  16   3.362  -0.970   4.370
  136    HA   LYS  16           HA       LYS  16   4.266  -3.641   4.906
  137   1HB   LYS  16          1HB       LYS  16   4.275  -1.065   6.541
  138   2HB   LYS  16          2HB       LYS  16   5.107  -2.512   7.084
  139   1HG   LYS  16          1HG       LYS  16   5.805  -1.517   4.320
  140   2HG   LYS  16          2HG       LYS  16   6.280  -0.504   5.677
  141   1HD   LYS  16          1HD       LYS  16   8.113  -1.944   5.074
  142   2HD   LYS  16          2HD       LYS  16   7.536  -2.352   6.693
  143   1HE   LYS  16          1HE       LYS  16   6.297  -4.294   5.769
  144   2HE   LYS  16          2HE       LYS  16   6.830  -3.861   4.135
  145   1HZ   LYS  16          1HZ       LYS  16   9.129  -4.235   4.860
  146   2HZ   LYS  16          2HZ       LYS  16   8.640  -4.626   6.370
  147   3HZ   LYS  16          3HZ       LYS  16   8.249  -5.586   5.112
  148    H    LEU  17           H        LEU  17   1.906  -1.624   6.645
  149    HA   LEU  17           HA       LEU  17   1.119  -3.564   8.569
  150   1HB   LEU  17          1HB       LEU  17   0.136  -0.995   7.431
  151   2HB   LEU  17          2HB       LEU  17  -1.138  -1.974   8.042
  152    HG   LEU  17           HG       LEU  17   1.383  -1.253   9.617
  153   1HD1  LEU  17          1HD1      LEU  17   0.086   0.736   9.065
  154   2HD1  LEU  17          2HD1      LEU  17  -1.401  -0.023   9.676
  155   3HD1  LEU  17          3HD1      LEU  17  -0.066   0.368  10.790
  156   1HD2  LEU  17          1HD2      LEU  17  -1.277  -2.413  10.568
  157   2HD2  LEU  17          2HD2      LEU  17   0.265  -3.285  10.514
  158   3HD2  LEU  17          3HD2      LEU  17   0.075  -1.914  11.605
  159    H    TYR  18           H        TYR  18  -0.345  -2.888   5.342
  160    HA   TYR  18           HA       TYR  18  -2.179  -5.015   5.301
  161   1HB   TYR  18          1HB       TYR  18  -0.780  -3.328   3.271
  162   2HB   TYR  18          2HB       TYR  18  -1.508  -4.782   2.687
  163    HD1  TYR  18           1HD      TYR  18  -3.977  -5.264   3.427
  164    HD2  TYR  18           2HD      TYR  18  -2.134  -1.389   3.387
  165    HE1  TYR  18           1HE      TYR  18  -6.230  -4.197   3.671
  166    HE2  TYR  18           2HE      TYR  18  -4.364  -0.341   3.742
  167    HH   TYR  18           HH       TYR  18  -6.599  -0.660   4.048
  168    H    ARG  19           H        ARG  19   1.298  -5.182   4.336
  169    HA   ARG  19           HA       ARG  19   1.140  -7.874   3.323
  170   1HB   ARG  19          1HB       ARG  19   3.443  -6.164   4.328
  171   2HB   ARG  19          2HB       ARG  19   3.677  -7.783   3.656
  172   1HG   ARG  19          1HG       ARG  19   2.810  -7.153   1.503
  173   2HG   ARG  19          2HG       ARG  19   2.192  -5.624   2.107
  174   1HD   ARG  19          1HD       ARG  19   4.127  -5.000   0.965
  175   2HD   ARG  19          2HD       ARG  19   4.612  -4.976   2.649
  176    HE   ARG  19           HE       ARG  19   5.853  -7.022   2.335
  177   1HH1  ARG  19          1HH2      ARG  19   4.602  -5.825  -0.721
  178   2HH1  ARG  19          2HH2      ARG  19   5.739  -6.760  -1.649
  179   1HH2  ARG  19          1HH1      ARG  19   7.265  -8.188   1.075
  180   2HH2  ARG  19          2HH1      ARG  19   7.195  -8.057  -0.656
  181    H    GLU  20           H        GLU  20   1.469  -6.713   6.610
  182    HA   GLU  20           HA       GLU  20   1.977  -9.456   7.635
  183   1HB   GLU  20          1HB       GLU  20   2.858  -7.037   8.481
  184   2HB   GLU  20          2HB       GLU  20   1.357  -7.049   9.362
  185   1HG   GLU  20          1HG       GLU  20   2.974  -7.897  10.865
  186   2HG   GLU  20          2HG       GLU  20   2.011  -9.282  10.369
  187    H    ALA  21           H        ALA  21  -0.551  -6.994   7.799
  188    HA   ALA  21           HA       ALA  21  -2.526  -8.496   9.188
  189   1HB   ALA  21          1HB       ALA  21  -2.755  -6.108   8.631
  190   2HB   ALA  21          2HB       ALA  21  -2.902  -6.526   6.904
  191   3HB   ALA  21          3HB       ALA  21  -4.151  -7.040   8.056
  192    H    SER  22           H        SER  22  -1.516  -8.732   5.766
  193    HA   SER  22           HA       SER  22  -3.415 -10.553   4.788
  194   1HB   SER  22          1HB       SER  22  -1.592  -9.411   3.500
  195   2HB   SER  22          2HB       SER  22  -0.435 -10.556   4.205
  196    HG   SER  22           HG       SER  22  -1.208 -11.228   2.141
  197    H    GLU  23           H        GLU  23  -0.630 -11.269   6.983
  198    HA   GLU  23           HA       GLU  23  -0.837 -14.129   6.783
  199   1HB   GLU  23          1HB       GLU  23   0.950 -12.552   7.900
  200   2HB   GLU  23          2HB       GLU  23  -0.086 -12.656   9.309
  201   1HG   GLU  23          1HG       GLU  23   1.620 -14.310   9.554
  202   2HG   GLU  23          2HG       GLU  23   0.108 -15.155   9.255
  203    H    LYS  24           H        LYS  24  -2.505 -11.779   8.808
  204    HA   LYS  24           HA       LYS  24  -4.067 -13.817  10.285
  205   1HB   LYS  24          1HB       LYS  24  -4.129 -10.765  10.302
  206   2HB   LYS  24          2HB       LYS  24  -5.111 -11.776  11.357
  207   1HG   LYS  24          1HG       LYS  24  -2.062 -11.874  11.321
  208   2HG   LYS  24          2HG       LYS  24  -3.003 -10.831  12.387
  209   1HD   LYS  24          1HD       LYS  24  -4.010 -12.714  13.521
  210   2HD   LYS  24          2HD       LYS  24  -3.392 -13.854  12.329
  211   1HE   LYS  24          1HE       LYS  24  -2.069 -14.068  14.300
  212   2HE   LYS  24          2HE       LYS  24  -1.074 -13.402  13.006
  213   1HZ   LYS  24          1HZ       LYS  24  -1.320 -11.210  14.021
  214   2HZ   LYS  24          2HZ       LYS  24  -2.309 -11.804  15.190
  215   3HZ   LYS  24          3HZ       LYS  24  -0.740 -12.253  15.132
  216    H    ALA  25           H        ALA  25  -4.695 -11.555   7.663
  217    HA   ALA  25           HA       ALA  25  -7.542 -12.040   7.508
  218   1HB   ALA  25          1HB       ALA  25  -6.437  -9.918   6.832
  219   2HB   ALA  25          2HB       ALA  25  -5.593 -10.797   5.525
  220   3HB   ALA  25          3HB       ALA  25  -7.348 -10.634   5.491
  221    H    ARG  26           H        ARG  26  -5.248 -14.273   6.812
  222    HA   ARG  26           HA       ARG  26  -5.393 -14.966   4.150
  223   1HB   ARG  26          1HB       ARG  26  -4.357 -17.012   4.811
  224   2HB   ARG  26          2HB       ARG  26  -3.808 -15.737   5.896
  225   1HG   ARG  26          1HG       ARG  26  -5.739 -16.581   7.494
  226   2HG   ARG  26          2HG       ARG  26  -5.749 -18.005   6.448
  227   1HD   ARG  26          1HD       ARG  26  -3.031 -17.615   6.992
  228   2HD   ARG  26          2HD       ARG  26  -3.808 -17.110   8.489
  229    HE   ARG  26           HE       ARG  26  -4.446 -19.760   7.237
  230   1HH1  ARG  26          1HH2      ARG  26  -3.169 -18.074  10.036
  231   2HH1  ARG  26          2HH2      ARG  26  -3.140 -19.524  11.002
  232   1HH2  ARG  26          1HH1      ARG  26  -4.370 -21.559   8.517
  233   2HH2  ARG  26          2HH1      ARG  26  -3.793 -21.443  10.154
  234    H    ASN  27           H        ASN  27  -8.127 -15.312   6.179
  235    HA   ASN  27           HA       ASN  27  -9.416 -17.572   4.965
  236   1HB   ASN  27          1HB       ASN  27 -10.198 -15.128   6.644
  237   2HB   ASN  27          2HB       ASN  27 -11.331 -16.346   6.147
  238   1HD2  ASN  27          2HD2      ASN  27 -11.207 -18.505   7.102
  239   2HD2  ASN  27          1HD2      ASN  27 -10.232 -18.751   8.542
  240    HA   PRO  28           HA       PRO  28 -10.043 -15.647   1.102
  241   1HB   PRO  28          1HB       PRO  28 -12.349 -16.810   0.108
  242   2HB   PRO  28          2HB       PRO  28 -10.744 -17.592   0.205
  243   1HG   PRO  28          1HG       PRO  28 -13.052 -17.821   2.148
  244   2HG   PRO  28          2HG       PRO  28 -12.023 -19.130   1.483
  245   1HD   PRO  28          1HD       PRO  28 -11.581 -18.086   3.948
  246   2HD   PRO  28          2HD       PRO  28 -10.208 -18.533   2.883
  247    H    GLU  29           H        GLU  29 -12.796 -15.416   3.263
  248    HA   GLU  29           HA       GLU  29 -14.353 -13.437   2.029
  249   1HB   GLU  29          1HB       GLU  29 -14.472 -14.924   4.303
  250   2HB   GLU  29          2HB       GLU  29 -13.971 -13.420   5.018
  251   1HG   GLU  29          1HG       GLU  29 -16.349 -13.468   5.129
  252   2HG   GLU  29          2HG       GLU  29 -15.934 -12.276   3.905
  253    H    LYS  30           H        LYS  30 -11.416 -13.065   3.824
  254    HA   LYS  30           HA       LYS  30 -11.415 -10.091   3.476
  255   1HB   LYS  30          1HB       LYS  30  -9.837 -11.862   5.390
  256   2HB   LYS  30          2HB       LYS  30  -9.457 -10.174   5.064
  257   1HG   LYS  30          1HG       LYS  30 -10.561 -10.242   7.107
  258   2HG   LYS  30          2HG       LYS  30 -11.629  -9.460   5.948
  259   1HD   LYS  30          1HD       LYS  30 -13.070 -11.372   5.833
  260   2HD   LYS  30          2HD       LYS  30 -11.914 -12.409   6.688
  261   1HE   LYS  30          1HE       LYS  30 -13.269  -9.953   7.899
  262   2HE   LYS  30          2HE       LYS  30 -13.909 -11.592   8.036
  263   1HZ   LYS  30          1HZ       LYS  30 -11.882 -12.250   9.195
  264   2HZ   LYS  30          2HZ       LYS  30 -11.248 -10.750   9.073
  265   3HZ   LYS  30          3HZ       LYS  30 -12.581 -11.004   9.978
  266    H    LYS  31           H        LYS  31  -9.422 -12.977   3.001
  267    HA   LYS  31           HA       LYS  31  -7.188 -11.809   1.878
  268   1HB   LYS  31          1HB       LYS  31  -7.491 -14.152   2.656
  269   2HB   LYS  31          2HB       LYS  31  -8.294 -14.528   1.146
  270   1HG   LYS  31          1HG       LYS  31  -5.568 -13.258   0.968
  271   2HG   LYS  31          2HG       LYS  31  -5.653 -14.897   1.620
  272   1HD   LYS  31          1HD       LYS  31  -6.828 -15.709  -0.348
  273   2HD   LYS  31          2HD       LYS  31  -6.858 -14.082  -1.053
  274   1HE   LYS  31          1HE       LYS  31  -4.379 -14.028  -1.078
  275   2HE   LYS  31          2HE       LYS  31  -4.323 -15.632  -0.337
  276   1HZ   LYS  31          1HZ       LYS  31  -5.419 -16.522  -2.322
  277   2HZ   LYS  31          2HZ       LYS  31  -5.487 -15.039  -3.009
  278   3HZ   LYS  31          3HZ       LYS  31  -4.044 -15.755  -2.747
  279    H    SER  32           H        SER  32 -10.198 -12.288   0.228
  280    HA   SER  32           HA       SER  32  -9.001 -11.300  -2.317
  281   1HB   SER  32          1HB       SER  32 -11.080 -11.972  -3.385
  282   2HB   SER  32          2HB       SER  32 -10.432 -13.319  -2.441
  283    HG   SER  32           HG       SER  32 -11.976 -12.974  -0.872
  284    H    VAL  33           H        VAL  33 -10.127  -9.829   0.315
  285    HA   VAL  33           HA       VAL  33 -11.359  -7.526  -1.162
  286    HB   VAL  33           HB       VAL  33 -11.488  -8.214   1.797
  287   1HG1  VAL  33          1HG1      VAL  33 -11.492  -5.775   1.526
  288   2HG1  VAL  33          2HG1      VAL  33 -12.711  -5.892   0.236
  289   3HG1  VAL  33          3HG1      VAL  33 -13.121  -6.328   1.908
  290   1HG2  VAL  33          1HG2      VAL  33 -13.636  -8.206  -0.375
  291   2HG2  VAL  33          2HG2      VAL  33 -12.946  -9.650   0.398
  292   3HG2  VAL  33          3HG2      VAL  33 -13.902  -8.517   1.355
  293    H    LEU  34           H        LEU  34  -8.831  -8.301   1.400
  294    HA   LEU  34           HA       LEU  34  -7.740  -5.628   1.180
  295   1HB   LEU  34          1HB       LEU  34  -6.302  -6.163   2.755
  296   2HB   LEU  34          2HB       LEU  34  -7.531  -7.354   3.137
  297    HG   LEU  34           HG       LEU  34  -5.087  -7.812   1.453
  298   1HD1  LEU  34          1HD1      LEU  34  -4.446  -7.278   3.817
  299   2HD1  LEU  34          2HD1      LEU  34  -5.501  -8.576   4.379
  300   3HD1  LEU  34          3HD1      LEU  34  -4.066  -8.940   3.386
  301   1HD2  LEU  34          1HD2      LEU  34  -6.870  -9.830   2.826
  302   2HD2  LEU  34          2HD2      LEU  34  -6.844  -9.499   1.078
  303   3HD2  LEU  34          3HD2      LEU  34  -5.423 -10.204   1.857
  304    H    GLN  35           H        GLN  35  -7.388  -8.492  -0.811
  305    HA   GLN  35           HA       GLN  35  -5.004  -7.837  -2.196
  306   1HB   GLN  35          1HB       GLN  35  -6.167  -9.984  -2.282
  307   2HB   GLN  35          2HB       GLN  35  -7.522  -9.247  -3.153
  308   1HG   GLN  35          1HG       GLN  35  -6.034  -8.787  -5.078
  309   2HG   GLN  35          2HG       GLN  35  -4.644  -9.370  -4.154
  310   1HE2  GLN  35          2HE2      GLN  35  -4.080 -11.167  -5.461
  311   2HE2  GLN  35          1HE2      GLN  35  -5.185 -12.507  -5.735
  312    H    LYS  36           H        LYS  36  -8.291  -6.522  -2.579
  313    HA   LYS  36           HA       LYS  36  -7.711  -5.239  -5.135
  314   1HB   LYS  36          1HB       LYS  36  -9.970  -6.087  -4.257
  315   2HB   LYS  36          2HB       LYS  36 -10.006  -4.678  -3.191
  316   1HG   LYS  36          1HG       LYS  36  -9.913  -3.192  -5.195
  317   2HG   LYS  36          2HG       LYS  36  -9.842  -4.622  -6.243
  318   1HD   LYS  36          1HD       LYS  36 -12.044  -5.377  -5.396
  319   2HD   LYS  36          2HD       LYS  36 -12.127  -3.965  -4.323
  320   1HE   LYS  36          1HE       LYS  36 -12.057  -2.460  -6.293
  321   2HE   LYS  36          2HE       LYS  36 -11.945  -3.859  -7.368
  322   1HZ   LYS  36          1HZ       LYS  36 -14.136  -4.567  -6.575
  323   2HZ   LYS  36          2HZ       LYS  36 -14.241  -3.282  -5.570
  324   3HZ   LYS  36          3HZ       LYS  36 -14.234  -3.059  -7.188
  325    H    ILE  37           H        ILE  37  -7.892  -4.080  -1.772
  326    HA   ILE  37           HA       ILE  37  -6.975  -1.359  -2.301
  327    HB   ILE  37           HB       ILE  37  -6.904  -3.247   0.051
  328   1HG1  ILE  37          1HG1      ILE  37  -8.138  -0.591   0.436
  329   2HG1  ILE  37          2HG1      ILE  37  -8.921  -1.595  -0.750
  330   1HG2  ILE  37          1HG2      ILE  37  -4.875  -1.937   0.412
  331   2HG2  ILE  37          2HG2      ILE  37  -5.706  -0.441  -0.105
  332   3HG2  ILE  37          3HG2      ILE  37  -6.118  -1.205   1.426
  333   1HD1  ILE  37          1HD1      ILE  37  -9.210  -3.404   0.883
  334   2HD1  ILE  37          2HD1      ILE  37  -8.272  -2.496   2.085
  335   3HD1  ILE  37          3HD1      ILE  37  -9.848  -1.886   1.552
  336    H    LEU  38           H        LEU  38  -5.158  -4.434  -1.535
  337    HA   LEU  38           HA       LEU  38  -2.577  -3.322  -1.672
  338   1HB   LEU  38          1HB       LEU  38  -3.687  -6.059  -2.328
  339   2HB   LEU  38          2HB       LEU  38  -1.996  -5.720  -2.605
  340    HG   LEU  38           HG       LEU  38  -3.317  -5.391   0.125
  341   1HD1  LEU  38          1HD1      LEU  38  -3.375  -7.752  -0.603
  342   2HD1  LEU  38          2HD1      LEU  38  -1.638  -7.684  -0.980
  343   3HD1  LEU  38          3HD1      LEU  38  -2.206  -7.512   0.699
  344   1HD2  LEU  38          1HD2      LEU  38  -0.828  -5.624   0.793
  345   2HD2  LEU  38          2HD2      LEU  38  -0.455  -5.291  -0.899
  346   3HD2  LEU  38          3HD2      LEU  38  -1.344  -4.088   0.081
  347    H    GLU  39           H        GLU  39  -4.564  -4.510  -4.461
  348    HA   GLU  39           HA       GLU  39  -2.491  -3.856  -6.351
  349   1HB   GLU  39          1HB       GLU  39  -4.311  -5.536  -6.723
  350   2HB   GLU  39          2HB       GLU  39  -5.497  -4.225  -6.773
  351   1HG   GLU  39          1HG       GLU  39  -4.416  -3.302  -8.793
  352   2HG   GLU  39          2HG       GLU  39  -3.146  -4.525  -8.695
  353    H    ASP  40           H        ASP  40  -5.284  -1.960  -5.175
  354    HA   ASP  40           HA       ASP  40  -4.900   0.328  -6.853
  355   1HB   ASP  40          1HB       ASP  40  -6.173  -0.381  -4.196
  356   2HB   ASP  40          2HB       ASP  40  -6.000   1.267  -4.607
  357    H    GLU  41           H        GLU  41  -3.395  -0.687  -3.755
  358    HA   GLU  41           HA       GLU  41  -2.056   1.913  -3.413
  359   1HB   GLU  41          1HB       GLU  41  -1.570  -0.733  -1.996
  360   2HB   GLU  41          2HB       GLU  41  -0.747   0.771  -1.627
  361   1HG   GLU  41          1HG       GLU  41  -3.573  -0.031  -0.927
  362   2HG   GLU  41          2HG       GLU  41  -2.291   0.476   0.114
  363    H    GLU  42           H        GLU  42  -1.153  -1.272  -4.743
  364    HA   GLU  42           HA       GLU  42   1.545  -0.601  -5.419
  365   1HB   GLU  42          1HB       GLU  42   0.595  -2.883  -5.487
  366   2HB   GLU  42          2HB       GLU  42  -0.396  -2.434  -6.881
  367   1HG   GLU  42          1HG       GLU  42   1.636  -2.007  -8.214
  368   2HG   GLU  42          2HG       GLU  42   2.649  -2.334  -6.805
  369    H    LYS  43           H        LYS  43  -1.516   0.026  -7.175
  370    HA   LYS  43           HA       LYS  43  -0.286   1.222  -9.477
  371   1HB   LYS  43          1HB       LYS  43  -2.886   0.561  -8.827
  372   2HB   LYS  43          2HB       LYS  43  -2.941   2.306  -8.641
  373   1HG   LYS  43          1HG       LYS  43  -3.579   1.878 -10.865
  374   2HG   LYS  43          2HG       LYS  43  -1.903   2.436 -10.994
  375   1HD   LYS  43          1HD       LYS  43  -1.139   0.074 -11.212
  376   2HD   LYS  43          2HD       LYS  43  -2.814  -0.481 -11.012
  377   1HE   LYS  43          1HE       LYS  43  -3.463   0.802 -13.052
  378   2HE   LYS  43          2HE       LYS  43  -1.782   1.309 -13.260
  379   1HZ   LYS  43          1HZ       LYS  43  -1.179  -1.044 -13.521
  380   2HZ   LYS  43          2HZ       LYS  43  -2.735  -1.507 -13.330
  381   3HZ   LYS  43          3HZ       LYS  43  -2.299  -0.628 -14.631
  382    H    HIS  44           H        HIS  44  -1.339   2.782  -6.341
  383    HA   HIS  44           HA       HIS  44  -0.641   5.401  -7.053
  384   1HB   HIS  44          1HB       HIS  44  -0.515   3.933  -4.374
  385   2HB   HIS  44          2HB       HIS  44  -0.552   5.644  -4.659
  386    HD2  HIS  44           2HD      HIS  44  -2.988   4.813  -7.042
  387    HE1  HIS  44           1HE      HIS  44  -5.311   4.549  -3.504
  388    HE2  HIS  44           2HE      HIS  44  -5.373   4.593  -6.054
  389    H    ILE  45           H        ILE  45   1.316   2.772  -5.588
  390    HA   ILE  45           HA       ILE  45   3.737   4.266  -5.342
  391    HB   ILE  45           HB       ILE  45   2.908   1.404  -5.207
  392   1HG1  ILE  45          1HG1      ILE  45   4.406   1.489  -3.186
  393   2HG1  ILE  45          2HG1      ILE  45   4.782   3.164  -3.575
  394   1HG2  ILE  45          1HG2      ILE  45   4.767   1.085  -6.745
  395   2HG2  ILE  45          2HG2      ILE  45   5.825   2.087  -5.717
  396   3HG2  ILE  45          3HG2      ILE  45   5.201   0.527  -5.135
  397   1HD1  ILE  45          1HD1      ILE  45   2.353   3.736  -3.230
  398   2HD1  ILE  45          2HD1      ILE  45   2.079   2.039  -2.759
  399   3HD1  ILE  45          3HD1      ILE  45   3.145   3.067  -1.796
  400    H    GLU  46           H        GLU  46   2.530   2.418  -8.222
  401    HA   GLU  46           HA       GLU  46   4.837   2.852  -9.826
  402   1HB   GLU  46          1HB       GLU  46   1.882   2.575 -10.501
  403   2HB   GLU  46          2HB       GLU  46   3.122   2.712 -11.720
  404   1HG   GLU  46          1HG       GLU  46   3.091   0.514  -9.625
  405   2HG   GLU  46          2HG       GLU  46   2.338   0.383 -11.212
  406    H    TRP  47           H        TRP  47   1.983   4.973  -9.322
  407    HA   TRP  47           HA       TRP  47   2.888   6.980 -11.199
  408   1HB   TRP  47          1HB       TRP  47   0.936   7.251  -8.882
  409   2HB   TRP  47          2HB       TRP  47   1.038   8.250 -10.310
  410    HD1  TRP  47           1HD      TRP  47   1.095   5.376 -12.193
  411    HE1  TRP  47           1HE      TRP  47  -1.174   4.237 -12.600
  412    HE3  TRP  47           3HE      TRP  47  -1.617   7.664  -8.545
  413    HZ2  TRP  47           2HZ      TRP  47  -3.844   4.329 -11.480
  414    HZ3  TRP  47           3HZ      TRP  47  -4.027   7.134  -8.201
  415    HH2  TRP  47           2HH      TRP  47  -5.135   5.427  -9.643
  416    H    LEU  48           H        LEU  48   3.053   6.636  -7.652
  417    HA   LEU  48           HA       LEU  48   4.350   9.057  -6.965
  418   1HB   LEU  48          1HB       LEU  48   4.243   6.245  -5.866
  419   2HB   LEU  48          2HB       LEU  48   5.269   7.396  -5.086
  420    HG   LEU  48           HG       LEU  48   2.320   7.924  -5.555
  421   1HD1  LEU  48          1HD1      LEU  48   2.556   5.938  -4.144
  422   2HD1  LEU  48          2HD1      LEU  48   3.721   6.775  -3.105
  423   3HD1  LEU  48          3HD1      LEU  48   2.020   7.308  -3.169
  424   1HD2  LEU  48          1HD2      LEU  48   4.351   9.183  -3.653
  425   2HD2  LEU  48          2HD2      LEU  48   3.662   9.954  -5.097
  426   3HD2  LEU  48          3HD2      LEU  48   2.618   9.573  -3.726
  427    H    GLU  49           H        GLU  49   5.750   5.991  -8.112
  428    HA   GLU  49           HA       GLU  49   8.489   6.853  -8.041
  429   1HB   GLU  49          1HB       GLU  49   7.422   4.477  -8.464
  430   2HB   GLU  49          2HB       GLU  49   7.407   4.950 -10.151
  431   1HG   GLU  49          1HG       GLU  49   9.864   5.421 -10.031
  432   2HG   GLU  49          2HG       GLU  49   9.867   4.904  -8.346
  433    H    THR  50           H        THR  50   6.062   7.010 -10.666
  434    HA   THR  50           HA       THR  50   7.829   8.364 -12.497
  435    HB   THR  50           HB       THR  50   5.306   7.257 -12.702
  436    HG1  THR  50           1HG      THR  50   5.631   7.698 -14.860
  437   1HG2  THR  50          1HG2      THR  50   4.164   9.427 -12.174
  438   2HG2  THR  50          2HG2      THR  50   5.021  10.174 -13.537
  439   3HG2  THR  50          3HG2      THR  50   3.872   8.851 -13.814
  440    H    ILE  51           H        ILE  51   5.941   9.583  -9.871
  441    HA   ILE  51           HA       ILE  51   6.347  12.395 -10.519
  442    HB   ILE  51           HB       ILE  51   5.205  10.906  -8.143
  443   1HG1  ILE  51          1HG1      ILE  51   3.832  12.872 -10.029
  444   2HG1  ILE  51          2HG1      ILE  51   3.934  11.157 -10.383
  445   1HG2  ILE  51          1HG2      ILE  51   6.200  12.913  -7.161
  446   2HG2  ILE  51          2HG2      ILE  51   5.423  13.934  -8.394
  447   3HG2  ILE  51          3HG2      ILE  51   4.456  13.074  -7.179
  448   1HD1  ILE  51          1HD1      ILE  51   1.793  11.571  -9.403
  449   2HD1  ILE  51          2HD1      ILE  51   2.750  10.642  -8.236
  450   3HD1  ILE  51          3HD1      ILE  51   2.497  12.389  -8.005
  451    H    ASN  52           H        ASN  52   8.095  10.063  -8.781
  452    HA   ASN  52           HA       ASN  52   9.751  11.832  -7.200
  453   1HB   ASN  52          1HB       ASN  52   9.322   9.388  -6.736
  454   2HB   ASN  52          2HB       ASN  52  10.352   8.992  -8.115
  455   1HD2  ASN  52          2HD2      ASN  52  11.855   7.850  -6.769
  456   2HD2  ASN  52          1HD2      ASN  52  12.908   8.731  -5.672
  457    H    GLY  53           H        GLY  53  12.065  12.171  -7.431
  458   1HA   GLY  53          1HA       GLY  53  13.577  11.843  -9.832
  459   2HA   GLY  53          2HA       GLY  53  12.839  13.445  -9.853
  460   1H    MET   1          1H        MET   1  -5.487 -10.122  20.400
  461   2H    MET   1          2H        MET   1  -6.571 -10.694  19.312
  462   3H    MET   1          3H        MET   1  -6.775  -9.210  19.968
  463    HA   MET   1           HA       MET   1  -4.813  -8.372  18.896
  464   1HB   MET   1          1HB       MET   1  -3.598 -10.527  18.921
  465   2HB   MET   1          2HB       MET   1  -4.630 -11.151  17.635
  466   1HG   MET   1          1HG       MET   1  -3.030  -8.593  17.289
  467   2HG   MET   1          2HG       MET   1  -2.276 -10.168  17.097
  468   1HE   MET   1          1HE       MET   1  -2.571  -7.646  14.918
  469   2HE   MET   1          2HE       MET   1  -1.486  -9.045  14.777
  470   3HE   MET   1          3HE       MET   1  -2.604  -8.649  13.451
  471    H    ASP   2           H        ASP   2  -5.261  -7.092  17.147
  472    HA   ASP   2           HA       ASP   2  -7.427  -7.878  15.253
  473   1HB   ASP   2          1HB       ASP   2  -7.215  -5.188  16.653
  474   2HB   ASP   2          2HB       ASP   2  -8.401  -5.634  15.435
  475    H    TYR   3           H        TYR   3  -7.382  -6.710  13.269
  476    HA   TYR   3           HA       TYR   3  -4.932  -5.162  12.575
  477   1HB   TYR   3          1HB       TYR   3  -4.445  -6.757  10.741
  478   2HB   TYR   3          2HB       TYR   3  -4.352  -7.525  12.305
  479    HD1  TYR   3           1HD      TYR   3  -6.279  -7.345   9.142
  480    HD2  TYR   3           2HD      TYR   3  -5.919  -9.286  12.980
  481    HE1  TYR   3           1HE      TYR   3  -7.887  -9.099   8.410
  482    HE2  TYR   3           2HE      TYR   3  -7.515 -11.044  12.237
  483    HH   TYR   3           HH       TYR   3  -8.839 -11.817  10.539
  484    H    LEU   4           H        LEU   4  -7.895  -4.513  12.677
  485    HA   LEU   4           HA       LEU   4  -8.143  -3.666   9.842
  486   1HB   LEU   4          1HB       LEU   4 -10.477  -3.789   9.924
  487   2HB   LEU   4          2HB       LEU   4  -9.788  -5.295  10.488
  488    HG   LEU   4           HG       LEU   4 -10.116  -4.046  12.883
  489   1HD1  LEU   4          1HD1      LEU   4 -11.218  -2.037  11.873
  490   2HD1  LEU   4          2HD1      LEU   4 -12.430  -3.092  11.139
  491   3HD1  LEU   4          3HD1      LEU   4 -12.331  -2.940  12.909
  492   1HD2  LEU   4          1HD2      LEU   4 -12.288  -5.577  11.399
  493   2HD2  LEU   4          2HD2      LEU   4 -10.945  -6.291  12.316
  494   3HD2  LEU   4          3HD2      LEU   4 -12.186  -5.351  13.158
  495    H    ARG   5           H        ARG   5  -8.845  -2.370  13.141
  496    HA   ARG   5           HA       ARG   5  -9.209   0.334  12.233
  497   1HB   ARG   5          1HB       ARG   5  -8.885   0.979  14.563
  498   2HB   ARG   5          2HB       ARG   5  -9.996  -0.377  14.395
  499   1HG   ARG   5          1HG       ARG   5  -8.206  -1.952  15.110
  500   2HG   ARG   5          2HG       ARG   5  -7.076  -0.595  15.277
  501   1HD   ARG   5          1HD       ARG   5  -8.459   0.414  17.004
  502   2HD   ARG   5          2HD       ARG   5  -9.704  -0.820  16.797
  503    HE   ARG   5           HE       ARG   5  -7.049  -1.131  18.101
  504   1HH1  ARG   5          1HH2      ARG   5 -10.046  -2.791  17.210
  505   2HH1  ARG   5          2HH2      ARG   5  -9.535  -4.228  18.094
  506   1HH2  ARG   5          1HH1      ARG   5  -6.607  -3.057  19.214
  507   2HH2  ARG   5          2HH1      ARG   5  -7.762  -4.378  19.068
  508    H    GLU   6           H        GLU   6  -6.273  -1.422  12.959
  509    HA   GLU   6           HA       GLU   6  -4.437   0.763  12.938
  510   1HB   GLU   6          1HB       GLU   6  -4.148  -1.748  13.643
  511   2HB   GLU   6          2HB       GLU   6  -3.892  -2.075  11.944
  512   1HG   GLU   6          1HG       GLU   6  -1.743  -1.836  12.917
  513   2HG   GLU   6          2HG       GLU   6  -2.004  -0.354  11.998
  514    H    LEU   7           H        LEU   7  -5.398  -1.438  10.307
  515    HA   LEU   7           HA       LEU   7  -4.307  -0.026   8.108
  516   1HB   LEU   7          1HB       LEU   7  -6.304  -2.279   8.595
  517   2HB   LEU   7          2HB       LEU   7  -6.030  -1.657   6.977
  518    HG   LEU   7           HG       LEU   7  -3.653  -2.089   7.153
  519   1HD1  LEU   7          1HD1      LEU   7  -3.091  -2.113   9.466
  520   2HD1  LEU   7          2HD1      LEU   7  -4.219  -3.450   9.790
  521   3HD1  LEU   7          3HD1      LEU   7  -2.764  -3.716   8.813
  522   1HD2  LEU   7          1HD2      LEU   7  -5.397  -3.749   6.265
  523   2HD2  LEU   7          2HD2      LEU   7  -3.820  -4.425   6.688
  524   3HD2  LEU   7          3HD2      LEU   7  -5.209  -4.625   7.781
  525    H    TYR   8           H        TYR   8  -6.557   1.321   9.977
  526    HA   TYR   8           HA       TYR   8  -8.198   2.473   7.721
  527   1HB   TYR   8          1HB       TYR   8  -9.121   0.909   9.690
  528   2HB   TYR   8          2HB       TYR   8  -8.978   2.306  10.683
  529    HD1  TYR   8           1HD      TYR   8 -11.386   0.841  10.570
  530    HD2  TYR   8           2HD      TYR   8 -10.081   4.055   7.991
  531    HE1  TYR   8           1HE      TYR   8 -13.757   1.460  10.135
  532    HE2  TYR   8           2HE      TYR   8 -12.453   4.672   7.593
  533    HH   TYR   8           HH       TYR   8 -14.648   4.195   8.007
  534    H    LYS   9           H        LYS   9  -6.891   3.113  10.990
  535    HA   LYS   9           HA       LYS   9  -7.312   5.919  10.884
  536   1HB   LYS   9          1HB       LYS   9  -6.865   4.378  12.939
  537   2HB   LYS   9          2HB       LYS   9  -5.168   4.421  12.503
  538   1HG   LYS   9          1HG       LYS   9  -5.436   6.049  14.223
  539   2HG   LYS   9          2HG       LYS   9  -5.235   6.945  12.730
  540   1HD   LYS   9          1HD       LYS   9  -6.996   8.121  13.497
  541   2HD   LYS   9          2HD       LYS   9  -7.967   6.849  12.776
  542   1HE   LYS   9          1HE       LYS   9  -7.069   6.991  15.696
  543   2HE   LYS   9          2HE       LYS   9  -8.643   7.506  15.094
  544   1HZ   LYS   9          1HZ       LYS   9  -9.054   5.196  14.394
  545   2HZ   LYS   9          2HZ       LYS   9  -7.619   4.719  15.038
  546   3HZ   LYS   9          3HZ       LYS   9  -8.797   5.295  16.000
  547    H    LEU  10           H        LEU  10  -4.246   4.223  10.233
  548    HA   LEU  10           HA       LEU  10  -2.891   6.535   9.354
  549   1HB   LEU  10          1HB       LEU  10  -2.528   3.579   8.782
  550   2HB   LEU  10          2HB       LEU  10  -1.436   4.788   8.112
  551    HG   LEU  10           HG       LEU  10  -1.952   4.555  11.109
  552   1HD1  LEU  10          1HD1      LEU  10  -1.048   2.452  10.309
  553   2HD1  LEU  10          2HD1      LEU  10   0.259   3.294   9.439
  554   3HD1  LEU  10          3HD1      LEU  10   0.187   3.330  11.219
  555   1HD2  LEU  10          1HD2      LEU  10   0.302   5.846   9.500
  556   2HD2  LEU  10          2HD2      LEU  10  -0.968   6.712  10.394
  557   3HD2  LEU  10          3HD2      LEU  10   0.216   5.742  11.272
  558    H    GLU  11           H        GLU  11  -4.956   4.232   7.631
  559    HA   GLU  11           HA       GLU  11  -4.803   5.309   5.011
  560   1HB   GLU  11          1HB       GLU  11  -6.448   3.475   6.614
  561   2HB   GLU  11          2HB       GLU  11  -7.419   4.208   5.408
  562   1HG   GLU  11          1HG       GLU  11  -4.730   2.781   4.967
  563   2HG   GLU  11          2HG       GLU  11  -6.304   2.026   4.805
  564    H    GLN  12           H        GLN  12  -6.829   6.477   7.826
  565    HA   GLN  12           HA       GLN  12  -7.934   8.606   6.160
  566   1HB   GLN  12          1HB       GLN  12  -8.110   7.827   9.083
  567   2HB   GLN  12          2HB       GLN  12  -8.873   9.291   8.421
  568   1HG   GLN  12          1HG       GLN  12 -10.055   7.986   6.761
  569   2HG   GLN  12          2HG       GLN  12  -9.351   6.490   7.348
  570   1HE2  GLN  12          2HE2      GLN  12 -12.267   7.835   7.342
  571   2HE2  GLN  12          1HE2      GLN  12 -12.800   7.452   8.971
  572    H    GLN  13           H        GLN  13  -5.378   8.488   8.566
  573    HA   GLN  13           HA       GLN  13  -4.805  11.258   8.614
  574   1HB   GLN  13          1HB       GLN  13  -3.990   9.460  10.185
  575   2HB   GLN  13          2HB       GLN  13  -2.963   8.817   8.886
  576   1HG   GLN  13          1HG       GLN  13  -1.781  10.942   8.767
  577   2HG   GLN  13          2HG       GLN  13  -2.806  11.612  10.055
  578   1HE2  GLN  13          2HE2      GLN  13   0.146  11.380  10.106
  579   2HE2  GLN  13          1HE2      GLN  13   0.506  10.304  11.449
  580    H    ALA  14           H        ALA  14  -3.863   8.719   6.261
  581    HA   ALA  14           HA       ALA  14  -2.181  10.438   4.631
  582   1HB   ALA  14          1HB       ALA  14  -2.281   7.869   4.546
  583   2HB   ALA  14          2HB       ALA  14  -3.897   8.002   3.848
  584   3HB   ALA  14          3HB       ALA  14  -2.501   8.649   2.965
  585    H    MET  15           H        MET  15  -5.634   9.548   4.578
  586    HA   MET  15           HA       MET  15  -6.364  11.116   2.287
  587   1HB   MET  15          1HB       MET  15  -7.769   9.304   3.263
  588   2HB   MET  15          2HB       MET  15  -7.947  10.230   4.739
  589   1HG   MET  15          1HG       MET  15  -9.952  10.570   3.860
  590   2HG   MET  15          2HG       MET  15  -9.149  12.013   3.279
  591   1HE   MET  15          1HE       MET  15  -8.441  12.445   0.926
  592   2HE   MET  15          2HE       MET  15  -7.559  10.941   0.532
  593   3HE   MET  15          3HE       MET  15  -8.902  11.478  -0.485
  594    H    LYS  16           H        LYS  16  -6.298  12.038   5.776
  595    HA   LYS  16           HA       LYS  16  -7.219  14.742   5.399
  596   1HB   LYS  16          1HB       LYS  16  -5.416  13.452   7.507
  597   2HB   LYS  16          2HB       LYS  16  -6.022  15.090   7.638
  598   1HG   LYS  16          1HG       LYS  16  -8.166  13.062   7.183
  599   2HG   LYS  16          2HG       LYS  16  -7.221  12.799   8.644
  600   1HD   LYS  16          1HD       LYS  16  -9.167  14.111   9.173
  601   2HD   LYS  16          2HD       LYS  16  -7.707  15.077   9.427
  602   1HE   LYS  16          1HE       LYS  16  -8.075  16.200   7.236
  603   2HE   LYS  16          2HE       LYS  16  -9.520  15.210   6.971
  604   1HZ   LYS  16          1HZ       LYS  16 -10.501  16.233   8.957
  605   2HZ   LYS  16          2HZ       LYS  16  -9.170  17.147   9.204
  606   3HZ   LYS  16          3HZ       LYS  16 -10.097  17.392   7.885
  607    H    LEU  17           H        LEU  17  -3.902  13.365   5.480
  608    HA   LEU  17           HA       LEU  17  -2.650  15.860   4.909
  609   1HB   LEU  17          1HB       LEU  17  -1.830  13.133   5.315
  610   2HB   LEU  17          2HB       LEU  17  -1.083  13.637   3.834
  611    HG   LEU  17           HG       LEU  17  -1.055  15.149   6.489
  612   1HD1  LEU  17          1HD1      LEU  17   0.248  13.036   6.553
  613   2HD1  LEU  17          2HD1      LEU  17   1.223  13.623   5.177
  614   3HD1  LEU  17          3HD1      LEU  17   1.271  14.469   6.736
  615   1HD2  LEU  17          1HD2      LEU  17   0.566  15.674   3.953
  616   2HD2  LEU  17          2HD2      LEU  17  -0.694  16.733   4.610
  617   3HD2  LEU  17          3HD2      LEU  17   0.807  16.499   5.507
  618    H    TYR  18           H        TYR  18  -3.936  13.400   2.693
  619    HA   TYR  18           HA       TYR  18  -3.160  14.591   0.254
  620   1HB   TYR  18          1HB       TYR  18  -5.133  12.562   1.163
  621   2HB   TYR  18          2HB       TYR  18  -5.544  13.305  -0.336
  622    HD1  TYR  18           1HD      TYR  18  -3.440  13.574  -2.051
  623    HD2  TYR  18           2HD      TYR  18  -3.815  10.617   1.060
  624    HE1  TYR  18           1HE      TYR  18  -1.608  12.233  -3.098
  625    HE2  TYR  18           2HE      TYR  18  -1.943   9.316   0.057
  626    HH   TYR  18           HH       TYR  18  -0.348   9.242  -1.597
  627    H    ARG  19           H        ARG  19  -6.017  15.360   2.306
  628    HA   ARG  19           HA       ARG  19  -7.210  17.167   0.421
  629   1HB   ARG  19          1HB       ARG  19  -8.248  16.167   2.532
  630   2HB   ARG  19          2HB       ARG  19  -7.369  17.400   3.454
  631   1HG   ARG  19          1HG       ARG  19  -8.518  19.177   2.093
  632   2HG   ARG  19          2HG       ARG  19  -9.382  17.905   1.210
  633   1HD   ARG  19          1HD       ARG  19 -10.380  17.151   3.392
  634   2HD   ARG  19          2HD       ARG  19  -9.570  18.517   4.183
  635    HE   ARG  19           HE       ARG  19 -11.389  19.044   1.877
  636   1HH1  ARG  19          1HH2      ARG  19 -10.974  19.350   5.345
  637   2HH1  ARG  19          2HH2      ARG  19 -12.323  20.442   5.493
  638   1HH2  ARG  19          1HH1      ARG  19 -13.077  20.442   2.142
  639   2HH2  ARG  19          2HH1      ARG  19 -13.474  21.040   3.725
  640    H    GLU  20           H        GLU  20  -4.755  17.769   2.941
  641    HA   GLU  20           HA       GLU  20  -4.578  20.636   2.363
  642   1HB   GLU  20          1HB       GLU  20  -3.915  18.967   4.467
  643   2HB   GLU  20          2HB       GLU  20  -2.344  19.223   3.756
  644   1HG   GLU  20          1HG       GLU  20  -4.300  21.381   4.677
  645   2HG   GLU  20          2HG       GLU  20  -2.898  20.823   5.582
  646    H    ALA  21           H        ALA  21  -2.651  17.767   1.531
  647    HA   ALA  21           HA       ALA  21  -0.643  19.058  -0.014
  648   1HB   ALA  21          1HB       ALA  21  -0.533  16.700   0.663
  649   2HB   ALA  21          2HB       ALA  21  -1.887  16.313  -0.429
  650   3HB   ALA  21          3HB       ALA  21  -0.341  16.874  -1.093
  651    H    SER  22           H        SER  22  -3.997  18.128  -0.974
  652    HA   SER  22           HA       SER  22  -3.828  18.968  -3.686
  653   1HB   SER  22          1HB       SER  22  -5.719  17.730  -2.592
  654   2HB   SER  22          2HB       SER  22  -6.240  19.267  -1.872
  655    HG   SER  22           HG       SER  22  -7.295  18.780  -3.872
  656    H    GLU  23           H        GLU  23  -4.154  20.966  -0.736
  657    HA   GLU  23           HA       GLU  23  -4.701  23.435  -2.158
  658   1HB   GLU  23          1HB       GLU  23  -5.048  22.795   0.378
  659   2HB   GLU  23          2HB       GLU  23  -3.367  23.269   0.542
  660   1HG   GLU  23          1HG       GLU  23  -4.651  25.172   1.121
  661   2HG   GLU  23          2HG       GLU  23  -3.924  25.514  -0.440
  662    H    LYS  24           H        LYS  24  -1.758  21.883  -0.883
  663    HA   LYS  24           HA       LYS  24   0.125  23.889  -1.822
  664   1HB   LYS  24          1HB       LYS  24   0.526  20.907  -1.307
  665   2HB   LYS  24          2HB       LYS  24   1.808  22.061  -1.675
  666   1HG   LYS  24          1HG       LYS  24   1.135  23.388   0.363
  667   2HG   LYS  24          2HG       LYS  24   0.016  22.075   0.791
  668   1HD   LYS  24          1HD       LYS  24   1.914  20.476   0.856
  669   2HD   LYS  24          2HD       LYS  24   3.012  21.755   0.325
  670   1HE   LYS  24          1HE       LYS  24   3.429  21.666   2.590
  671   2HE   LYS  24          2HE       LYS  24   2.344  23.049   2.434
  672   1HZ   LYS  24          1HZ       LYS  24   0.509  21.601   3.192
  673   2HZ   LYS  24          2HZ       LYS  24   1.517  20.312   3.271
  674   3HZ   LYS  24          3HZ       LYS  24   1.717  21.580   4.276
  675    H    ALA  25           H        ALA  25  -1.020  20.885  -3.318
  676    HA   ALA  25           HA       ALA  25   0.375  21.194  -5.813
  677   1HB   ALA  25          1HB       ALA  25  -0.242  19.014  -4.762
  678   2HB   ALA  25          2HB       ALA  25  -1.959  19.396  -5.018
  679   3HB   ALA  25          3HB       ALA  25  -0.882  19.169  -6.401
  680    H    ARG  26           H        ARG  26  -1.308  23.559  -5.269
  681    HA   ARG  26           HA       ARG  26  -3.810  23.557  -6.510
  682   1HB   ARG  26          1HB       ARG  26  -3.659  25.950  -6.371
  683   2HB   ARG  26          2HB       ARG  26  -2.894  25.231  -4.974
  684   1HG   ARG  26          1HG       ARG  26  -0.698  25.476  -6.654
  685   2HG   ARG  26          2HG       ARG  26  -1.698  26.828  -7.200
  686   1HD   ARG  26          1HD       ARG  26  -1.859  27.521  -4.754
  687   2HD   ARG  26          2HD       ARG  26  -0.690  26.245  -4.387
  688    HE   ARG  26           HE       ARG  26   0.242  28.011  -6.502
  689   1HH1  ARG  26          1HH2      ARG  26   0.069  27.819  -3.010
  690   2HH1  ARG  26          2HH2      ARG  26   1.430  28.886  -2.794
  691   1HH2  ARG  26          1HH1      ARG  26   1.964  29.361  -6.160
  692   2HH2  ARG  26          2HH1      ARG  26   2.469  29.738  -4.539
  693    H    ASN  27           H        ASN  27  -0.783  23.504  -8.146
  694    HA   ASN  27           HA       ASN  27  -1.538  24.406 -10.771
  695   1HB   ASN  27          1HB       ASN  27   0.781  24.193 -10.094
  696   2HB   ASN  27          2HB       ASN  27   0.565  22.484  -9.704
  697   1HD2  ASN  27          2HD2      ASN  27   2.568  22.467 -11.153
  698   2HD2  ASN  27          1HD2      ASN  27   2.244  22.242 -12.862
  699    HA   PRO  28           HA       PRO  28  -4.453  21.006 -11.342
  700   1HB   PRO  28          1HB       PRO  28  -5.142  21.360 -13.983
  701   2HB   PRO  28          2HB       PRO  28  -5.743  22.366 -12.631
  702   1HG   PRO  28          1HG       PRO  28  -3.433  22.947 -14.502
  703   2HG   PRO  28          2HG       PRO  28  -4.765  24.043 -14.013
  704   1HD   PRO  28          1HD       PRO  28  -2.332  24.138 -12.828
  705   2HD   PRO  28          2HD       PRO  28  -3.824  24.369 -11.863
  706    H    GLU  29           H        GLU  29  -1.493  21.285 -13.192
  707    HA   GLU  29           HA       GLU  29  -1.486  18.783 -14.541
  708   1HB   GLU  29          1HB       GLU  29   0.194  20.863 -14.428
  709   2HB   GLU  29          2HB       GLU  29   0.984  19.902 -13.202
  710   1HG   GLU  29          1HG       GLU  29   2.100  19.430 -15.245
  711   2HG   GLU  29          2HG       GLU  29   1.146  18.001 -14.876
  712    H    LYS  30           H        LYS  30  -0.849  19.568 -11.226
  713    HA   LYS  30           HA       LYS  30  -0.507  16.712 -10.415
  714   1HB   LYS  30          1HB       LYS  30   0.228  19.353  -9.136
  715   2HB   LYS  30          2HB       LYS  30  -0.153  17.979  -8.113
  716   1HG   LYS  30          1HG       LYS  30   2.214  18.231  -8.389
  717   2HG   LYS  30          2HG       LYS  30   1.646  16.662  -8.922
  718   1HD   LYS  30          1HD       LYS  30   2.066  18.842 -10.986
  719   2HD   LYS  30          2HD       LYS  30   3.467  18.048 -10.257
  720   1HE   LYS  30          1HE       LYS  30   2.530  15.815 -10.875
  721   2HE   LYS  30          2HE       LYS  30   1.212  16.623 -11.723
  722   1HZ   LYS  30          1HZ       LYS  30   2.913  17.680 -13.158
  723   2HZ   LYS  30          2HZ       LYS  30   4.102  16.872 -12.381
  724   3HZ   LYS  30          3HZ       LYS  30   2.994  16.052 -13.254
  725    H    LYS  31           H        LYS  31  -2.611  19.540  -9.802
  726    HA   LYS  31           HA       LYS  31  -4.269  18.236  -7.930
  727   1HB   LYS  31          1HB       LYS  31  -4.097  20.807  -8.862
  728   2HB   LYS  31          2HB       LYS  31  -5.616  20.292  -9.596
  729   1HG   LYS  31          1HG       LYS  31  -6.387  19.516  -7.319
  730   2HG   LYS  31          2HG       LYS  31  -4.874  20.139  -6.637
  731   1HD   LYS  31          1HD       LYS  31  -5.463  22.413  -7.456
  732   2HD   LYS  31          2HD       LYS  31  -6.984  21.773  -8.113
  733   1HE   LYS  31          1HE       LYS  31  -7.640  21.010  -5.832
  734   2HE   LYS  31          2HE       LYS  31  -6.136  21.659  -5.178
  735   1HZ   LYS  31          1HZ       LYS  31  -6.877  23.885  -5.860
  736   2HZ   LYS  31          2HZ       LYS  31  -8.264  23.280  -6.482
  737   3HZ   LYS  31          3HZ       LYS  31  -7.987  23.208  -4.877
  738    H    SER  32           H        SER  32  -4.106  17.323 -11.125
  739    HA   SER  32           HA       SER  32  -6.688  15.842 -10.831
  740   1HB   SER  32          1HB       SER  32  -6.770  15.692 -13.279
  741   2HB   SER  32          2HB       SER  32  -6.738  17.378 -12.749
  742    HG   SER  32           HG       SER  32  -4.616  17.554 -13.359
  743    H    VAL  33           H        VAL  33  -3.621  15.339 -10.177
  744    HA   VAL  33           HA       VAL  33  -3.644  12.466 -11.047
  745    HB   VAL  33           HB       VAL  33  -1.260  14.227 -10.370
  746   1HG1  VAL  33          1HG1      VAL  33  -0.844  11.898  -9.671
  747   2HG1  VAL  33          2HG1      VAL  33  -1.396  11.307 -11.253
  748   3HG1  VAL  33          3HG1      VAL  33   0.087  12.276 -11.122
  749   1HG2  VAL  33          1HG2      VAL  33  -2.160  12.988 -13.012
  750   2HG2  VAL  33          2HG2      VAL  33  -2.193  14.717 -12.612
  751   3HG2  VAL  33          3HG2      VAL  33  -0.645  13.881 -12.743
  752    H    LEU  34           H        LEU  34  -2.759  14.666  -8.219
  753    HA   LEU  34           HA       LEU  34  -2.850  12.373  -6.424
  754   1HB   LEU  34          1HB       LEU  34  -2.127  13.664  -4.837
  755   2HB   LEU  34          2HB       LEU  34  -1.544  14.636  -6.174
  756    HG   LEU  34           HG       LEU  34  -4.153  15.075  -4.742
  757   1HD1  LEU  34          1HD1      LEU  34  -2.206  15.285  -3.178
  758   2HD1  LEU  34          2HD1      LEU  34  -1.518  16.525  -4.248
  759   3HD1  LEU  34          3HD1      LEU  34  -3.067  16.803  -3.419
  760   1HD2  LEU  34          1HD2      LEU  34  -2.551  16.986  -6.461
  761   2HD2  LEU  34          2HD2      LEU  34  -4.078  16.190  -6.913
  762   3HD2  LEU  34          3HD2      LEU  34  -4.057  17.373  -5.599
  763    H    GLN  35           H        GLN  35  -5.309  14.381  -7.870
  764    HA   GLN  35           HA       GLN  35  -7.328  13.992  -5.886
  765   1HB   GLN  35          1HB       GLN  35  -7.234  15.702  -7.684
  766   2HB   GLN  35          2HB       GLN  35  -7.658  14.479  -8.878
  767   1HG   GLN  35          1HG       GLN  35  -9.362  15.198  -6.441
  768   2HG   GLN  35          2HG       GLN  35  -9.501  16.031  -7.981
  769   1HE2  GLN  35          2HE2      GLN  35 -11.707  14.744  -6.788
  770   2HE2  GLN  35          1HE2      GLN  35 -12.138  13.359  -7.795
  771    H    LYS  36           H        LYS  36  -6.286  11.974  -8.621
  772    HA   LYS  36           HA       LYS  36  -8.449  10.070  -8.397
  773   1HB   LYS  36          1HB       LYS  36  -6.857  10.522 -10.383
  774   2HB   LYS  36          2HB       LYS  36  -5.646   9.569  -9.515
  775   1HG   LYS  36          1HG       LYS  36  -7.200   7.613  -9.552
  776   2HG   LYS  36          2HG       LYS  36  -8.413   8.610 -10.378
  777   1HD   LYS  36          1HD       LYS  36  -6.799   8.953 -12.278
  778   2HD   LYS  36          2HD       LYS  36  -5.630   7.935 -11.438
  779   1HE   LYS  36          1HE       LYS  36  -6.642   6.552 -13.070
  780   2HE   LYS  36          2HE       LYS  36  -7.295   6.039 -11.512
  781   1HZ   LYS  36          1HZ       LYS  36  -9.313   7.329 -12.023
  782   2HZ   LYS  36          2HZ       LYS  36  -8.683   7.826 -13.449
  783   3HZ   LYS  36          3HZ       LYS  36  -9.031   6.253 -13.215
  784    H    ILE  37           H        ILE  37  -5.235  10.233  -6.891
  785    HA   ILE  37           HA       ILE  37  -5.486   7.778  -5.337
  786    HB   ILE  37           HB       ILE  37  -4.021  10.371  -4.703
  787   1HG1  ILE  37          1HG1      ILE  37  -2.853   7.886  -5.916
  788   2HG1  ILE  37          2HG1      ILE  37  -3.177   9.428  -6.735
  789   1HG2  ILE  37          1HG2      ILE  37  -4.312   9.218  -2.625
  790   2HG2  ILE  37          2HG2      ILE  37  -4.003   7.643  -3.379
  791   3HG2  ILE  37          3HG2      ILE  37  -2.688   8.785  -3.129
  792   1HD1  ILE  37          1HD1      ILE  37  -1.569  10.534  -5.131
  793   2HD1  ILE  37          2HD1      ILE  37  -1.078   8.895  -4.622
  794   3HD1  ILE  37          3HD1      ILE  37  -0.859   9.400  -6.295
  795    H    LEU  38           H        LEU  38  -6.423  11.242  -4.606
  796    HA   LEU  38           HA       LEU  38  -7.437  10.593  -2.063
  797   1HB   LEU  38          1HB       LEU  38  -7.611  12.737  -1.814
  798   2HB   LEU  38          2HB       LEU  38  -7.004  12.889  -3.434
  799    HG   LEU  38           HG       LEU  38  -9.407  12.758  -4.198
  800   1HD1  LEU  38          1HD1      LEU  38 -10.594  12.097  -2.111
  801   2HD1  LEU  38          2HD1      LEU  38  -9.959  13.535  -1.296
  802   3HD1  LEU  38          3HD1      LEU  38 -11.119  13.688  -2.628
  803   1HD2  LEU  38          1HD2      LEU  38  -8.599  15.156  -2.473
  804   2HD2  LEU  38          2HD2      LEU  38  -8.004  14.875  -4.107
  805   3HD2  LEU  38          3HD2      LEU  38  -9.724  15.197  -3.848
  806    H    GLU  39           H        GLU  39  -9.211  10.412  -5.199
  807    HA   GLU  39           HA       GLU  39 -11.640   9.546  -3.894
  808   1HB   GLU  39          1HB       GLU  39 -10.583   9.172  -6.737
  809   2HB   GLU  39          2HB       GLU  39 -12.179   8.624  -6.204
  810   1HG   GLU  39          1HG       GLU  39 -12.759  10.953  -5.558
  811   2HG   GLU  39          2HG       GLU  39 -11.211  11.504  -6.197
  812    H    ASP  40           H        ASP  40  -8.832   7.679  -5.096
  813    HA   ASP  40           HA       ASP  40  -9.952   5.084  -4.662
  814   1HB   ASP  40          1HB       ASP  40  -7.219   6.371  -4.934
  815   2HB   ASP  40          2HB       ASP  40  -7.313   4.767  -4.389
  816    H    GLU  41           H        GLU  41  -8.334   7.419  -2.465
  817    HA   GLU  41           HA       GLU  41  -8.097   5.389  -0.334
  818   1HB   GLU  41          1HB       GLU  41  -7.821   8.410  -0.118
  819   2HB   GLU  41          2HB       GLU  41  -7.462   7.252   1.151
  820   1HG   GLU  41          1HG       GLU  41  -5.914   7.694  -1.415
  821   2HG   GLU  41          2HG       GLU  41  -5.412   8.054   0.216
  822    H    GLU  42           H        GLU  42 -10.343   8.064  -1.067
  823    HA   GLU  42           HA       GLU  42 -12.062   7.727   1.168
  824   1HB   GLU  42          1HB       GLU  42 -12.130   9.590  -0.486
  825   2HB   GLU  42          2HB       GLU  42 -12.815   8.484  -1.685
  826   1HG   GLU  42          1HG       GLU  42 -14.797   8.136  -0.259
  827   2HG   GLU  42          2HG       GLU  42 -14.078   9.124   1.016
  828    H    LYS  43           H        LYS  43 -11.848   5.835  -1.842
  829    HA   LYS  43           HA       LYS  43 -14.182   4.215  -1.366
  830   1HB   LYS  43          1HB       LYS  43 -12.502   4.560  -3.504
  831   2HB   LYS  43          2HB       LYS  43 -11.866   3.051  -2.879
  832   1HG   LYS  43          1HG       LYS  43 -13.488   2.461  -4.488
  833   2HG   LYS  43          2HG       LYS  43 -14.274   2.166  -2.928
  834   1HD   LYS  43          1HD       LYS  43 -15.488   4.337  -3.142
  835   2HD   LYS  43          2HD       LYS  43 -14.653   4.642  -4.680
  836   1HE   LYS  43          1HE       LYS  43 -15.661   2.569  -5.622
  837   2HE   LYS  43          2HE       LYS  43 -16.500   2.282  -4.092
  838   1HZ   LYS  43          1HZ       LYS  43 -17.692   4.385  -4.429
  839   2HZ   LYS  43          2HZ       LYS  43 -16.916   4.647  -5.844
  840   3HZ   LYS  43          3HZ       LYS  43 -17.945   3.391  -5.697
  841    H    HIS  44           H        HIS  44 -10.703   3.669  -0.409
  842    HA   HIS  44           HA       HIS  44 -11.035   1.086   0.621
  843   1HB   HIS  44          1HB       HIS  44  -9.195   3.395   1.420
  844   2HB   HIS  44          2HB       HIS  44  -9.002   1.718   1.799
  845    HD2  HIS  44           2HD      HIS  44 -10.017   1.183  -1.500
  846    HE1  HIS  44           1HE      HIS  44  -5.953   2.239  -2.117
  847    HE2  HIS  44           2HE      HIS  44  -8.056   1.276  -3.200
  848    H    ILE  45           H        ILE  45 -11.429   4.279   2.188
  849    HA   ILE  45           HA       ILE  45 -11.859   3.402   4.852
  850    HB   ILE  45           HB       ILE  45 -12.429   5.839   3.196
  851   1HG1  ILE  45          1HG1      ILE  45 -11.332   6.967   5.119
  852   2HG1  ILE  45          2HG1      ILE  45 -11.199   5.418   5.947
  853   1HG2  ILE  45          1HG2      ILE  45 -14.590   5.717   4.279
  854   2HG2  ILE  45          2HG2      ILE  45 -13.825   5.469   5.868
  855   3HG2  ILE  45          3HG2      ILE  45 -13.636   7.006   4.994
  856   1HD1  ILE  45          1HD1      ILE  45  -9.683   4.621   4.102
  857   2HD1  ILE  45          2HD1      ILE  45  -9.791   6.262   3.400
  858   3HD1  ILE  45          3HD1      ILE  45  -9.073   6.025   4.988
  859    H    GLU  46           H        GLU  46 -14.254   3.564   2.171
  860    HA   GLU  46           HA       GLU  46 -16.519   2.850   3.779
  861   1HB   GLU  46          1HB       GLU  46 -15.893   2.569   0.809
  862   2HB   GLU  46          2HB       GLU  46 -17.454   2.206   1.506
  863   1HG   GLU  46          1HG       GLU  46 -16.112   4.937   1.678
  864   2HG   GLU  46          2HG       GLU  46 -17.265   4.468   0.438
  865    H    TRP  47           H        TRP  47 -14.093   0.850   2.069
  866    HA   TRP  47           HA       TRP  47 -15.477  -1.656   2.543
  867   1HB   TRP  47          1HB       TRP  47 -12.567  -1.123   1.841
  868   2HB   TRP  47          2HB       TRP  47 -13.454  -2.606   1.618
  869    HD1  TRP  47           1HD      TRP  47 -15.914  -0.523   0.233
  870    HE1  TRP  47           1HE      TRP  47 -15.547   0.138  -2.223
  871    HE3  TRP  47           3HE      TRP  47 -11.057  -1.951  -0.258
  872    HZ2  TRP  47           2HZ      TRP  47 -13.390   0.027  -4.170
  873    HZ3  TRP  47           3HZ      TRP  47  -9.835  -1.679  -2.391
  874    HH2  TRP  47           2HH      TRP  47 -10.984  -0.622  -4.351
  875    H    LEU  48           H        LEU  48 -12.791   0.089   4.094
  876    HA   LEU  48           HA       LEU  48 -12.032  -1.732   6.114
  877   1HB   LEU  48          1HB       LEU  48 -11.946   1.196   5.562
  878   2HB   LEU  48          2HB       LEU  48 -12.123   0.895   7.244
  879    HG   LEU  48           HG       LEU  48  -9.886   1.189   6.794
  880   1HD1  LEU  48          1HD1      LEU  48 -10.432  -0.656   8.413
  881   2HD1  LEU  48          2HD1      LEU  48 -10.125  -1.832   7.116
  882   3HD1  LEU  48          3HD1      LEU  48  -8.826  -0.778   7.681
  883   1HD2  LEU  48          1HD2      LEU  48  -9.999  -1.020   4.713
  884   2HD2  LEU  48          2HD2      LEU  48  -9.779   0.723   4.420
  885   3HD2  LEU  48          3HD2      LEU  48  -8.535  -0.185   5.277
  886    H    GLU  49           H        GLU  49 -14.582   0.731   6.271
  887    HA   GLU  49           HA       GLU  49 -15.767   0.031   8.720
  888   1HB   GLU  49          1HB       GLU  49 -16.295   1.799   6.673
  889   2HB   GLU  49          2HB       GLU  49 -17.645   0.718   6.482
  890   1HG   GLU  49          1HG       GLU  49 -18.240   0.983   8.894
  891   2HG   GLU  49          2HG       GLU  49 -16.911   2.115   9.096
  892    H    THR  50           H        THR  50 -16.002  -1.751   5.715
  893    HA   THR  50           HA       THR  50 -18.374  -3.285   6.513
  894    HB   THR  50           HB       THR  50 -16.536  -3.412   4.083
  895    HG1  THR  50           1HG      THR  50 -17.771  -1.523   4.165
  896   1HG2  THR  50          1HG2      THR  50 -17.582  -5.540   4.345
  897   2HG2  THR  50          2HG2      THR  50 -19.165  -4.771   4.657
  898   3HG2  THR  50          3HG2      THR  50 -18.392  -4.644   3.047
  899    H    ILE  51           H        ILE  51 -14.903  -3.557   6.479
  900    HA   ILE  51           HA       ILE  51 -14.859  -6.305   7.470
  901    HB   ILE  51           HB       ILE  51 -12.690  -4.180   7.201
  902   1HG1  ILE  51          1HG1      ILE  51 -13.367  -4.881   5.016
  903   2HG1  ILE  51          2HG1      ILE  51 -11.831  -5.635   5.368
  904   1HG2  ILE  51          1HG2      ILE  51 -11.979  -5.659   8.979
  905   2HG2  ILE  51          2HG2      ILE  51 -12.400  -7.101   8.036
  906   3HG2  ILE  51          3HG2      ILE  51 -11.055  -6.051   7.533
  907   1HD1  ILE  51          1HD1      ILE  51 -13.123  -7.774   5.935
  908   2HD1  ILE  51          2HD1      ILE  51 -14.575  -6.959   5.317
  909   3HD1  ILE  51          3HD1      ILE  51 -13.199  -7.250   4.245
  910    H    ASN  52           H        ASN  52 -15.060  -3.211   8.851
  911    HA   ASN  52           HA       ASN  52 -14.579  -3.995  11.621
  912   1HB   ASN  52          1HB       ASN  52 -14.391  -1.635  10.665
  913   2HB   ASN  52          2HB       ASN  52 -16.153  -1.606  10.583
  914   1HD2  ASN  52          2HD2      ASN  52 -16.109   0.249  12.041
  915   2HD2  ASN  52          1HD2      ASN  52 -15.834  -0.026  13.753
  916    H    GLY  53           H        GLY  53 -16.262  -3.877  13.323
  917   1HA   GLY  53          1HA       GLY  53 -19.060  -4.214  12.899
  918   2HA   GLY  53          2HA       GLY  53 -18.329  -5.815  13.003
  Start of MODEL   13
    1   1H    MET   1          1H        MET   1   5.566  19.801   2.573
    2   2H    MET   1          2H        MET   1   6.712  18.771   3.127
    3   3H    MET   1          3H        MET   1   6.310  20.099   3.995
    4    HA   MET   1           HA       MET   1   7.157  21.579   2.318
    5   1HB   MET   1          1HB       MET   1   9.144  19.498   3.298
    6   2HB   MET   1          2HB       MET   1   9.612  20.937   2.380
    7   1HG   MET   1          1HG       MET   1   8.611  22.396   4.081
    8   2HG   MET   1          2HG       MET   1   8.140  20.985   5.037
    9   1HE   MET   1          1HE       MET   1   9.821  23.485   6.159
   10   2HE   MET   1          2HE       MET   1   9.297  22.096   7.140
   11   3HE   MET   1          3HE       MET   1  10.995  22.621   7.176
   12    H    ASP   2           H        ASP   2   8.955  18.662   1.275
   13    HA   ASP   2           HA       ASP   2   8.939  19.500  -1.445
   14   1HB   ASP   2          1HB       ASP   2   9.563  16.792  -0.194
   15   2HB   ASP   2          2HB       ASP   2   9.967  17.258  -1.842
   16    H    TYR   3           H        TYR   3   6.648  17.544   0.271
   17    HA   TYR   3           HA       TYR   3   5.058  16.071  -0.278
   18   1HB   TYR   3          1HB       TYR   3   4.468  18.310  -2.241
   19   2HB   TYR   3          2HB       TYR   3   3.361  16.982  -1.958
   20    HD1  TYR   3           1HD      TYR   3   2.500  19.696  -1.795
   21    HD2  TYR   3           2HD      TYR   3   4.070  17.098   1.284
   22    HE1  TYR   3           1HE      TYR   3   1.095  20.834  -0.092
   23    HE2  TYR   3           2HE      TYR   3   2.682  18.250   2.960
   24    HH   TYR   3           HH       TYR   3   1.143  19.919   3.365
   25    H    LEU   4           H        LEU   4   7.159  14.876  -1.197
   26    HA   LEU   4           HA       LEU   4   5.766  13.264  -3.175
   27   1HB   LEU   4          1HB       LEU   4   7.597  12.947  -4.752
   28   2HB   LEU   4          2HB       LEU   4   7.056  14.607  -4.668
   29    HG   LEU   4           HG       LEU   4   9.089  14.734  -2.864
   30   1HD1  LEU   4          1HD1      LEU   4   9.793  12.348  -3.295
   31   2HD1  LEU   4          2HD1      LEU   4  10.042  12.772  -4.987
   32   3HD1  LEU   4          3HD1      LEU   4  11.039  13.526  -3.730
   33   1HD2  LEU   4          1HD2      LEU   4   9.364  14.984  -5.887
   34   2HD2  LEU   4          2HD2      LEU   4   8.781  16.240  -4.773
   35   3HD2  LEU   4          3HD2      LEU   4  10.462  15.697  -4.682
   36    H    ARG   5           H        ARG   5   8.809  13.192  -1.165
   37    HA   ARG   5           HA       ARG   5   8.561  10.291  -0.825
   38   1HB   ARG   5          1HB       ARG   5  10.082  12.501   0.608
   39   2HB   ARG   5          2HB       ARG   5   9.886  10.928   1.385
   40   1HG   ARG   5          1HG       ARG   5  10.869   9.795  -0.576
   41   2HG   ARG   5          2HG       ARG   5  11.169  11.372  -1.342
   42   1HD   ARG   5          1HD       ARG   5  12.682  12.022   0.433
   43   2HD   ARG   5          2HD       ARG   5  12.192  10.639   1.430
   44    HE   ARG   5           HE       ARG   5  13.293   9.768  -1.096
   45   1HH1  ARG   5          1HH2      ARG   5  14.323  10.922   2.051
   46   2HH1  ARG   5          2HH2      ARG   5  15.809  10.015   1.999
   47   1HH2  ARG   5          1HH1      ARG   5  15.207   8.630  -1.090
   48   2HH2  ARG   5          2HH1      ARG   5  16.294   8.763   0.261
   49    H    GLU   6           H        GLU   6   7.407  13.063   0.995
   50    HA   GLU   6           HA       GLU   6   6.392  11.756   3.238
   51   1HB   GLU   6          1HB       GLU   6   6.806  14.197   2.831
   52   2HB   GLU   6          2HB       GLU   6   5.360  14.279   1.829
   53   1HG   GLU   6          1HG       GLU   6   3.937  13.908   3.694
   54   2HG   GLU   6          2HG       GLU   6   5.269  13.357   4.718
   55    H    LEU   7           H        LEU   7   4.650  12.518   0.191
   56    HA   LEU   7           HA       LEU   7   2.166  11.243   0.874
   57   1HB   LEU   7          1HB       LEU   7   3.428  12.272  -1.711
   58   2HB   LEU   7          2HB       LEU   7   1.857  11.487  -1.677
   59    HG   LEU   7           HG       LEU   7   1.071  13.158  -0.003
   60   1HD1  LEU   7          1HD1      LEU   7   3.026  14.140   0.924
   61   2HD1  LEU   7          2HD1      LEU   7   3.667  14.499  -0.701
   62   3HD1  LEU   7          3HD1      LEU   7   2.268  15.393  -0.055
   63   1HD2  LEU   7          1HD2      LEU   7   0.568  13.290  -2.453
   64   2HD2  LEU   7          2HD2      LEU   7   0.680  14.898  -1.724
   65   3HD2  LEU   7          3HD2      LEU   7   2.034  14.263  -2.686
   66    H    TYR   8           H        TYR   8   5.074   9.757   0.206
   67    HA   TYR   8           HA       TYR   8   3.890   7.366  -1.204
   68   1HB   TYR   8          1HB       TYR   8   5.927   8.961  -1.936
   69   2HB   TYR   8          2HB       TYR   8   6.839   8.153  -0.729
   70    HD1  TYR   8           1HD      TYR   8   5.471   5.274  -1.667
   71    HD2  TYR   8           2HD      TYR   8   7.703   8.508  -3.452
   72    HE1  TYR   8           1HE      TYR   8   6.516   3.692  -3.285
   73    HE2  TYR   8           2HE      TYR   8   8.692   6.925  -5.093
   74    HH   TYR   8           HH       TYR   8   8.855   4.727  -5.757
   75    H    LYS   9           H        LYS   9   6.083   8.380   1.407
   76    HA   LYS   9           HA       LYS   9   6.442   5.769   2.480
   77   1HB   LYS   9          1HB       LYS   9   6.845   8.598   3.581
   78   2HB   LYS   9          2HB       LYS   9   7.181   7.178   4.584
   79   1HG   LYS   9          1HG       LYS   9   8.747   6.311   2.850
   80   2HG   LYS   9          2HG       LYS   9   8.422   7.725   1.850
   81   1HD   LYS   9          1HD       LYS   9  10.513   8.023   2.938
   82   2HD   LYS   9          2HD       LYS   9   9.384   9.195   3.614
   83   1HE   LYS   9          1HE       LYS   9   9.593   6.567   5.056
   84   2HE   LYS   9          2HE       LYS   9  11.070   7.525   5.041
   85   1HZ   LYS   9          1HZ       LYS   9   9.871   9.368   6.033
   86   2HZ   LYS   9          2HZ       LYS   9   8.459   8.543   6.033
   87   3HZ   LYS   9          3HZ       LYS   9   9.700   8.048   6.970
   88    H    LEU  10           H        LEU  10   4.148   8.235   3.674
   89    HA   LEU  10           HA       LEU  10   2.999   6.427   5.529
   90   1HB   LEU  10          1HB       LEU  10   2.129   9.059   4.344
   91   2HB   LEU  10          2HB       LEU  10   1.022   8.154   5.378
   92    HG   LEU  10           HG       LEU  10   3.865   8.763   6.290
   93   1HD1  LEU  10          1HD1      LEU  10   2.891  10.900   5.803
   94   2HD1  LEU  10          2HD1      LEU  10   1.392  10.487   6.676
   95   3HD1  LEU  10          3HD1      LEU  10   2.930  10.679   7.552
   96   1HD2  LEU  10          1HD2      LEU  10   1.285   8.189   7.814
   97   2HD2  LEU  10          2HD2      LEU  10   2.621   7.044   7.581
   98   3HD2  LEU  10          3HD2      LEU  10   2.878   8.505   8.536
   99    H    GLU  11           H        GLU  11   2.301   7.069   2.127
  100    HA   GLU  11           HA       GLU  11   0.092   5.304   1.745
  101   1HB   GLU  11          1HB       GLU  11   2.132   6.776   0.220
  102   2HB   GLU  11          2HB       GLU  11   1.761   5.337  -0.615
  103   1HG   GLU  11          1HG       GLU  11  -0.297   7.375   0.403
  104   2HG   GLU  11          2HG       GLU  11   0.428   7.410  -1.197
  105    H    GLN  12           H        GLN  12   3.683   4.556   1.702
  106    HA   GLN  12           HA       GLN  12   3.110   1.784   1.280
  107   1HB   GLN  12          1HB       GLN  12   5.600   3.386   1.855
  108   2HB   GLN  12          2HB       GLN  12   5.618   1.612   1.807
  109   1HG   GLN  12          1HG       GLN  12   4.583   1.643  -0.425
  110   2HG   GLN  12          2HG       GLN  12   4.663   3.393  -0.453
  111   1HE2  GLN  12          2HE2      GLN  12   6.157   0.927  -1.902
  112   2HE2  GLN  12          1HE2      GLN  12   7.816   1.503  -1.885
  113    H    GLN  13           H        GLN  13   3.518   3.646   4.202
  114    HA   GLN  13           HA       GLN  13   3.975   1.337   5.909
  115   1HB   GLN  13          1HB       GLN  13   2.897   4.136   6.470
  116   2HB   GLN  13          2HB       GLN  13   2.969   2.888   7.720
  117   1HG   GLN  13          1HG       GLN  13   5.407   2.625   7.357
  118   2HG   GLN  13          2HG       GLN  13   5.373   3.914   6.159
  119   1HE2  GLN  13          2HE2      GLN  13   5.452   6.081   6.919
  120   2HE2  GLN  13          1HE2      GLN  13   5.429   6.472   8.636
  121    H    ALA  14           H        ALA  14   0.982   2.698   4.533
  122    HA   ALA  14           HA       ALA  14  -0.724   0.801   6.014
  123   1HB   ALA  14          1HB       ALA  14  -1.635   2.924   5.112
  124   2HB   ALA  14          2HB       ALA  14  -1.179   2.442   3.461
  125   3HB   ALA  14          3HB       ALA  14  -2.413   1.524   4.348
  126    H    MET  15           H        MET  15   0.800   0.899   2.734
  127    HA   MET  15           HA       MET  15  -0.101  -1.665   1.822
  128   1HB   MET  15          1HB       MET  15   2.594  -0.262   1.364
  129   2HB   MET  15          2HB       MET  15   2.160  -1.754   0.610
  130   1HG   MET  15          1HG       MET  15  -0.028  -0.121   0.048
  131   2HG   MET  15          2HG       MET  15   1.354   0.968  -0.083
  132   1HE   MET  15          1HE       MET  15   1.127  -2.985  -0.836
  133   2HE   MET  15          2HE       MET  15  -0.422  -2.207  -1.188
  134   3HE   MET  15          3HE       MET  15   0.555  -2.880  -2.513
  135    H    LYS  16           H        LYS  16   2.790  -0.971   3.867
  136    HA   LYS  16           HA       LYS  16   3.500  -3.776   3.871
  137   1HB   LYS  16          1HB       LYS  16   4.390  -1.334   5.429
  138   2HB   LYS  16          2HB       LYS  16   5.039  -2.958   5.762
  139   1HG   LYS  16          1HG       LYS  16   5.724  -3.195   3.383
  140   2HG   LYS  16          2HG       LYS  16   5.130  -1.562   3.037
  141   1HD   LYS  16          1HD       LYS  16   6.766  -0.618   4.617
  142   2HD   LYS  16          2HD       LYS  16   7.350  -2.264   4.998
  143   1HE   LYS  16          1HE       LYS  16   7.921  -2.611   2.611
  144   2HE   LYS  16          2HE       LYS  16   7.348  -0.985   2.226
  145   1HZ   LYS  16          1HZ       LYS  16   9.116  -0.096   3.669
  146   2HZ   LYS  16          2HZ       LYS  16   9.642  -1.603   4.023
  147   3HZ   LYS  16          3HZ       LYS  16   9.769  -1.031   2.502
  148    H    LEU  17           H        LEU  17   1.603  -1.728   6.013
  149    HA   LEU  17           HA       LEU  17   1.116  -3.743   8.021
  150   1HB   LEU  17          1HB       LEU  17  -0.001  -1.127   7.167
  151   2HB   LEU  17          2HB       LEU  17  -1.212  -2.166   7.788
  152    HG   LEU  17           HG       LEU  17   1.398  -1.472   9.223
  153   1HD1  LEU  17          1HD1      LEU  17   0.031  -0.042  10.623
  154   2HD1  LEU  17          2HD1      LEU  17  -0.175   0.421   8.925
  155   3HD1  LEU  17          3HD1      LEU  17  -1.443  -0.514   9.742
  156   1HD2  LEU  17          1HD2      LEU  17  -1.076  -2.939  10.262
  157   2HD2  LEU  17          2HD2      LEU  17   0.544  -3.635  10.065
  158   3HD2  LEU  17          3HD2      LEU  17   0.278  -2.370  11.261
  159    H    TYR  18           H        TYR  18  -0.607  -2.923   4.959
  160    HA   TYR  18           HA       TYR  18  -2.413  -5.058   4.954
  161   1HB   TYR  18          1HB       TYR  18  -1.224  -3.189   2.941
  162   2HB   TYR  18          2HB       TYR  18  -2.053  -4.563   2.316
  163    HD1  TYR  18           1HD      TYR  18  -4.360  -5.080   3.684
  164    HD2  TYR  18           2HD      TYR  18  -2.571  -1.230   3.014
  165    HE1  TYR  18           1HE      TYR  18  -6.535  -3.994   4.208
  166    HE2  TYR  18           2HE      TYR  18  -4.751  -0.127   3.526
  167    HH   TYR  18           HH       TYR  18  -6.874  -0.416   4.246
  168    H    ARG  19           H        ARG  19   0.949  -5.088   3.764
  169    HA   ARG  19           HA       ARG  19   1.009  -7.684   2.653
  170   1HB   ARG  19          1HB       ARG  19   2.692  -5.797   2.494
  171   2HB   ARG  19          2HB       ARG  19   3.316  -6.268   4.068
  172   1HG   ARG  19          1HG       ARG  19   3.147  -8.325   1.851
  173   2HG   ARG  19          2HG       ARG  19   4.383  -7.074   1.775
  174   1HD   ARG  19          1HD       ARG  19   5.287  -7.731   3.953
  175   2HD   ARG  19          2HD       ARG  19   4.089  -9.010   4.111
  176    HE   ARG  19           HE       ARG  19   6.483  -8.993   2.418
  177   1HH1  ARG  19          1HH2      ARG  19   3.416 -10.616   2.924
  178   2HH1  ARG  19          2HH2      ARG  19   3.897 -12.005   1.982
  179   1HH2  ARG  19          1HH1      ARG  19   7.027 -10.786   1.232
  180   2HH2  ARG  19          2HH1      ARG  19   5.896 -12.095   1.055
  181    H    GLU  20           H        GLU  20   1.101  -6.802   6.029
  182    HA   GLU  20           HA       GLU  20   1.669  -9.620   6.863
  183   1HB   GLU  20          1HB       GLU  20   2.750  -7.281   7.724
  184   2HB   GLU  20          2HB       GLU  20   1.349  -7.281   8.752
  185   1HG   GLU  20          1HG       GLU  20   3.050  -8.266  10.053
  186   2HG   GLU  20          2HG       GLU  20   2.001  -9.593   9.578
  187    H    ALA  21           H        ALA  21  -0.702  -7.060   7.206
  188    HA   ALA  21           HA       ALA  21  -2.717  -8.372   8.692
  189   1HB   ALA  21          1HB       ALA  21  -2.867  -6.023   7.914
  190   2HB   ALA  21          2HB       ALA  21  -3.063  -6.605   6.242
  191   3HB   ALA  21          3HB       ALA  21  -4.304  -6.955   7.444
  192    H    SER  22           H        SER  22  -1.788  -8.888   5.255
  193    HA   SER  22           HA       SER  22  -3.783 -10.751   4.561
  194   1HB   SER  22          1HB       SER  22  -2.092  -9.775   3.012
  195   2HB   SER  22          2HB       SER  22  -0.883 -10.880   3.700
  196    HG   SER  22           HG       SER  22  -2.656 -12.532   3.207
  197    H    GLU  23           H        GLU  23  -1.002 -11.315   6.744
  198    HA   GLU  23           HA       GLU  23  -1.227 -14.225   6.694
  199   1HB   GLU  23          1HB       GLU  23   0.772 -12.705   7.416
  200   2HB   GLU  23          2HB       GLU  23  -0.091 -12.540   8.932
  201   1HG   GLU  23          1HG       GLU  23   1.478 -14.268   9.271
  202   2HG   GLU  23          2HG       GLU  23  -0.085 -15.061   9.157
  203    H    LYS  24           H        LYS  24  -2.429 -11.625   8.769
  204    HA   LYS  24           HA       LYS  24  -4.011 -13.329  10.566
  205   1HB   LYS  24          1HB       LYS  24  -3.934 -10.344  10.009
  206   2HB   LYS  24          2HB       LYS  24  -5.034 -11.078  11.187
  207   1HG   LYS  24          1HG       LYS  24  -3.235 -11.914  12.530
  208   2HG   LYS  24          2HG       LYS  24  -2.020 -11.514  11.304
  209   1HD   LYS  24          1HD       LYS  24  -2.416  -9.137  11.587
  210   2HD   LYS  24          2HD       LYS  24  -3.728  -9.458  12.749
  211   1HE   LYS  24          1HE       LYS  24  -2.182 -10.465  14.329
  212   2HE   LYS  24          2HE       LYS  24  -0.860 -10.414  13.159
  213   1HZ   LYS  24          1HZ       LYS  24  -0.905  -7.993  13.273
  214   2HZ   LYS  24          2HZ       LYS  24  -2.167  -8.005  14.318
  215   3HZ   LYS  24          3HZ       LYS  24  -0.719  -8.599  14.774
  216    H    ALA  25           H        ALA  25  -4.701 -11.639   7.584
  217    HA   ALA  25           HA       ALA  25  -7.493 -12.497   7.472
  218   1HB   ALA  25          1HB       ALA  25  -6.774 -10.262   6.714
  219   2HB   ALA  25          2HB       ALA  25  -5.708 -11.009   5.502
  220   3HB   ALA  25          3HB       ALA  25  -7.455 -11.180   5.367
  221    H    ARG  26           H        ARG  26  -5.352 -14.661   7.465
  222    HA   ARG  26           HA       ARG  26  -4.880 -15.822   4.986
  223   1HB   ARG  26          1HB       ARG  26  -4.486 -17.862   6.242
  224   2HB   ARG  26          2HB       ARG  26  -3.901 -16.478   7.142
  225   1HG   ARG  26          1HG       ARG  26  -6.420 -16.661   8.231
  226   2HG   ARG  26          2HG       ARG  26  -6.185 -18.337   7.717
  227   1HD   ARG  26          1HD       ARG  26  -3.904 -18.145   8.953
  228   2HD   ARG  26          2HD       ARG  26  -4.562 -16.667   9.662
  229    HE   ARG  26           HE       ARG  26  -6.345 -18.981   9.900
  230   1HH1  ARG  26          1HH2      ARG  26  -3.701 -17.367  11.535
  231   2HH1  ARG  26          2HH2      ARG  26  -4.127 -18.051  13.081
  232   1HH2  ARG  26          1HH1      ARG  26  -6.826 -19.819  11.887
  233   2HH2  ARG  26          2HH1      ARG  26  -5.849 -19.410  13.266
  234    H    ASN  27           H        ASN  27  -7.969 -15.715   6.552
  235    HA   ASN  27           HA       ASN  27  -9.271 -17.923   5.234
  236   1HB   ASN  27          1HB       ASN  27 -10.064 -16.835   7.328
  237   2HB   ASN  27          2HB       ASN  27 -10.299 -15.319   6.457
  238   1HD2  ASN  27          2HD2      ASN  27 -12.547 -15.198   6.886
  239   2HD2  ASN  27          1HD2      ASN  27 -13.667 -16.356   6.186
  240    HA   PRO  28           HA       PRO  28  -8.936 -15.938   1.253
  241   1HB   PRO  28          1HB       PRO  28 -10.652 -17.458  -0.296
  242   2HB   PRO  28          2HB       PRO  28  -9.008 -17.946   0.210
  243   1HG   PRO  28          1HG       PRO  28 -11.647 -18.656   1.515
  244   2HG   PRO  28          2HG       PRO  28 -10.276 -19.742   1.117
  245   1HD   PRO  28          1HD       PRO  28 -10.619 -18.768   3.608
  246   2HD   PRO  28          2HD       PRO  28  -8.976 -18.894   2.913
  247    H    GLU  29           H        GLU  29 -12.007 -16.171   2.858
  248    HA   GLU  29           HA       GLU  29 -13.632 -14.459   1.259
  249   1HB   GLU  29          1HB       GLU  29 -14.055 -15.875   3.482
  250   2HB   GLU  29          2HB       GLU  29 -13.647 -14.378   4.284
  251   1HG   GLU  29          1HG       GLU  29 -16.009 -14.405   4.123
  252   2HG   GLU  29          2HG       GLU  29 -15.460 -13.215   2.953
  253    H    LYS  30           H        LYS  30 -11.135 -13.758   3.548
  254    HA   LYS  30           HA       LYS  30 -11.376 -10.807   3.248
  255   1HB   LYS  30          1HB       LYS  30 -11.129 -12.272   5.537
  256   2HB   LYS  30          2HB       LYS  30  -9.441 -12.149   5.131
  257   1HG   LYS  30          1HG       LYS  30  -9.525 -10.188   6.284
  258   2HG   LYS  30          2HG       LYS  30 -10.232  -9.500   4.823
  259   1HD   LYS  30          1HD       LYS  30 -11.691 -10.626   7.254
  260   2HD   LYS  30          2HD       LYS  30 -11.560  -8.922   6.814
  261   1HE   LYS  30          1HE       LYS  30 -12.970  -9.219   4.869
  262   2HE   LYS  30          2HE       LYS  30 -12.923 -10.979   5.021
  263   1HZ   LYS  30          1HZ       LYS  30 -14.152 -10.812   7.094
  264   2HZ   LYS  30          2HZ       LYS  30 -14.176  -9.183   7.027
  265   3HZ   LYS  30          3HZ       LYS  30 -14.993 -10.062   5.916
  266    H    LYS  31           H        LYS  31  -8.963 -13.417   2.834
  267    HA   LYS  31           HA       LYS  31  -6.890 -11.800   1.885
  268   1HB   LYS  31          1HB       LYS  31  -6.854 -14.315   2.416
  269   2HB   LYS  31          2HB       LYS  31  -7.416 -14.554   0.753
  270   1HG   LYS  31          1HG       LYS  31  -5.430 -13.433  -0.129
  271   2HG   LYS  31          2HG       LYS  31  -4.891 -13.021   1.512
  272   1HD   LYS  31          1HD       LYS  31  -4.549 -15.383   2.043
  273   2HD   LYS  31          2HD       LYS  31  -5.311 -15.869   0.523
  274   1HE   LYS  31          1HE       LYS  31  -2.965 -16.101   0.188
  275   2HE   LYS  31          2HE       LYS  31  -3.499 -14.708  -0.753
  276   1HZ   LYS  31          1HZ       LYS  31  -2.628 -13.271   1.060
  277   2HZ   LYS  31          2HZ       LYS  31  -2.113 -14.596   1.874
  278   3HZ   LYS  31          3HZ       LYS  31  -1.455 -14.215   0.435
  279    H    SER  32           H        SER  32  -9.704 -12.783   0.081
  280    HA   SER  32           HA       SER  32  -8.691 -11.434  -2.361
  281   1HB   SER  32          1HB       SER  32 -11.260 -12.989  -1.867
  282   2HB   SER  32          2HB       SER  32 -10.737 -12.336  -3.432
  283    HG   SER  32           HG       SER  32 -10.165 -14.554  -3.154
  284    H    VAL  33           H        VAL  33  -9.932 -10.158   0.300
  285    HA   VAL  33           HA       VAL  33 -11.472  -8.027  -1.166
  286    HB   VAL  33           HB       VAL  33 -11.657  -8.962   1.714
  287   1HG1  VAL  33          1HG1      VAL  33 -11.679  -6.519   1.844
  288   2HG1  VAL  33          2HG1      VAL  33 -12.837  -6.426   0.497
  289   3HG1  VAL  33          3HG1      VAL  33 -13.317  -7.132   2.056
  290   1HG2  VAL  33          1HG2      VAL  33 -13.747  -8.583  -0.482
  291   2HG2  VAL  33          2HG2      VAL  33 -13.035 -10.140  -0.013
  292   3HG2  VAL  33          3HG2      VAL  33 -14.027  -9.243   1.144
  293    H    LEU  34           H        LEU  34  -8.928  -8.501   1.458
  294    HA   LEU  34           HA       LEU  34  -8.190  -5.699   1.195
  295   1HB   LEU  34          1HB       LEU  34  -6.830  -6.004   2.890
  296   2HB   LEU  34          2HB       LEU  34  -7.901  -7.358   3.212
  297    HG   LEU  34           HG       LEU  34  -5.288  -7.448   1.752
  298   1HD1  LEU  34          1HD1      LEU  34  -5.137  -6.944   4.278
  299   2HD1  LEU  34          2HD1      LEU  34  -5.843  -8.528   4.560
  300   3HD1  LEU  34          3HD1      LEU  34  -4.264  -8.389   3.751
  301   1HD2  LEU  34          1HD2      LEU  34  -6.881  -9.774   2.854
  302   2HD2  LEU  34          2HD2      LEU  34  -6.710  -9.363   1.133
  303   3HD2  LEU  34          3HD2      LEU  34  -5.297  -9.886   2.053
  304    H    GLN  35           H        GLN  35  -7.574  -8.421  -0.841
  305    HA   GLN  35           HA       GLN  35  -5.108  -7.611  -1.946
  306   1HB   GLN  35          1HB       GLN  35  -6.576  -9.789  -2.292
  307   2HB   GLN  35          2HB       GLN  35  -7.207  -8.915  -3.682
  308   1HG   GLN  35          1HG       GLN  35  -4.797  -8.589  -4.437
  309   2HG   GLN  35          2HG       GLN  35  -4.285  -9.595  -3.081
  310   1HE2  GLN  35          2HE2      GLN  35  -4.875  -9.736  -6.359
  311   2HE2  GLN  35          1HE2      GLN  35  -5.290 -11.441  -6.467
  312    H    LYS  36           H        LYS  36  -8.419  -6.460  -2.664
  313    HA   LYS  36           HA       LYS  36  -7.672  -5.048  -5.102
  314   1HB   LYS  36          1HB       LYS  36 -10.057  -4.747  -3.200
  315   2HB   LYS  36          2HB       LYS  36  -9.864  -3.821  -4.696
  316   1HG   LYS  36          1HG       LYS  36  -9.794  -5.918  -6.012
  317   2HG   LYS  36          2HG       LYS  36 -10.042  -6.862  -4.530
  318   1HD   LYS  36          1HD       LYS  36 -12.222  -5.778  -4.167
  319   2HD   LYS  36          2HD       LYS  36 -11.968  -4.743  -5.589
  320   1HE   LYS  36          1HE       LYS  36 -11.851  -6.757  -7.037
  321   2HE   LYS  36          2HE       LYS  36 -12.116  -7.792  -5.627
  322   1HZ   LYS  36          1HZ       LYS  36 -14.296  -6.736  -5.345
  323   2HZ   LYS  36          2HZ       LYS  36 -14.044  -5.764  -6.636
  324   3HZ   LYS  36          3HZ       LYS  36 -14.184  -7.376  -6.842
  325    H    ILE  37           H        ILE  37  -7.861  -4.059  -1.703
  326    HA   ILE  37           HA       ILE  37  -6.989  -1.312  -2.161
  327    HB   ILE  37           HB       ILE  37  -6.727  -3.171   0.239
  328   1HG1  ILE  37          1HG1      ILE  37  -8.793  -1.055  -0.280
  329   2HG1  ILE  37          2HG1      ILE  37  -9.008  -2.815  -0.240
  330   1HG2  ILE  37          1HG2      ILE  37  -5.019  -1.445   0.455
  331   2HG2  ILE  37          2HG2      ILE  37  -6.156  -0.187  -0.073
  332   3HG2  ILE  37          3HG2      ILE  37  -6.333  -0.953   1.504
  333   1HD1  ILE  37          1HD1      ILE  37  -8.305  -2.774   2.185
  334   2HD1  ILE  37          2HD1      ILE  37  -8.460  -0.994   2.106
  335   3HD1  ILE  37          3HD1      ILE  37  -9.861  -2.017   1.811
  336    H    LEU  38           H        LEU  38  -5.147  -4.356  -1.339
  337    HA   LEU  38           HA       LEU  38  -2.566  -3.254  -1.483
  338   1HB   LEU  38          1HB       LEU  38  -3.713  -5.970  -2.112
  339   2HB   LEU  38          2HB       LEU  38  -2.039  -5.667  -2.498
  340    HG   LEU  38           HG       LEU  38  -3.152  -5.226   0.300
  341   1HD1  LEU  38          1HD1      LEU  38  -3.470  -7.584  -0.314
  342   2HD1  LEU  38          2HD1      LEU  38  -1.777  -7.691  -0.851
  343   3HD1  LEU  38          3HD1      LEU  38  -2.165  -7.419   0.865
  344   1HD2  LEU  38          1HD2      LEU  38  -0.347  -5.489  -0.893
  345   2HD2  LEU  38          2HD2      LEU  38  -1.038  -4.099  -0.019
  346   3HD2  LEU  38          3HD2      LEU  38  -0.668  -5.594   0.841
  347    H    GLU  39           H        GLU  39  -4.522  -4.444  -4.295
  348    HA   GLU  39           HA       GLU  39  -2.425  -3.799  -6.165
  349   1HB   GLU  39          1HB       GLU  39  -4.221  -5.502  -6.538
  350   2HB   GLU  39          2HB       GLU  39  -5.423  -4.208  -6.615
  351   1HG   GLU  39          1HG       GLU  39  -4.328  -3.289  -8.631
  352   2HG   GLU  39          2HG       GLU  39  -3.050  -4.501  -8.510
  353    H    ASP  40           H        ASP  40  -5.298  -1.944  -5.100
  354    HA   ASP  40           HA       ASP  40  -4.979   0.310  -6.809
  355   1HB   ASP  40          1HB       ASP  40  -6.194  -0.348  -4.105
  356   2HB   ASP  40          2HB       ASP  40  -6.091   1.275  -4.579
  357    H    GLU  41           H        GLU  41  -3.421  -0.580  -3.692
  358    HA   GLU  41           HA       GLU  41  -2.199   2.089  -3.466
  359   1HB   GLU  41          1HB       GLU  41  -1.509  -0.448  -1.960
  360   2HB   GLU  41          2HB       GLU  41  -0.868   1.165  -1.646
  361   1HG   GLU  41          1HG       GLU  41  -3.635   0.131  -0.985
  362   2HG   GLU  41          2HG       GLU  41  -2.379   0.636   0.096
  363    H    GLU  42           H        GLU  42  -1.086  -1.123  -4.575
  364    HA   GLU  42           HA       GLU  42   1.573  -0.314  -5.207
  365   1HB   GLU  42          1HB       GLU  42   0.700  -2.654  -5.154
  366   2HB   GLU  42          2HB       GLU  42  -0.131  -2.354  -6.689
  367   1HG   GLU  42          1HG       GLU  42   2.022  -1.942  -7.801
  368   2HG   GLU  42          2HG       GLU  42   2.874  -2.042  -6.256
  369    H    LYS  43           H        LYS  43  -1.461   0.143  -7.008
  370    HA   LYS  43           HA       LYS  43  -0.328   1.310  -9.374
  371   1HB   LYS  43          1HB       LYS  43  -2.893   0.627  -8.560
  372   2HB   LYS  43          2HB       LYS  43  -2.956   2.372  -8.423
  373   1HG   LYS  43          1HG       LYS  43  -3.700   1.896 -10.600
  374   2HG   LYS  43          2HG       LYS  43  -2.033   2.445 -10.833
  375   1HD   LYS  43          1HD       LYS  43  -1.288   0.061 -10.988
  376   2HD   LYS  43          2HD       LYS  43  -2.957  -0.468 -10.702
  377   1HE   LYS  43          1HE       LYS  43  -3.670   0.752 -12.765
  378   2HE   LYS  43          2HE       LYS  43  -1.986   1.206 -13.061
  379   1HZ   LYS  43          1HZ       LYS  43  -1.452  -1.174 -13.231
  380   2HZ   LYS  43          2HZ       LYS  43  -3.012  -1.585 -12.965
  381   3HZ   LYS  43          3HZ       LYS  43  -2.600  -0.778 -14.320
  382    H    HIS  44           H        HIS  44  -1.459   2.937  -6.289
  383    HA   HIS  44           HA       HIS  44  -0.809   5.547  -7.069
  384   1HB   HIS  44          1HB       HIS  44  -0.821   4.188  -4.335
  385   2HB   HIS  44          2HB       HIS  44  -0.900   5.885  -4.691
  386    HD2  HIS  44           2HD      HIS  44  -3.147   4.858  -7.188
  387    HE1  HIS  44           1HE      HIS  44  -5.702   4.882  -3.812
  388    HE2  HIS  44           2HE      HIS  44  -5.598   4.702  -6.335
  389    H    ILE  45           H        ILE  45   1.154   3.035  -5.431
  390    HA   ILE  45           HA       ILE  45   3.468   4.614  -4.957
  391    HB   ILE  45           HB       ILE  45   2.764   1.710  -5.035
  392   1HG1  ILE  45          1HG1      ILE  45   3.980   1.752  -2.846
  393   2HG1  ILE  45          2HG1      ILE  45   4.333   3.458  -3.102
  394   1HG2  ILE  45          1HG2      ILE  45   4.789   1.540  -6.345
  395   2HG2  ILE  45          2HG2      ILE  45   5.671   2.577  -5.199
  396   3HG2  ILE  45          3HG2      ILE  45   5.098   0.966  -4.712
  397   1HD1  ILE  45          1HD1      ILE  45   1.872   3.942  -3.018
  398   2HD1  ILE  45          2HD1      ILE  45   1.614   2.216  -2.638
  399   3HD1  ILE  45          3HD1      ILE  45   2.529   3.234  -1.535
  400    H    GLU  46           H        GLU  46   2.594   2.795  -7.954
  401    HA   GLU  46           HA       GLU  46   4.996   3.460  -9.377
  402   1HB   GLU  46          1HB       GLU  46   2.172   2.687 -10.150
  403   2HB   GLU  46          2HB       GLU  46   3.288   3.232 -11.382
  404   1HG   GLU  46          1HG       GLU  46   3.931   0.947  -9.485
  405   2HG   GLU  46          2HG       GLU  46   3.107   0.729 -11.027
  406    H    TRP  47           H        TRP  47   1.914   5.261  -9.024
  407    HA   TRP  47           HA       TRP  47   2.606   7.338 -10.889
  408   1HB   TRP  47          1HB       TRP  47   0.683   7.411  -8.542
  409   2HB   TRP  47          2HB       TRP  47   0.705   8.472  -9.925
  410    HD1  TRP  47           1HD      TRP  47   1.019   5.471 -11.748
  411    HE1  TRP  47           1HE      TRP  47  -1.225   4.337 -12.293
  412    HE3  TRP  47           3HE      TRP  47  -1.919   7.906  -8.400
  413    HZ2  TRP  47           2HZ      TRP  47  -3.982   4.491 -11.367
  414    HZ3  TRP  47           3HZ      TRP  47  -4.344   7.404  -8.188
  415    HH2  TRP  47           2HH      TRP  47  -5.388   5.683  -9.675
  416    H    LEU  48           H        LEU  48   2.931   6.976  -7.368
  417    HA   LEU  48           HA       LEU  48   4.023   9.492  -6.677
  418   1HB   LEU  48          1HB       LEU  48   3.860   6.740  -5.576
  419   2HB   LEU  48          2HB       LEU  48   5.356   7.495  -5.162
  420    HG   LEU  48           HG       LEU  48   3.885   7.805  -3.430
  421   1HD1  LEU  48          1HD1      LEU  48   5.316   9.796  -4.071
  422   2HD1  LEU  48          2HD1      LEU  48   3.865  10.533  -4.782
  423   3HD1  LEU  48          3HD1      LEU  48   3.916  10.166  -3.055
  424   1HD2  LEU  48          1HD2      LEU  48   1.882   9.067  -5.329
  425   2HD2  LEU  48          2HD2      LEU  48   1.729   7.512  -4.479
  426   3HD2  LEU  48          3HD2      LEU  48   1.746   9.017  -3.558
  427    H    GLU  49           H        GLU  49   5.721   6.509  -7.616
  428    HA   GLU  49           HA       GLU  49   8.327   7.610  -7.842
  429   1HB   GLU  49          1HB       GLU  49   7.198   5.118  -8.265
  430   2HB   GLU  49          2HB       GLU  49   7.654   5.558  -9.898
  431   1HG   GLU  49          1HG       GLU  49   9.479   5.524  -7.454
  432   2HG   GLU  49          2HG       GLU  49   9.403   4.273  -8.688
  433    H    THR  50           H        THR  50   5.736   7.564 -10.377
  434    HA   THR  50           HA       THR  50   7.259   8.876 -12.404
  435    HB   THR  50           HB       THR  50   4.346   8.449 -11.774
  436    HG1  THR  50           1HG      THR  50   5.963   7.750 -13.992
  437   1HG2  THR  50          1HG2      THR  50   4.196  10.581 -12.848
  438   2HG2  THR  50          2HG2      THR  50   5.317  10.064 -14.138
  439   3HG2  THR  50          3HG2      THR  50   3.705   9.313 -13.978
  440    H    ILE  51           H        ILE  51   5.966  10.152  -9.476
  441    HA   ILE  51           HA       ILE  51   6.219  12.960 -10.408
  442    HB   ILE  51           HB       ILE  51   4.788  11.592  -8.118
  443   1HG1  ILE  51          1HG1      ILE  51   3.632  11.610 -10.287
  444   2HG1  ILE  51          2HG1      ILE  51   2.775  12.528  -9.068
  445   1HG2  ILE  51          1HG2      ILE  51   5.635  13.515  -7.015
  446   2HG2  ILE  51          2HG2      ILE  51   5.194  14.578  -8.368
  447   3HG2  ILE  51          3HG2      ILE  51   3.932  13.800  -7.366
  448   1HD1  ILE  51          1HD1      ILE  51   3.549  14.648 -10.100
  449   2HD1  ILE  51          2HD1      ILE  51   4.458  13.726 -11.321
  450   3HD1  ILE  51          3HD1      ILE  51   2.702  13.623 -11.268
  451    H    ASN  52           H        ASN  52   8.090  10.730  -8.864
  452    HA   ASN  52           HA       ASN  52   9.697  12.552  -7.227
  453   1HB   ASN  52          1HB       ASN  52   9.540  10.029  -6.936
  454   2HB   ASN  52          2HB       ASN  52  10.478   9.861  -8.421
  455   1HD2  ASN  52          2HD2      ASN  52  11.830   8.610  -6.787
  456   2HD2  ASN  52          1HD2      ASN  52  13.022   9.544  -5.887
  457    H    GLY  53           H        GLY  53  11.824  13.330  -7.768
  458   1HA   GLY  53          1HA       GLY  53  13.035  13.331 -10.348
  459   2HA   GLY  53          2HA       GLY  53  11.961  14.727 -10.251
  460   1H    MET   1          1H        MET   1 -11.530  -6.757  15.931
  461   2H    MET   1          2H        MET   1 -11.887  -7.078  17.494
  462   3H    MET   1          3H        MET   1 -12.351  -5.659  16.808
  463    HA   MET   1           HA       MET   1 -10.096  -4.921  16.593
  464   1HB   MET   1          1HB       MET   1 -11.220  -4.387  18.686
  465   2HB   MET   1          2HB       MET   1 -10.728  -5.916  19.409
  466   1HG   MET   1          1HG       MET   1  -8.717  -3.853  18.425
  467   2HG   MET   1          2HG       MET   1  -9.450  -3.780  20.024
  468   1HE   MET   1          1HE       MET   1  -6.298  -3.754  19.662
  469   2HE   MET   1          2HE       MET   1  -7.124  -3.703  21.239
  470   3HE   MET   1          3HE       MET   1  -5.824  -4.878  20.953
  471    H    ASP   2           H        ASP   2  -8.298  -5.648  15.755
  472    HA   ASP   2           HA       ASP   2  -6.389  -7.038  17.177
  473   1HB   ASP   2          1HB       ASP   2  -7.938  -8.875  15.359
  474   2HB   ASP   2          2HB       ASP   2  -6.189  -8.981  15.269
  475    H    TYR   3           H        TYR   3  -7.497  -6.623  13.786
  476    HA   TYR   3           HA       TYR   3  -5.082  -5.115  13.066
  477   1HB   TYR   3          1HB       TYR   3  -4.228  -6.616  11.480
  478   2HB   TYR   3          2HB       TYR   3  -4.444  -7.549  12.937
  479    HD1  TYR   3           1HD      TYR   3  -4.854  -7.561   9.470
  480    HD2  TYR   3           2HD      TYR   3  -6.838  -8.884  13.055
  481    HE1  TYR   3           1HE      TYR   3  -6.154  -9.217   8.140
  482    HE2  TYR   3           2HE      TYR   3  -8.156 -10.515  11.730
  483    HH   TYR   3           HH       TYR   3  -8.606 -11.353   9.655
  484    H    LEU   4           H        LEU   4  -7.384  -3.929  13.189
  485    HA   LEU   4           HA       LEU   4  -8.218  -3.455  10.372
  486   1HB   LEU   4          1HB       LEU   4 -10.056  -4.588  10.940
  487   2HB   LEU   4          2HB       LEU   4  -9.685  -4.558  12.647
  488    HG   LEU   4           HG       LEU   4 -10.573  -2.241  12.785
  489   1HD1  LEU   4          1HD1      LEU   4 -10.535  -1.647  10.331
  490   2HD1  LEU   4          2HD1      LEU   4 -11.734  -2.913  10.027
  491   3HD1  LEU   4          3HD1      LEU   4 -12.159  -1.501  11.019
  492   1HD2  LEU   4          1HD2      LEU   4 -12.466  -4.426  11.867
  493   2HD2  LEU   4          2HD2      LEU   4 -11.785  -4.254  13.500
  494   3HD2  LEU   4          3HD2      LEU   4 -12.863  -3.004  12.893
  495    H    ARG   5           H        ARG   5  -8.440  -2.048  13.712
  496    HA   ARG   5           HA       ARG   5  -8.549   0.690  12.945
  497   1HB   ARG   5          1HB       ARG   5  -7.346  -0.706  15.384
  498   2HB   ARG   5          2HB       ARG   5  -7.434   1.041  15.249
  499   1HG   ARG   5          1HG       ARG   5  -9.892  -0.766  15.151
  500   2HG   ARG   5          2HG       ARG   5  -9.241  -0.015  16.614
  501   1HD   ARG   5          1HD       ARG   5  -9.452   2.229  15.460
  502   2HD   ARG   5          2HD       ARG   5 -10.373   1.418  14.179
  503    HE   ARG   5           HE       ARG   5 -11.750   0.602  16.346
  504   1HH1  ARG   5          1HH2      ARG   5 -10.714   3.857  15.553
  505   2HH1  ARG   5          2HH2      ARG   5 -11.964   4.586  16.524
  506   1HH2  ARG   5          1HH1      ARG   5 -13.307   1.600  17.572
  507   2HH2  ARG   5          2HH1      ARG   5 -13.395   3.336  17.623
  508    H    GLU   6           H        GLU   6  -5.731  -1.349  13.543
  509    HA   GLU   6           HA       GLU   6  -3.701   0.575  13.204
  510   1HB   GLU   6          1HB       GLU   6  -3.645  -1.906  14.061
  511   2HB   GLU   6          2HB       GLU   6  -3.471  -2.344  12.371
  512   1HG   GLU   6          1HG       GLU   6  -1.275  -2.266  13.257
  513   2HG   GLU   6          2HG       GLU   6  -1.426  -0.801  12.298
  514    H    LEU   7           H        LEU   7  -5.398  -1.364  10.775
  515    HA   LEU   7           HA       LEU   7  -3.776  -0.588   8.495
  516   1HB   LEU   7          1HB       LEU   7  -6.681  -1.537   8.460
  517   2HB   LEU   7          2HB       LEU   7  -5.509  -1.597   7.156
  518    HG   LEU   7           HG       LEU   7  -5.632  -3.277   9.668
  519   1HD1  LEU   7          1HD1      LEU   7  -7.098  -3.921   7.776
  520   2HD1  LEU   7          2HD1      LEU   7  -5.688  -3.969   6.693
  521   3HD1  LEU   7          3HD1      LEU   7  -5.826  -5.127   8.031
  522   1HD2  LEU   7          1HD2      LEU   7  -3.447  -3.344   7.568
  523   2HD2  LEU   7          2HD2      LEU   7  -3.260  -2.813   9.266
  524   3HD2  LEU   7          3HD2      LEU   7  -3.665  -4.495   8.915
  525    H    TYR   8           H        TYR   8  -7.030   0.320   9.569
  526    HA   TYR   8           HA       TYR   8  -7.722   2.297   7.696
  527   1HB   TYR   8          1HB       TYR   8  -8.778   1.027   9.955
  528   2HB   TYR   8          2HB       TYR   8  -8.560   2.608  10.593
  529    HD1  TYR   8           1HD      TYR   8 -11.054   0.793  10.120
  530    HD2  TYR   8           2HD      TYR   8  -9.431   4.231   8.079
  531    HE1  TYR   8           1HE      TYR   8 -13.346   1.465   9.433
  532    HE2  TYR   8           2HE      TYR   8 -11.733   4.907   7.415
  533    HH   TYR   8           HH       TYR   8 -13.970   4.428   7.529
  534    H    LYS   9           H        LYS   9  -6.062   2.784  10.863
  535    HA   LYS   9           HA       LYS   9  -6.080   5.625  10.602
  536   1HB   LYS   9          1HB       LYS   9  -5.817   4.424  12.742
  537   2HB   LYS   9          2HB       LYS   9  -4.227   3.838  12.267
  538   1HG   LYS   9          1HG       LYS   9  -4.735   6.826  12.293
  539   2HG   LYS   9          2HG       LYS   9  -4.599   5.975  13.831
  540   1HD   LYS   9          1HD       LYS   9  -2.357   5.161  13.273
  541   2HD   LYS   9          2HD       LYS   9  -2.458   5.869  11.664
  542   1HE   LYS   9          1HE       LYS   9  -1.116   7.317  12.999
  543   2HE   LYS   9          2HE       LYS   9  -2.640   8.140  12.650
  544   1HZ   LYS   9          1HZ       LYS   9  -3.385   7.574  14.901
  545   2HZ   LYS   9          2HZ       LYS   9  -1.998   6.761  15.210
  546   3HZ   LYS   9          3HZ       LYS   9  -1.970   8.375  14.985
  547    H    LEU  10           H        LEU  10  -3.438   3.400   9.697
  548    HA   LEU  10           HA       LEU  10  -1.875   5.544   8.681
  549   1HB   LEU  10          1HB       LEU  10  -1.713   2.549   8.535
  550   2HB   LEU  10          2HB       LEU  10  -0.679   3.510   7.474
  551    HG   LEU  10           HG       LEU  10  -0.806   4.098  10.460
  552   1HD1  LEU  10          1HD1      LEU  10  -0.170   1.803  10.347
  553   2HD1  LEU  10          2HD1      LEU  10   1.015   2.119   9.051
  554   3HD1  LEU  10          3HD1      LEU  10   1.274   2.755  10.694
  555   1HD2  LEU  10          1HD2      LEU  10   1.337   4.583   8.343
  556   2HD2  LEU  10          2HD2      LEU  10   0.252   5.818   9.014
  557   3HD2  LEU  10          3HD2      LEU  10   1.442   5.036  10.056
  558    H    GLU  11           H        GLU  11  -4.249   3.385   7.188
  559    HA   GLU  11           HA       GLU  11  -4.238   4.432   4.543
  560   1HB   GLU  11          1HB       GLU  11  -6.076   2.983   6.379
  561   2HB   GLU  11          2HB       GLU  11  -6.952   3.820   5.203
  562   1HG   GLU  11          1HG       GLU  11  -4.633   1.894   4.636
  563   2HG   GLU  11          2HG       GLU  11  -6.317   1.419   4.673
  564    H    GLN  12           H        GLN  12  -5.876   5.830   7.496
  565    HA   GLN  12           HA       GLN  12  -6.749   8.071   5.917
  566   1HB   GLN  12          1HB       GLN  12  -6.961   7.313   8.825
  567   2HB   GLN  12          2HB       GLN  12  -7.537   8.865   8.194
  568   1HG   GLN  12          1HG       GLN  12  -8.940   7.712   6.536
  569   2HG   GLN  12          2HG       GLN  12  -8.444   6.154   7.143
  570   1HE2  GLN  12          2HE2      GLN  12 -11.126   7.860   7.124
  571   2HE2  GLN  12          1HE2      GLN  12 -11.687   7.631   8.773
  572    H    GLN  13           H        GLN  13  -3.859   7.519   7.747
  573    HA   GLN  13           HA       GLN  13  -3.132  10.337   8.012
  574   1HB   GLN  13          1HB       GLN  13  -1.546   7.732   8.007
  575   2HB   GLN  13          2HB       GLN  13  -0.724   9.284   8.043
  576   1HG   GLN  13          1HG       GLN  13  -2.824   8.583  10.123
  577   2HG   GLN  13          2HG       GLN  13  -1.135   8.107  10.278
  578   1HE2  GLN  13          2HE2      GLN  13   0.217   9.580  11.328
  579   2HE2  GLN  13          1HE2      GLN  13  -0.173  11.283  11.499
  580    H    ALA  14           H        ALA  14  -2.724   7.964   5.367
  581    HA   ALA  14           HA       ALA  14  -1.308   9.865   3.641
  582   1HB   ALA  14          1HB       ALA  14  -1.289   7.405   3.250
  583   2HB   ALA  14          2HB       ALA  14  -3.052   7.419   3.014
  584   3HB   ALA  14          3HB       ALA  14  -1.992   8.273   1.875
  585    H    MET  15           H        MET  15  -4.751   9.006   4.221
  586    HA   MET  15           HA       MET  15  -5.826  10.747   2.237
  587   1HB   MET  15          1HB       MET  15  -7.038   8.906   3.478
  588   2HB   MET  15          2HB       MET  15  -7.124   9.949   4.892
  589   1HG   MET  15          1HG       MET  15  -8.839  11.149   4.110
  590   2HG   MET  15          2HG       MET  15  -8.151  11.298   2.493
  591   1HE   MET  15          1HE       MET  15  -7.626   8.843   1.325
  592   2HE   MET  15          2HE       MET  15  -9.110   8.129   0.668
  593   3HE   MET  15          3HE       MET  15  -8.779   9.860   0.447
  594    H    LYS  16           H        LYS  16  -5.155  11.460   5.701
  595    HA   LYS  16           HA       LYS  16  -6.041  14.191   5.697
  596   1HB   LYS  16          1HB       LYS  16  -3.958  12.580   7.232
  597   2HB   LYS  16          2HB       LYS  16  -4.157  14.292   7.554
  598   1HG   LYS  16          1HG       LYS  16  -6.690  12.672   7.602
  599   2HG   LYS  16          2HG       LYS  16  -5.511  12.298   8.852
  600   1HD   LYS  16          1HD       LYS  16  -7.118  13.954   9.650
  601   2HD   LYS  16          2HD       LYS  16  -5.472  14.598   9.630
  602   1HE   LYS  16          1HE       LYS  16  -5.978  15.759   7.466
  603   2HE   LYS  16          2HE       LYS  16  -7.637  15.146   7.547
  604   1HZ   LYS  16          1HZ       LYS  16  -7.911  16.387   9.633
  605   2HZ   LYS  16          2HZ       LYS  16  -6.374  16.934   9.565
  606   3HZ   LYS  16          3HZ       LYS  16  -7.456  17.410   8.444
  607    H    LEU  17           H        LEU  17  -2.871  12.763   4.956
  608    HA   LEU  17           HA       LEU  17  -1.511  15.164   4.252
  609   1HB   LEU  17          1HB       LEU  17  -1.188  12.251   3.929
  610   2HB   LEU  17          2HB       LEU  17  -0.580  13.071   2.536
  611    HG   LEU  17           HG       LEU  17   0.202  13.686   5.423
  612   1HD1  LEU  17          1HD1      LEU  17   0.869  11.427   4.635
  613   2HD1  LEU  17          2HD1      LEU  17   1.706  12.162   3.251
  614   3HD1  LEU  17          3HD1      LEU  17   2.255  12.490   4.913
  615   1HD2  LEU  17          1HD2      LEU  17   1.477  14.602   2.800
  616   2HD2  LEU  17          2HD2      LEU  17   0.568  15.642   3.914
  617   3HD2  LEU  17          3HD2      LEU  17   2.090  14.927   4.439
  618    H    TYR  18           H        TYR  18  -3.309  12.918   2.150
  619    HA   TYR  18           HA       TYR  18  -3.207  14.397  -0.242
  620   1HB   TYR  18          1HB       TYR  18  -4.925  12.196   0.923
  621   2HB   TYR  18          2HB       TYR  18  -5.402  12.876  -0.579
  622    HD1  TYR  18           1HD      TYR  18  -3.328  13.199  -2.323
  623    HD2  TYR  18           2HD      TYR  18  -3.656  10.160   0.697
  624    HE1  TYR  18           1HE      TYR  18  -1.533  11.884  -3.440
  625    HE2  TYR  18           2HE      TYR  18  -1.686   8.943  -0.276
  626    HH   TYR  18           HH       TYR  18  -0.204   8.887  -2.011
  627    H    ARG  19           H        ARG  19  -5.660  14.691   2.388
  628    HA   ARG  19           HA       ARG  19  -7.318  16.524   0.923
  629   1HB   ARG  19          1HB       ARG  19  -7.736  15.145   3.166
  630   2HB   ARG  19          2HB       ARG  19  -7.148  16.621   3.943
  631   1HG   ARG  19          1HG       ARG  19  -8.924  17.890   2.575
  632   2HG   ARG  19          2HG       ARG  19  -9.480  16.317   1.997
  633   1HD   ARG  19          1HD       ARG  19 -10.948  16.741   3.724
  634   2HD   ARG  19          2HD       ARG  19  -9.754  15.696   4.511
  635    HE   ARG  19           HE       ARG  19  -8.956  18.416   4.859
  636   1HH1  ARG  19          1HH2      ARG  19 -11.556  16.350   5.983
  637   2HH1  ARG  19          2HH2      ARG  19 -11.882  17.359   7.365
  638   1HH2  ARG  19          1HH1      ARG  19  -9.457  19.679   6.624
  639   2HH2  ARG  19          2HH1      ARG  19 -10.719  19.187   7.713
  640    H    GLU  20           H        GLU  20  -4.551  17.110   3.077
  641    HA   GLU  20           HA       GLU  20  -4.868  20.040   2.933
  642   1HB   GLU  20          1HB       GLU  20  -3.823  18.393   4.789
  643   2HB   GLU  20          2HB       GLU  20  -2.345  18.678   3.898
  644   1HG   GLU  20          1HG       GLU  20  -2.599  21.122   4.179
  645   2HG   GLU  20          2HG       GLU  20  -4.143  20.885   5.000
  646    H    ALA  21           H        ALA  21  -2.656  17.646   1.591
  647    HA   ALA  21           HA       ALA  21  -1.003  19.333   0.043
  648   1HB   ALA  21          1HB       ALA  21  -0.593  16.931   0.268
  649   2HB   ALA  21          2HB       ALA  21  -2.071  16.567  -0.656
  650   3HB   ALA  21          3HB       ALA  21  -0.700  17.377  -1.442
  651    H    SER  22           H        SER  22  -4.306  18.130  -0.758
  652    HA   SER  22           HA       SER  22  -4.556  19.307  -3.303
  653   1HB   SER  22          1HB       SER  22  -6.150  17.723  -2.194
  654   2HB   SER  22          2HB       SER  22  -6.754  19.078  -1.220
  655    HG   SER  22           HG       SER  22  -8.011  18.719  -3.109
  656    H    GLU  23           H        GLU  23  -4.900  20.991  -0.121
  657    HA   GLU  23           HA       GLU  23  -5.991  23.455  -1.256
  658   1HB   GLU  23          1HB       GLU  23  -6.024  22.609   1.189
  659   2HB   GLU  23          2HB       GLU  23  -4.353  23.112   1.279
  660   1HG   GLU  23          1HG       GLU  23  -5.619  24.872   2.218
  661   2HG   GLU  23          2HG       GLU  23  -5.041  25.455   0.666
  662    H    LYS  24           H        LYS  24  -2.685  22.435  -0.258
  663    HA   LYS  24           HA       LYS  24  -1.369  24.861  -1.155
  664   1HB   LYS  24          1HB       LYS  24  -0.449  23.144   0.500
  665   2HB   LYS  24          2HB       LYS  24  -0.048  22.147  -0.913
  666   1HG   LYS  24          1HG       LYS  24   1.290  24.102  -1.824
  667   2HG   LYS  24          2HG       LYS  24   0.925  24.989  -0.336
  668   1HD   LYS  24          1HD       LYS  24   2.105  23.218   0.970
  669   2HD   LYS  24          2HD       LYS  24   2.476  22.377  -0.558
  670   1HE   LYS  24          1HE       LYS  24   3.652  24.434  -1.370
  671   2HE   LYS  24          2HE       LYS  24   3.354  25.202   0.194
  672   1HZ   LYS  24          1HZ       LYS  24   4.684  23.442   1.232
  673   2HZ   LYS  24          2HZ       LYS  24   4.963  22.733  -0.220
  674   3HZ   LYS  24          3HZ       LYS  24   5.566  24.214   0.098
  675    H    ALA  25           H        ALA  25  -1.939  21.738  -2.731
  676    HA   ALA  25           HA       ALA  25  -0.690  22.558  -5.254
  677   1HB   ALA  25          1HB       ALA  25  -0.421  20.257  -4.280
  678   2HB   ALA  25          2HB       ALA  25  -2.168  19.987  -4.555
  679   3HB   ALA  25          3HB       ALA  25  -1.092  20.301  -5.915
  680    H    ARG  26           H        ARG  26  -2.819  24.254  -4.612
  681    HA   ARG  26           HA       ARG  26  -5.300  23.601  -5.817
  682   1HB   ARG  26          1HB       ARG  26  -5.809  25.927  -5.724
  683   2HB   ARG  26          2HB       ARG  26  -4.970  25.476  -4.266
  684   1HG   ARG  26          1HG       ARG  26  -3.255  26.578  -6.493
  685   2HG   ARG  26          2HG       ARG  26  -4.383  27.702  -5.749
  686   1HD   ARG  26          1HD       ARG  26  -3.396  27.540  -3.624
  687   2HD   ARG  26          2HD       ARG  26  -2.563  26.035  -4.016
  688    HE   ARG  26           HE       ARG  26  -1.610  28.050  -5.786
  689   1HH1  ARG  26          1HH2      ARG  26  -1.367  27.294  -2.381
  690   2HH1  ARG  26          2HH2      ARG  26   0.215  28.014  -2.235
  691   1HH2  ARG  26          1HH1      ARG  26   0.428  28.912  -5.547
  692   2HH2  ARG  26          2HH1      ARG  26   1.199  28.898  -3.989
  693    H    ASN  27           H        ASN  27  -2.341  24.177  -7.404
  694    HA   ASN  27           HA       ASN  27  -3.195  24.964 -10.016
  695   1HB   ASN  27          1HB       ASN  27  -0.871  25.075  -9.077
  696   2HB   ASN  27          2HB       ASN  27  -0.792  23.314  -9.095
  697   1HD2  ASN  27          2HD2      ASN  27   0.337  22.548 -10.861
  698   2HD2  ASN  27          1HD2      ASN  27   0.397  23.373 -12.410
  699    HA   PRO  28           HA       PRO  28  -5.489  21.343 -10.908
  700   1HB   PRO  28          1HB       PRO  28  -5.828  21.439 -13.641
  701   2HB   PRO  28          2HB       PRO  28  -6.639  22.522 -12.469
  702   1HG   PRO  28          1HG       PRO  28  -4.116  23.057 -14.060
  703   2HG   PRO  28          2HG       PRO  28  -5.544  24.122 -13.855
  704   1HD   PRO  28          1HD       PRO  28  -3.316  24.441 -12.360
  705   2HD   PRO  28          2HD       PRO  28  -4.936  24.651 -11.627
  706    H    GLU  29           H        GLU  29  -2.401  21.601 -12.578
  707    HA   GLU  29           HA       GLU  29  -2.173  19.097 -13.803
  708   1HB   GLU  29          1HB       GLU  29  -0.632  21.085 -13.854
  709   2HB   GLU  29          2HB       GLU  29   0.046  20.591 -12.333
  710   1HG   GLU  29          1HG       GLU  29  -0.033  18.657 -14.681
  711   2HG   GLU  29          2HG       GLU  29   1.149  19.957 -14.661
  712    H    LYS  30           H        LYS  30  -1.336  19.925 -10.522
  713    HA   LYS  30           HA       LYS  30  -0.923  17.144  -9.644
  714   1HB   LYS  30          1HB       LYS  30   0.304  19.256  -8.759
  715   2HB   LYS  30          2HB       LYS  30  -1.187  19.617  -7.918
  716   1HG   LYS  30          1HG       LYS  30   0.180  18.506  -6.296
  717   2HG   LYS  30          2HG       LYS  30  -0.970  17.283  -6.798
  718   1HD   LYS  30          1HD       LYS  30   1.173  16.243  -6.682
  719   2HD   LYS  30          2HD       LYS  30   0.849  16.427  -8.414
  720   1HE   LYS  30          1HE       LYS  30   2.220  18.522  -8.427
  721   2HE   LYS  30          2HE       LYS  30   2.503  18.343  -6.691
  722   1HZ   LYS  30          1HZ       LYS  30   3.663  16.250  -7.173
  723   2HZ   LYS  30          2HZ       LYS  30   3.417  16.454  -8.788
  724   3HZ   LYS  30          3HZ       LYS  30   4.366  17.494  -7.964
  725    H    LYS  31           H        LYS  31  -3.475  19.603  -9.213
  726    HA   LYS  31           HA       LYS  31  -5.095  18.066  -7.488
  727   1HB   LYS  31          1HB       LYS  31  -5.241  20.557  -8.091
  728   2HB   LYS  31          2HB       LYS  31  -6.280  20.037  -9.434
  729   1HG   LYS  31          1HG       LYS  31  -7.884  19.064  -7.902
  730   2HG   LYS  31          2HG       LYS  31  -6.776  19.254  -6.529
  731   1HD   LYS  31          1HD       LYS  31  -6.931  21.706  -6.712
  732   2HD   LYS  31          2HD       LYS  31  -8.023  21.544  -8.110
  733   1HE   LYS  31          1HE       LYS  31  -9.644  20.304  -6.707
  734   2HE   LYS  31          2HE       LYS  31  -8.550  20.410  -5.321
  735   1HZ   LYS  31          1HZ       LYS  31  -8.804  22.823  -5.370
  736   2HZ   LYS  31          2HZ       LYS  31  -9.785  22.751  -6.678
  737   3HZ   LYS  31          3HZ       LYS  31 -10.274  22.129  -5.252
  738    H    SER  32           H        SER  32  -4.674  17.547 -10.872
  739    HA   SER  32           HA       SER  32  -6.813  15.461 -10.832
  740   1HB   SER  32          1HB       SER  32  -5.234  16.653 -13.143
  741   2HB   SER  32          2HB       SER  32  -6.475  15.399 -13.303
  742    HG   SER  32           HG       SER  32  -8.020  16.838 -12.521
  743    H    VAL  33           H        VAL  33  -3.796  15.416  -9.813
  744    HA   VAL  33           HA       VAL  33  -3.249  12.628 -10.790
  745    HB   VAL  33           HB       VAL  33  -1.333  14.852 -10.053
  746   1HG1  VAL  33          1HG1      VAL  33  -0.427  12.870  -8.946
  747   2HG1  VAL  33          2HG1      VAL  33  -0.687  11.893 -10.412
  748   3HG1  VAL  33          3HG1      VAL  33   0.503  13.211 -10.400
  749   1HG2  VAL  33          1HG2      VAL  33  -1.546  13.032 -12.499
  750   2HG2  VAL  33          2HG2      VAL  33  -2.155  14.696 -12.422
  751   3HG2  VAL  33          3HG2      VAL  33  -0.420  14.392 -12.281
  752    H    LEU  34           H        LEU  34  -3.244  14.776  -7.830
  753    HA   LEU  34           HA       LEU  34  -3.130  12.344  -6.198
  754   1HB   LEU  34          1HB       LEU  34  -2.603  13.639  -4.512
  755   2HB   LEU  34          2HB       LEU  34  -2.113  14.759  -5.762
  756    HG   LEU  34           HG       LEU  34  -4.765  14.727  -4.361
  757   1HD1  LEU  34          1HD1      LEU  34  -3.986  16.653  -3.044
  758   2HD1  LEU  34          2HD1      LEU  34  -2.862  15.312  -2.816
  759   3HD1  LEU  34          3HD1      LEU  34  -2.428  16.642  -3.901
  760   1HD2  LEU  34          1HD2      LEU  34  -3.560  16.970  -6.008
  761   2HD2  LEU  34          2HD2      LEU  34  -4.892  15.913  -6.535
  762   3HD2  LEU  34          3HD2      LEU  34  -5.124  17.010  -5.171
  763    H    GLN  35           H        GLN  35  -5.699  14.132  -7.733
  764    HA   GLN  35           HA       GLN  35  -7.733  13.215  -5.895
  765   1HB   GLN  35          1HB       GLN  35  -7.976  15.241  -7.159
  766   2HB   GLN  35          2HB       GLN  35  -7.994  14.339  -8.693
  767   1HG   GLN  35          1HG       GLN  35 -10.118  13.304  -8.097
  768   2HG   GLN  35          2HG       GLN  35 -10.020  13.934  -6.447
  769   1HE2  GLN  35          2HE2      GLN  35 -10.355  14.979  -9.894
  770   2HE2  GLN  35          1HE2      GLN  35 -11.173  16.478  -9.480
  771    H    LYS  36           H        LYS  36  -6.384  11.862  -8.911
  772    HA   LYS  36           HA       LYS  36  -8.341   9.729  -9.102
  773   1HB   LYS  36          1HB       LYS  36  -6.732   8.668 -10.664
  774   2HB   LYS  36          2HB       LYS  36  -7.081  10.349 -11.074
  775   1HG   LYS  36          1HG       LYS  36  -4.965  11.063 -10.027
  776   2HG   LYS  36          2HG       LYS  36  -4.565   9.389  -9.631
  777   1HD   LYS  36          1HD       LYS  36  -4.911  10.557 -12.425
  778   2HD   LYS  36          2HD       LYS  36  -3.370  10.245 -11.612
  779   1HE   LYS  36          1HE       LYS  36  -3.909   7.817 -11.507
  780   2HE   LYS  36          2HE       LYS  36  -5.428   8.123 -12.363
  781   1HZ   LYS  36          1HZ       LYS  36  -4.113   8.969 -14.244
  782   2HZ   LYS  36          2HZ       LYS  36  -2.715   8.649 -13.458
  783   3HZ   LYS  36          3HZ       LYS  36  -3.699   7.427 -13.906
  784    H    ILE  37           H        ILE  37  -5.402  10.036  -7.188
  785    HA   ILE  37           HA       ILE  37  -5.658   7.306  -6.022
  786    HB   ILE  37           HB       ILE  37  -4.316   9.904  -5.149
  787   1HG1  ILE  37          1HG1      ILE  37  -3.135   7.329  -6.166
  788   2HG1  ILE  37          2HG1      ILE  37  -3.245   8.886  -7.005
  789   1HG2  ILE  37          1HG2      ILE  37  -4.979   8.758  -3.090
  790   2HG2  ILE  37          2HG2      ILE  37  -4.328   7.224  -3.704
  791   3HG2  ILE  37          3HG2      ILE  37  -3.252   8.570  -3.293
  792   1HD1  ILE  37          1HD1      ILE  37  -1.746   9.879  -5.250
  793   2HD1  ILE  37          2HD1      ILE  37  -1.478   8.221  -4.642
  794   3HD1  ILE  37          3HD1      ILE  37  -1.000   8.647  -6.286
  795    H    LEU  38           H        LEU  38  -6.693  10.649  -4.849
  796    HA   LEU  38           HA       LEU  38  -8.099   9.726  -2.662
  797   1HB   LEU  38          1HB       LEU  38  -8.698  12.035  -4.503
  798   2HB   LEU  38          2HB       LEU  38  -9.722  11.705  -3.137
  799    HG   LEU  38           HG       LEU  38  -6.726  12.180  -2.838
  800   1HD1  LEU  38          1HD1      LEU  38  -7.835  14.193  -3.737
  801   2HD1  LEU  38          2HD1      LEU  38  -9.057  14.105  -2.448
  802   3HD1  LEU  38          3HD1      LEU  38  -7.352  14.427  -2.055
  803   1HD2  LEU  38          1HD2      LEU  38  -9.073  11.895  -0.916
  804   2HD2  LEU  38          2HD2      LEU  38  -7.514  11.026  -0.923
  805   3HD2  LEU  38          3HD2      LEU  38  -7.593  12.725  -0.441
  806    H    GLU  39           H        GLU  39  -9.494   9.624  -6.008
  807    HA   GLU  39           HA       GLU  39 -12.042   8.670  -5.025
  808   1HB   GLU  39          1HB       GLU  39 -10.714   8.591  -7.770
  809   2HB   GLU  39          2HB       GLU  39 -12.353   8.004  -7.468
  810   1HG   GLU  39          1HG       GLU  39 -13.017  10.241  -6.624
  811   2HG   GLU  39          2HG       GLU  39 -11.405  10.859  -6.974
  812    H    ASP  40           H        ASP  40  -9.108   6.938  -5.844
  813    HA   ASP  40           HA       ASP  40 -10.244   4.216  -5.625
  814   1HB   ASP  40          1HB       ASP  40  -7.570   5.639  -5.979
  815   2HB   ASP  40          2HB       ASP  40  -7.487   4.157  -5.209
  816    H    GLU  41           H        GLU  41  -8.713   6.647  -3.614
  817    HA   GLU  41           HA       GLU  41  -7.954   4.801  -1.513
  818   1HB   GLU  41          1HB       GLU  41  -6.776   6.859  -2.534
  819   2HB   GLU  41          2HB       GLU  41  -7.807   7.854  -1.515
  820   1HG   GLU  41          1HG       GLU  41  -5.431   7.567  -0.870
  821   2HG   GLU  41          2HG       GLU  41  -6.519   7.036   0.415
  822    H    GLU  42           H        GLU  42 -10.446   7.311  -1.909
  823    HA   GLU  42           HA       GLU  42 -11.788   6.993   0.615
  824   1HB   GLU  42          1HB       GLU  42 -12.086   8.850  -0.959
  825   2HB   GLU  42          2HB       GLU  42 -12.804   7.791  -2.155
  826   1HG   GLU  42          1HG       GLU  42 -13.981   8.122   0.639
  827   2HG   GLU  42          2HG       GLU  42 -14.273   9.317  -0.616
  828    H    LYS  43           H        LYS  43 -11.823   5.099  -2.388
  829    HA   LYS  43           HA       LYS  43 -14.111   3.480  -1.786
  830   1HB   LYS  43          1HB       LYS  43 -12.477   3.788  -3.982
  831   2HB   LYS  43          2HB       LYS  43 -11.868   2.274  -3.388
  832   1HG   LYS  43          1HG       LYS  43 -13.530   1.513  -4.773
  833   2HG   LYS  43          2HG       LYS  43 -14.487   1.649  -3.298
  834   1HD   LYS  43          1HD       LYS  43 -14.315   3.648  -5.600
  835   2HD   LYS  43          2HD       LYS  43 -15.686   2.595  -5.226
  836   1HE   LYS  43          1HE       LYS  43 -16.061   3.790  -3.099
  837   2HE   LYS  43          2HE       LYS  43 -14.631   4.789  -3.392
  838   1HZ   LYS  43          1HZ       LYS  43 -15.734   5.684  -5.363
  839   2HZ   LYS  43          2HZ       LYS  43 -17.096   4.828  -5.033
  840   3HZ   LYS  43          3HZ       LYS  43 -16.567   5.991  -3.999
  841    H    HIS  44           H        HIS  44 -10.628   3.004  -0.882
  842    HA   HIS  44           HA       HIS  44 -10.965   0.518   0.383
  843   1HB   HIS  44          1HB       HIS  44  -9.118   2.865   1.025
  844   2HB   HIS  44          2HB       HIS  44  -8.925   1.191   1.446
  845    HD2  HIS  44           2HD      HIS  44  -9.925   0.539  -1.830
  846    HE1  HIS  44           1HE      HIS  44  -5.912   1.740  -2.503
  847    HE2  HIS  44           2HE      HIS  44  -7.985   0.677  -3.546
  848    H    ILE  45           H        ILE  45 -11.371   3.868   1.595
  849    HA   ILE  45           HA       ILE  45 -11.793   3.111   4.359
  850    HB   ILE  45           HB       ILE  45 -12.058   5.605   2.696
  851   1HG1  ILE  45          1HG1      ILE  45 -10.768   6.539   4.669
  852   2HG1  ILE  45          2HG1      ILE  45 -10.746   4.922   5.366
  853   1HG2  ILE  45          1HG2      ILE  45 -14.170   5.715   3.882
  854   2HG2  ILE  45          2HG2      ILE  45 -13.360   5.342   5.426
  855   3HG2  ILE  45          3HG2      ILE  45 -13.036   6.870   4.572
  856   1HD1  ILE  45          1HD1      ILE  45  -9.402   4.124   3.425
  857   2HD1  ILE  45          2HD1      ILE  45  -9.459   5.778   2.752
  858   3HD1  ILE  45          3HD1      ILE  45  -8.630   5.468   4.282
  859    H    GLU  46           H        GLU  46 -14.087   3.585   1.617
  860    HA   GLU  46           HA       GLU  46 -16.486   3.050   3.051
  861   1HB   GLU  46          1HB       GLU  46 -15.551   2.757   0.208
  862   2HB   GLU  46          2HB       GLU  46 -16.996   1.875   0.659
  863   1HG   GLU  46          1HG       GLU  46 -16.651   4.850   1.135
  864   2HG   GLU  46          2HG       GLU  46 -17.333   4.161  -0.345
  865    H    TRP  47           H        TRP  47 -14.195   0.708   1.575
  866    HA   TRP  47           HA       TRP  47 -15.753  -1.581   2.343
  867   1HB   TRP  47          1HB       TRP  47 -12.797  -1.410   1.663
  868   2HB   TRP  47          2HB       TRP  47 -13.822  -2.818   1.579
  869    HD1  TRP  47           1HD      TRP  47 -16.111  -0.877  -0.160
  870    HE1  TRP  47           1HE      TRP  47 -15.619  -0.561  -2.662
  871    HE3  TRP  47           3HE      TRP  47 -11.206  -2.284  -0.193
  872    HZ2  TRP  47           2HZ      TRP  47 -13.365  -0.944  -4.466
  873    HZ3  TRP  47           3HZ      TRP  47  -9.879  -2.304  -2.293
  874    HH2  TRP  47           2HH      TRP  47 -10.957  -1.612  -4.441
  875    H    LEU  48           H        LEU  48 -12.910   0.035   3.765
  876    HA   LEU  48           HA       LEU  48 -12.349  -1.699   5.920
  877   1HB   LEU  48          1HB       LEU  48 -12.033   1.239   5.319
  878   2HB   LEU  48          2HB       LEU  48 -11.659   0.725   6.925
  879    HG   LEU  48           HG       LEU  48 -10.433  -0.596   4.491
  880   1HD1  LEU  48          1HD1      LEU  48  -9.825   1.787   4.494
  881   2HD1  LEU  48          2HD1      LEU  48  -9.334   1.680   6.196
  882   3HD1  LEU  48          3HD1      LEU  48  -8.437   0.792   4.941
  883   1HD2  LEU  48          1HD2      LEU  48  -9.605  -0.514   7.437
  884   2HD2  LEU  48          2HD2      LEU  48 -10.279  -1.921   6.587
  885   3HD2  LEU  48          3HD2      LEU  48  -8.692  -1.301   6.135
  886    H    GLU  49           H        GLU  49 -14.661   1.006   5.795
  887    HA   GLU  49           HA       GLU  49 -15.665   0.613   8.480
  888   1HB   GLU  49          1HB       GLU  49 -16.021   2.533   6.578
  889   2HB   GLU  49          2HB       GLU  49 -17.498   1.642   6.309
  890   1HG   GLU  49          1HG       GLU  49 -18.055   1.827   8.747
  891   2HG   GLU  49          2HG       GLU  49 -16.589   2.769   8.999
  892    H    THR  50           H        THR  50 -16.403  -0.902   5.454
  893    HA   THR  50           HA       THR  50 -18.862  -2.244   6.362
  894    HB   THR  50           HB       THR  50 -17.198  -2.182   3.876
  895    HG1  THR  50           1HG      THR  50 -19.171  -1.663   3.035
  896   1HG2  THR  50          1HG2      THR  50 -17.488  -4.574   4.049
  897   2HG2  THR  50          2HG2      THR  50 -19.226  -4.367   4.406
  898   3HG2  THR  50          3HG2      THR  50 -18.562  -3.915   2.811
  899    H    ILE  51           H        ILE  51 -15.471  -2.972   6.324
  900    HA   ILE  51           HA       ILE  51 -15.865  -5.718   7.308
  901    HB   ILE  51           HB       ILE  51 -13.442  -4.100   6.463
  902   1HG1  ILE  51          1HG1      ILE  51 -14.874  -4.804   4.586
  903   2HG1  ILE  51          2HG1      ILE  51 -13.307  -5.578   4.542
  904   1HG2  ILE  51          1HG2      ILE  51 -12.537  -5.571   8.094
  905   2HG2  ILE  51          2HG2      ILE  51 -13.461  -6.957   7.475
  906   3HG2  ILE  51          3HG2      ILE  51 -12.138  -6.244   6.515
  907   1HD1  ILE  51          1HD1      ILE  51 -14.330  -7.681   5.384
  908   2HD1  ILE  51          2HD1      ILE  51 -15.922  -6.880   5.428
  909   3HD1  ILE  51          3HD1      ILE  51 -15.085  -7.114   3.887
  910    H    ASN  52           H        ASN  52 -15.508  -2.717   8.717
  911    HA   ASN  52           HA       ASN  52 -14.159  -3.034  11.074
  912   1HB   ASN  52          1HB       ASN  52 -15.207  -0.953  10.308
  913   2HB   ASN  52          2HB       ASN  52 -16.808  -1.626  10.637
  914   1HD2  ASN  52          2HD2      ASN  52 -17.636  -0.622  12.431
  915   2HD2  ASN  52          1HD2      ASN  52 -16.702  -0.292  13.884
  916    H    GLY  53           H        GLY  53 -14.234  -4.299  12.819
  917   1HA   GLY  53          1HA       GLY  53 -16.375  -5.047  14.434
  918   2HA   GLY  53          2HA       GLY  53 -16.200  -6.360  13.264
  Start of MODEL   14
    1   1H    MET   1          1H        MET   1  10.465  16.535   2.829
    2   2H    MET   1          2H        MET   1  11.522  16.795   1.605
    3   3H    MET   1          3H        MET   1  12.002  16.977   3.157
    4    HA   MET   1           HA       MET   1  10.575  18.804   3.526
    5   1HB   MET   1          1HB       MET   1  11.690  20.515   2.385
    6   2HB   MET   1          2HB       MET   1  12.860  19.246   2.695
    7   1HG   MET   1          1HG       MET   1  12.561  18.512   0.266
    8   2HG   MET   1          2HG       MET   1  11.539  19.938   0.052
    9   1HE   MET   1          1HE       MET   1  15.107  19.183   1.768
   10   2HE   MET   1          2HE       MET   1  15.090  18.486   0.129
   11   3HE   MET   1          3HE       MET   1  16.132  19.878   0.494
   12    H    ASP   2           H        ASP   2  10.222  17.854   0.025
   13    HA   ASP   2           HA       ASP   2   7.810  19.468  -0.214
   14   1HB   ASP   2          1HB       ASP   2   9.130  17.463  -2.079
   15   2HB   ASP   2          2HB       ASP   2   7.747  18.469  -2.503
   16    H    TYR   3           H        TYR   3   6.018  18.247  -1.543
   17    HA   TYR   3           HA       TYR   3   4.619  16.729   0.559
   18   1HB   TYR   3          1HB       TYR   3   2.625  17.737  -0.533
   19   2HB   TYR   3          2HB       TYR   3   3.792  18.916   0.015
   20    HD1  TYR   3           1HD      TYR   3   5.249  20.163  -1.620
   21    HD2  TYR   3           2HD      TYR   3   2.042  17.568  -2.899
   22    HE1  TYR   3           1HE      TYR   3   5.348  21.154  -3.901
   23    HE2  TYR   3           2HE      TYR   3   2.119  18.595  -5.160
   24    HH   TYR   3           HH       TYR   3   3.059  20.218  -6.485
   25    H    LEU   4           H        LEU   4   6.307  15.177  -1.136
   26    HA   LEU   4           HA       LEU   4   4.256  13.343  -2.230
   27   1HB   LEU   4          1HB       LEU   4   5.466  12.891  -4.252
   28   2HB   LEU   4          2HB       LEU   4   5.086  14.593  -4.120
   29    HG   LEU   4           HG       LEU   4   7.630  14.464  -2.978
   30   1HD1  LEU   4          1HD1      LEU   4   7.909  12.117  -3.776
   31   2HD1  LEU   4          2HD1      LEU   4   7.572  12.653  -5.425
   32   3HD1  LEU   4          3HD1      LEU   4   9.029  13.228  -4.577
   33   1HD2  LEU   4          1HD2      LEU   4   7.007  15.053  -5.888
   34   2HD2  LEU   4          2HD2      LEU   4   6.830  16.194  -4.534
   35   3HD2  LEU   4          3HD2      LEU   4   8.432  15.580  -4.974
   36    H    ARG   5           H        ARG   5   7.837  13.306  -1.493
   37    HA   ARG   5           HA       ARG   5   7.798  10.499  -0.891
   38   1HB   ARG   5          1HB       ARG   5   9.833  11.717  -1.431
   39   2HB   ARG   5          2HB       ARG   5   9.715  12.665   0.057
   40   1HG   ARG   5          1HG       ARG   5  10.145  10.767   1.436
   41   2HG   ARG   5          2HG       ARG   5   9.848   9.617   0.127
   42   1HD   ARG   5          1HD       ARG   5  12.135  11.625   0.049
   43   2HD   ARG   5          2HD       ARG   5  12.281  10.030   0.808
   44    HE   ARG   5           HE       ARG   5  11.243   9.599  -1.780
   45   1HH1  ARG   5          1HH2      ARG   5  14.269  10.743  -0.435
   46   2HH1  ARG   5          2HH2      ARG   5  15.204  10.091  -1.752
   47   1HH2  ARG   5          1HH1      ARG   5  12.500   8.746  -3.398
   48   2HH2  ARG   5          2HH1      ARG   5  14.222   8.989  -3.380
   49    H    GLU   6           H        GLU   6   7.063  13.292   1.096
   50    HA   GLU   6           HA       GLU   6   6.676  12.039   3.618
   51   1HB   GLU   6          1HB       GLU   6   6.601  14.553   2.909
   52   2HB   GLU   6          2HB       GLU   6   4.941  14.246   2.427
   53   1HG   GLU   6          1HG       GLU   6   4.856  15.169   4.613
   54   2HG   GLU   6          2HG       GLU   6   4.484  13.464   4.812
   55    H    LEU   7           H        LEU   7   4.520  12.183   0.793
   56    HA   LEU   7           HA       LEU   7   2.269  10.903   2.160
   57   1HB   LEU   7          1HB       LEU   7   2.697  11.155  -0.841
   58   2HB   LEU   7          2HB       LEU   7   1.190  10.883   0.019
   59    HG   LEU   7           HG       LEU   7   2.850  13.434  -0.020
   60   1HD1  LEU   7          1HD1      LEU   7   1.490  12.940  -2.047
   61   2HD1  LEU   7          2HD1      LEU   7   0.041  12.835  -1.021
   62   3HD1  LEU   7          3HD1      LEU   7   0.914  14.369  -1.178
   63   1HD2  LEU   7          1HD2      LEU   7   0.246  12.878   1.455
   64   2HD2  LEU   7          2HD2      LEU   7   1.830  13.211   2.202
   65   3HD2  LEU   7          3HD2      LEU   7   1.024  14.469   1.266
   66    H    TYR   8           H        TYR   8   4.671   9.886  -0.247
   67    HA   TYR   8           HA       TYR   8   4.108   7.192  -0.723
   68   1HB   TYR   8          1HB       TYR   8   6.088   9.045  -1.284
   69   2HB   TYR   8          2HB       TYR   8   6.966   8.082  -0.165
   70    HD1  TYR   8           1HD      TYR   8   5.733   5.298  -1.238
   71    HD2  TYR   8           2HD      TYR   8   7.636   8.733  -3.033
   72    HE1  TYR   8           1HE      TYR   8   6.739   3.846  -2.981
   73    HE2  TYR   8           2HE      TYR   8   8.554   7.277  -4.831
   74    HH   TYR   8           HH       TYR   8   8.005   3.736  -4.875
   75    H    LYS   9           H        LYS   9   5.844   8.552   2.067
   76    HA   LYS   9           HA       LYS   9   6.484   5.989   3.188
   77   1HB   LYS   9          1HB       LYS   9   6.446   8.859   4.243
   78   2HB   LYS   9          2HB       LYS   9   6.822   7.542   5.344
   79   1HG   LYS   9          1HG       LYS   9   8.355   8.113   2.768
   80   2HG   LYS   9          2HG       LYS   9   8.817   8.682   4.373
   81   1HD   LYS   9          1HD       LYS   9   9.020   6.296   5.139
   82   2HD   LYS   9          2HD       LYS   9   8.597   5.761   3.512
   83   1HE   LYS   9          1HE       LYS   9  10.939   5.607   3.620
   84   2HE   LYS   9          2HE       LYS   9  10.585   7.012   2.612
   85   1HZ   LYS   9          1HZ       LYS   9  11.061   8.424   4.559
   86   2HZ   LYS   9          2HZ       LYS   9  11.358   7.110   5.487
   87   3HZ   LYS   9          3HZ       LYS   9  12.343   7.467   4.239
   88    H    LEU  10           H        LEU  10   3.911   8.172   4.421
   89    HA   LEU  10           HA       LEU  10   2.702   6.175   5.941
   90   1HB   LEU  10          1HB       LEU  10   1.486   8.633   4.618
   91   2HB   LEU  10          2HB       LEU  10   0.632   7.567   5.732
   92    HG   LEU  10           HG       LEU  10   2.842   7.989   7.225
   93   1HD1  LEU  10          1HD1      LEU  10   4.010   9.514   5.809
   94   2HD1  LEU  10          2HD1      LEU  10   2.573  10.538   5.621
   95   3HD1  LEU  10          3HD1      LEU  10   3.401  10.417   7.189
   96   1HD2  LEU  10          1HD2      LEU  10   0.449   9.874   7.051
   97   2HD2  LEU  10          2HD2      LEU  10   0.521   8.354   7.966
   98   3HD2  LEU  10          3HD2      LEU  10   1.538   9.716   8.450
   99    H    GLU  11           H        GLU  11   2.301   6.856   2.480
  100    HA   GLU  11           HA       GLU  11   0.308   4.930   1.839
  101   1HB   GLU  11          1HB       GLU  11   2.508   6.408   0.478
  102   2HB   GLU  11          2HB       GLU  11   1.983   5.071  -0.405
  103   1HG   GLU  11          1HG       GLU  11   0.173   7.310   0.653
  104   2HG   GLU  11          2HG       GLU  11   0.858   7.246  -0.965
  105    H    GLN  12           H        GLN  12   3.958   4.410   2.122
  106    HA   GLN  12           HA       GLN  12   3.568   1.590   1.634
  107   1HB   GLN  12          1HB       GLN  12   5.899   3.306   2.493
  108   2HB   GLN  12          2HB       GLN  12   6.008   1.544   2.336
  109   1HG   GLN  12          1HG       GLN  12   5.284   1.638   0.011
  110   2HG   GLN  12          2HG       GLN  12   5.092   3.377   0.087
  111   1HE2  GLN  12          2HE2      GLN  12   7.138   4.642   0.746
  112   2HE2  GLN  12          1HE2      GLN  12   8.662   4.034   0.101
  113    H    GLN  13           H        GLN  13   3.600   3.490   4.549
  114    HA   GLN  13           HA       GLN  13   3.871   1.235   6.376
  115   1HB   GLN  13          1HB       GLN  13   2.531   3.979   6.645
  116   2HB   GLN  13          2HB       GLN  13   2.592   2.835   7.974
  117   1HG   GLN  13          1HG       GLN  13   5.137   3.801   6.611
  118   2HG   GLN  13          2HG       GLN  13   4.359   4.703   7.908
  119   1HE2  GLN  13          2HE2      GLN  13   4.454   3.890  10.081
  120   2HE2  GLN  13          1HE2      GLN  13   5.459   2.506  10.481
  121    H    ALA  14           H        ALA  14   1.049   2.621   4.675
  122    HA   ALA  14           HA       ALA  14  -0.839   0.750   5.893
  123   1HB   ALA  14          1HB       ALA  14  -1.571   2.866   4.817
  124   2HB   ALA  14          2HB       ALA  14  -0.934   2.307   3.255
  125   3HB   ALA  14          3HB       ALA  14  -2.290   1.453   4.021
  126    H    MET  15           H        MET  15   1.186   0.768   2.897
  127    HA   MET  15           HA       MET  15   0.255  -1.761   1.895
  128   1HB   MET  15          1HB       MET  15   3.020  -0.501   1.586
  129   2HB   MET  15          2HB       MET  15   2.467  -1.922   0.741
  130   1HG   MET  15          1HG       MET  15   0.425  -0.022   0.294
  131   2HG   MET  15          2HG       MET  15   1.926   0.886   0.170
  132   1HE   MET  15          1HE       MET  15   1.347  -2.995  -0.888
  133   2HE   MET  15          2HE       MET  15  -0.170  -2.089  -1.015
  134   3HE   MET  15          3HE       MET  15   0.641  -2.672  -2.486
  135    H    LYS  16           H        LYS  16   2.974  -1.179   4.260
  136    HA   LYS  16           HA       LYS  16   3.504  -4.039   4.435
  137   1HB   LYS  16          1HB       LYS  16   4.354  -1.629   6.063
  138   2HB   LYS  16          2HB       LYS  16   4.776  -3.294   6.528
  139   1HG   LYS  16          1HG       LYS  16   5.798  -3.688   4.297
  140   2HG   LYS  16          2HG       LYS  16   5.378  -2.040   3.807
  141   1HD   LYS  16          1HD       LYS  16   7.658  -2.082   4.401
  142   2HD   LYS  16          2HD       LYS  16   6.768  -1.164   5.646
  143   1HE   LYS  16          1HE       LYS  16   6.831  -3.158   7.138
  144   2HE   LYS  16          2HE       LYS  16   7.687  -4.070   5.889
  145   1HZ   LYS  16          1HZ       LYS  16   9.529  -2.478   6.094
  146   2HZ   LYS  16          2HZ       LYS  16   8.734  -1.646   7.255
  147   3HZ   LYS  16          3HZ       LYS  16   9.225  -3.175   7.535
  148    H    LEU  17           H        LEU  17   1.449  -1.819   6.287
  149    HA   LEU  17           HA       LEU  17   0.601  -3.753   8.229
  150   1HB   LEU  17          1HB       LEU  17  -0.313  -1.142   7.126
  151   2HB   LEU  17          2HB       LEU  17  -1.615  -2.127   7.647
  152    HG   LEU  17           HG       LEU  17   0.816  -1.426   9.354
  153   1HD1  LEU  17          1HD1      LEU  17  -0.560   0.540   8.844
  154   2HD1  LEU  17          2HD1      LEU  17  -2.024  -0.320   9.370
  155   3HD1  LEU  17          3HD1      LEU  17  -0.744   0.061  10.543
  156   1HD2  LEU  17          1HD2      LEU  17  -1.842  -2.692  10.169
  157   2HD2  LEU  17          2HD2      LEU  17  -0.292  -3.548  10.104
  158   3HD2  LEU  17          3HD2      LEU  17  -0.501  -2.238  11.250
  159    H    TYR  18           H        TYR  18  -0.526  -3.066   4.935
  160    HA   TYR  18           HA       TYR  18  -2.504  -5.088   4.802
  161   1HB   TYR  18          1HB       TYR  18  -1.069  -3.270   2.910
  162   2HB   TYR  18          2HB       TYR  18  -1.850  -4.616   2.189
  163    HD1  TYR  18           1HD      TYR  18  -4.337  -5.083   3.280
  164    HD2  TYR  18           2HD      TYR  18  -2.346  -1.288   2.970
  165    HE1  TYR  18           1HE      TYR  18  -6.478  -3.918   3.832
  166    HE2  TYR  18           2HE      TYR  18  -4.454  -0.121   3.584
  167    HH   TYR  18           HH       TYR  18  -6.613  -0.379   4.310
  168    H    ARG  19           H        ARG  19   1.005  -5.373   4.143
  169    HA   ARG  19           HA       ARG  19   0.938  -8.099   3.186
  170   1HB   ARG  19          1HB       ARG  19   3.084  -6.679   4.826
  171   2HB   ARG  19          2HB       ARG  19   3.275  -8.247   4.055
  172   1HG   ARG  19          1HG       ARG  19   3.024  -7.253   1.827
  173   2HG   ARG  19          2HG       ARG  19   2.728  -5.665   2.549
  174   1HD   ARG  19          1HD       ARG  19   4.984  -5.863   3.701
  175   2HD   ARG  19          2HD       ARG  19   5.282  -7.306   2.714
  176    HE   ARG  19           HE       ARG  19   4.530  -5.232   0.948
  177   1HH1  ARG  19          1HH2      ARG  19   7.250  -5.914   3.051
  178   2HH1  ARG  19          2HH2      ARG  19   8.329  -4.900   2.132
  179   1HH2  ARG  19          1HH1      ARG  19   5.969  -3.966  -0.184
  180   2HH2  ARG  19          2HH1      ARG  19   7.616  -3.832   0.354
  181    H    GLU  20           H        GLU  20   1.248  -6.844   6.517
  182    HA   GLU  20           HA       GLU  20   1.355  -9.500   7.724
  183   1HB   GLU  20          1HB       GLU  20   2.057  -6.954   8.451
  184   2HB   GLU  20          2HB       GLU  20   0.550  -7.074   9.320
  185   1HG   GLU  20          1HG       GLU  20   2.830  -9.099   9.533
  186   2HG   GLU  20          2HG       GLU  20   2.678  -7.690  10.576
  187    H    ALA  21           H        ALA  21  -1.199  -7.074   7.384
  188    HA   ALA  21           HA       ALA  21  -3.322  -8.538   8.581
  189   1HB   ALA  21          1HB       ALA  21  -3.546  -6.215   7.947
  190   2HB   ALA  21          2HB       ALA  21  -3.367  -6.621   6.220
  191   3HB   ALA  21          3HB       ALA  21  -4.785  -7.187   7.124
  192    H    SER  22           H        SER  22  -1.947  -8.850   5.246
  193    HA   SER  22           HA       SER  22  -3.842 -10.765   4.318
  194   1HB   SER  22          1HB       SER  22  -2.105  -9.549   2.937
  195   2HB   SER  22          2HB       SER  22  -0.897 -10.672   3.585
  196    HG   SER  22           HG       SER  22  -3.151 -11.235   1.947
  197    H    GLU  23           H        GLU  23  -0.969 -11.220   6.432
  198    HA   GLU  23           HA       GLU  23  -1.095 -14.121   6.369
  199   1HB   GLU  23          1HB       GLU  23   0.838 -12.517   7.104
  200   2HB   GLU  23          2HB       GLU  23   0.037 -12.533   8.673
  201   1HG   GLU  23          1HG       GLU  23   0.155 -15.008   8.728
  202   2HG   GLU  23          2HG       GLU  23   0.916 -15.019   7.137
  203    H    LYS  24           H        LYS  24  -2.353 -11.653   8.618
  204    HA   LYS  24           HA       LYS  24  -3.774 -13.441  10.403
  205   1HB   LYS  24          1HB       LYS  24  -3.901 -10.501   9.742
  206   2HB   LYS  24          2HB       LYS  24  -5.286 -11.216  10.547
  207   1HG   LYS  24          1HG       LYS  24  -3.751 -10.221  12.146
  208   2HG   LYS  24          2HG       LYS  24  -3.970 -11.950  12.423
  209   1HD   LYS  24          1HD       LYS  24  -1.794 -12.437  11.389
  210   2HD   LYS  24          2HD       LYS  24  -1.557 -10.729  10.999
  211   1HE   LYS  24          1HE       LYS  24  -1.937 -11.788  13.840
  212   2HE   LYS  24          2HE       LYS  24  -0.357 -11.646  13.060
  213   1HZ   LYS  24          1HZ       LYS  24  -0.815  -9.680  14.367
  214   2HZ   LYS  24          2HZ       LYS  24  -0.724  -9.287  12.781
  215   3HZ   LYS  24          3HZ       LYS  24  -2.185  -9.357  13.531
  216    H    ALA  25           H        ALA  25  -4.858 -11.776   7.480
  217    HA   ALA  25           HA       ALA  25  -7.519 -12.941   7.533
  218   1HB   ALA  25          1HB       ALA  25  -7.886 -11.427   5.653
  219   2HB   ALA  25          2HB       ALA  25  -6.987 -10.565   6.915
  220   3HB   ALA  25          3HB       ALA  25  -6.148 -11.166   5.467
  221    H    ARG  26           H        ARG  26  -5.105 -14.782   6.954
  222    HA   ARG  26           HA       ARG  26  -4.881 -15.514   4.316
  223   1HB   ARG  26          1HB       ARG  26  -3.937 -17.555   4.992
  224   2HB   ARG  26          2HB       ARG  26  -3.483 -16.357   6.181
  225   1HG   ARG  26          1HG       ARG  26  -5.671 -18.468   6.540
  226   2HG   ARG  26          2HG       ARG  26  -4.013 -18.589   7.120
  227   1HD   ARG  26          1HD       ARG  26  -4.374 -16.564   8.522
  228   2HD   ARG  26          2HD       ARG  26  -6.087 -16.574   8.062
  229    HE   ARG  26           HE       ARG  26  -5.938 -19.044   8.994
  230   1HH1  ARG  26          1HH2      ARG  26  -4.501 -16.214  10.461
  231   2HH1  ARG  26          2HH2      ARG  26  -4.504 -16.922  12.057
  232   1HH2  ARG  26          1HH1      ARG  26  -5.964 -19.871  11.052
  233   2HH2  ARG  26          2HH1      ARG  26  -5.345 -18.932  12.378
  234    H    ASN  27           H        ASN  27  -7.751 -16.118   6.105
  235    HA   ASN  27           HA       ASN  27  -8.912 -18.230   4.572
  236   1HB   ASN  27          1HB       ASN  27  -9.721 -17.395   6.769
  237   2HB   ASN  27          2HB       ASN  27 -10.194 -15.867   6.025
  238   1HD2  ASN  27          2HD2      ASN  27 -11.437 -18.782   7.059
  239   2HD2  ASN  27          1HD2      ASN  27 -12.838 -18.831   5.999
  240    HA   PRO  28           HA       PRO  28  -9.056 -16.135   0.695
  241   1HB   PRO  28          1HB       PRO  28 -10.903 -17.598  -0.730
  242   2HB   PRO  28          2HB       PRO  28  -9.249 -18.153  -0.330
  243   1HG   PRO  28          1HG       PRO  28 -11.826 -18.763   1.145
  244   2HG   PRO  28          2HG       PRO  28 -10.540 -19.907   0.637
  245   1HD   PRO  28          1HD       PRO  28 -10.658 -18.933   3.161
  246   2HD   PRO  28          2HD       PRO  28  -9.079 -19.154   2.343
  247    H    GLU  29           H        GLU  29 -12.018 -16.319   2.565
  248    HA   GLU  29           HA       GLU  29 -13.738 -14.691   0.989
  249   1HB   GLU  29          1HB       GLU  29 -14.061 -16.120   3.196
  250   2HB   GLU  29          2HB       GLU  29 -13.671 -14.631   4.018
  251   1HG   GLU  29          1HG       GLU  29 -16.044 -14.754   3.915
  252   2HG   GLU  29          2HG       GLU  29 -15.570 -13.506   2.772
  253    H    LYS  30           H        LYS  30 -11.199 -13.883   3.189
  254    HA   LYS  30           HA       LYS  30 -11.593 -10.956   2.785
  255   1HB   LYS  30          1HB       LYS  30 -11.797 -11.944   5.105
  256   2HB   LYS  30          2HB       LYS  30 -10.060 -12.276   5.047
  257   1HG   LYS  30          1HG       LYS  30  -9.629  -9.838   4.688
  258   2HG   LYS  30          2HG       LYS  30 -11.367  -9.524   4.721
  259   1HD   LYS  30          1HD       LYS  30  -9.726 -10.653   7.030
  260   2HD   LYS  30          2HD       LYS  30 -10.233  -8.967   6.851
  261   1HE   LYS  30          1HE       LYS  30 -12.625  -9.701   6.909
  262   2HE   LYS  30          2HE       LYS  30 -12.087 -11.370   7.149
  263   1HZ   LYS  30          1HZ       LYS  30 -10.968 -10.618   9.201
  264   2HZ   LYS  30          2HZ       LYS  30 -11.582  -9.114   9.011
  265   3HZ   LYS  30          3HZ       LYS  30 -12.586 -10.375   9.274
  266    H    LYS  31           H        LYS  31  -9.052 -13.446   2.600
  267    HA   LYS  31           HA       LYS  31  -6.974 -11.799   1.679
  268   1HB   LYS  31          1HB       LYS  31  -6.862 -14.216   2.329
  269   2HB   LYS  31          2HB       LYS  31  -7.578 -14.639   0.788
  270   1HG   LYS  31          1HG       LYS  31  -5.125 -12.893   0.720
  271   2HG   LYS  31          2HG       LYS  31  -4.914 -14.554   1.281
  272   1HD   LYS  31          1HD       LYS  31  -5.812 -15.476  -0.766
  273   2HD   LYS  31          2HD       LYS  31  -6.312 -13.889  -1.336
  274   1HE   LYS  31          1HE       LYS  31  -4.319 -14.486  -2.525
  275   2HE   LYS  31          2HE       LYS  31  -3.949 -13.144  -1.441
  276   1HZ   LYS  31          1HZ       LYS  31  -2.931 -14.743   0.090
  277   2HZ   LYS  31          2HZ       LYS  31  -3.318 -16.000  -0.887
  278   3HZ   LYS  31          3HZ       LYS  31  -2.239 -14.881  -1.378
  279    H    SER  32           H        SER  32  -9.853 -12.706  -0.010
  280    HA   SER  32           HA       SER  32  -8.909 -11.414  -2.517
  281   1HB   SER  32          1HB       SER  32 -10.053 -13.741  -2.360
  282   2HB   SER  32          2HB       SER  32 -11.560 -12.830  -2.157
  283    HG   SER  32           HG       SER  32 -11.084 -13.348  -4.364
  284    H    VAL  33           H        VAL  33  -9.993 -10.124   0.171
  285    HA   VAL  33           HA       VAL  33 -11.629  -8.019  -1.217
  286    HB   VAL  33           HB       VAL  33 -11.782  -8.984   1.655
  287   1HG1  VAL  33          1HG1      VAL  33 -11.929  -6.542   1.745
  288   2HG1  VAL  33          2HG1      VAL  33 -13.098  -6.534   0.402
  289   3HG1  VAL  33          3HG1      VAL  33 -13.531  -7.240   1.974
  290   1HG2  VAL  33          1HG2      VAL  33 -13.903  -8.739  -0.532
  291   2HG2  VAL  33          2HG2      VAL  33 -13.102 -10.251  -0.064
  292   3HG2  VAL  33          3HG2      VAL  33 -14.129  -9.407   1.099
  293    H    LEU  34           H        LEU  34  -9.067  -8.523   1.369
  294    HA   LEU  34           HA       LEU  34  -8.325  -5.720   1.124
  295   1HB   LEU  34          1HB       LEU  34  -6.925  -6.029   2.775
  296   2HB   LEU  34          2HB       LEU  34  -7.995  -7.375   3.126
  297    HG   LEU  34           HG       LEU  34  -5.427  -7.523   1.573
  298   1HD1  LEU  34          1HD1      LEU  34  -5.158  -6.909   4.061
  299   2HD1  LEU  34          2HD1      LEU  34  -5.876  -8.472   4.447
  300   3HD1  LEU  34          3HD1      LEU  34  -4.332  -8.390   3.564
  301   1HD2  LEU  34          1HD2      LEU  34  -7.007  -9.782   2.816
  302   2HD2  LEU  34          2HD2      LEU  34  -6.884  -9.430   1.074
  303   3HD2  LEU  34          3HD2      LEU  34  -5.450  -9.937   1.972
  304    H    GLN  35           H        GLN  35  -7.792  -8.445  -0.896
  305    HA   GLN  35           HA       GLN  35  -5.354  -7.824  -2.117
  306   1HB   GLN  35          1HB       GLN  35  -7.440  -9.672  -2.462
  307   2HB   GLN  35          2HB       GLN  35  -7.452  -8.818  -3.976
  308   1HG   GLN  35          1HG       GLN  35  -4.988 -10.109  -2.718
  309   2HG   GLN  35          2HG       GLN  35  -6.002 -10.867  -3.938
  310   1HE2  GLN  35          2HE2      GLN  35  -3.057  -9.482  -3.730
  311   2HE2  GLN  35          1HE2      GLN  35  -2.998  -8.716  -5.310
  312    H    LYS  36           H        LYS  36  -8.609  -6.475  -2.823
  313    HA   LYS  36           HA       LYS  36  -7.699  -5.032  -5.191
  314   1HB   LYS  36          1HB       LYS  36 -10.252  -4.804  -3.522
  315   2HB   LYS  36          2HB       LYS  36  -9.917  -3.844  -4.961
  316   1HG   LYS  36          1HG       LYS  36 -10.862  -5.468  -6.168
  317   2HG   LYS  36          2HG       LYS  36  -9.376  -6.363  -5.931
  318   1HD   LYS  36          1HD       LYS  36 -11.130  -7.850  -5.445
  319   2HD   LYS  36          2HD       LYS  36 -10.451  -7.427  -3.867
  320   1HE   LYS  36          1HE       LYS  36 -12.292  -5.910  -3.407
  321   2HE   LYS  36          2HE       LYS  36 -12.858  -5.997  -5.080
  322   1HZ   LYS  36          1HZ       LYS  36 -13.477  -8.281  -4.756
  323   2HZ   LYS  36          2HZ       LYS  36 -12.831  -8.349  -3.264
  324   3HZ   LYS  36          3HZ       LYS  36 -14.161  -7.421  -3.554
  325    H    ILE  37           H        ILE  37  -7.948  -4.139  -1.786
  326    HA   ILE  37           HA       ILE  37  -7.104  -1.358  -2.174
  327    HB   ILE  37           HB       ILE  37  -6.783  -3.255   0.192
  328   1HG1  ILE  37          1HG1      ILE  37  -8.927  -1.193  -0.229
  329   2HG1  ILE  37          2HG1      ILE  37  -9.093  -2.958  -0.266
  330   1HG2  ILE  37          1HG2      ILE  37  -5.140  -1.510   0.447
  331   2HG2  ILE  37          2HG2      ILE  37  -6.275  -0.273  -0.120
  332   3HG2  ILE  37          3HG2      ILE  37  -6.477  -1.009   1.466
  333   1HD1  ILE  37          1HD1      ILE  37  -8.350  -3.000   2.151
  334   2HD1  ILE  37          2HD1      ILE  37  -8.568  -1.227   2.152
  335   3HD1  ILE  37          3HD1      ILE  37  -9.938  -2.284   1.826
  336    H    LEU  38           H        LEU  38  -5.287  -4.419  -1.407
  337    HA   LEU  38           HA       LEU  38  -2.700  -3.338  -1.473
  338   1HB   LEU  38          1HB       LEU  38  -3.918  -6.022  -2.030
  339   2HB   LEU  38          2HB       LEU  38  -2.279  -5.793  -2.595
  340    HG   LEU  38           HG       LEU  38  -3.095  -5.228   0.282
  341   1HD1  LEU  38          1HD1      LEU  38  -3.559  -7.590  -0.241
  342   2HD1  LEU  38          2HD1      LEU  38  -1.914  -7.778  -0.897
  343   3HD1  LEU  38          3HD1      LEU  38  -2.161  -7.436   0.833
  344   1HD2  LEU  38          1HD2      LEU  38  -0.423  -5.672  -1.146
  345   2HD2  LEU  38          2HD2      LEU  38  -0.977  -4.193  -0.329
  346   3HD2  LEU  38          3HD2      LEU  38  -0.596  -5.639   0.613
  347    H    GLU  39           H        GLU  39  -4.588  -4.474  -4.328
  348    HA   GLU  39           HA       GLU  39  -2.516  -3.760  -6.188
  349   1HB   GLU  39          1HB       GLU  39  -4.323  -5.426  -6.628
  350   2HB   GLU  39          2HB       GLU  39  -5.525  -4.130  -6.598
  351   1HG   GLU  39          1HG       GLU  39  -4.502  -3.104  -8.595
  352   2HG   GLU  39          2HG       GLU  39  -3.212  -4.308  -8.576
  353    H    ASP  40           H        ASP  40  -5.336  -1.885  -5.010
  354    HA   ASP  40           HA       ASP  40  -4.971   0.393  -6.684
  355   1HB   ASP  40          1HB       ASP  40  -6.251  -0.304  -4.028
  356   2HB   ASP  40          2HB       ASP  40  -6.081   1.332  -4.432
  357    H    GLU  41           H        GLU  41  -3.415  -0.591  -3.600
  358    HA   GLU  41           HA       GLU  41  -2.154   2.060  -3.274
  359   1HB   GLU  41          1HB       GLU  41  -1.497  -0.556  -1.888
  360   2HB   GLU  41          2HB       GLU  41  -0.823   1.020  -1.486
  361   1HG   GLU  41          1HG       GLU  41  -3.658   0.069  -1.028
  362   2HG   GLU  41          2HG       GLU  41  -2.427   0.399   0.164
  363    H    GLU  42           H        GLU  42  -1.131  -1.127  -4.516
  364    HA   GLU  42           HA       GLU  42   1.555  -0.432  -5.149
  365   1HB   GLU  42          1HB       GLU  42   0.579  -2.717  -5.218
  366   2HB   GLU  42          2HB       GLU  42  -0.328  -2.279  -6.672
  367   1HG   GLU  42          1HG       GLU  42   1.781  -1.893  -7.893
  368   2HG   GLU  42          2HG       GLU  42   2.711  -2.200  -6.422
  369    H    LYS  43           H        LYS  43  -1.474   0.282  -6.888
  370    HA   LYS  43           HA       LYS  43  -0.204   1.469  -9.190
  371   1HB   LYS  43          1HB       LYS  43  -2.768   0.712  -8.659
  372   2HB   LYS  43          2HB       LYS  43  -2.921   2.425  -8.314
  373   1HG   LYS  43          1HG       LYS  43  -3.486   2.186 -10.602
  374   2HG   LYS  43          2HG       LYS  43  -1.843   2.842 -10.614
  375   1HD   LYS  43          1HD       LYS  43  -0.971   0.484 -10.958
  376   2HD   LYS  43          2HD       LYS  43  -2.652  -0.076 -11.028
  377   1HE   LYS  43          1HE       LYS  43  -3.054   1.419 -12.977
  378   2HE   LYS  43          2HE       LYS  43  -1.380   1.985 -12.888
  379   1HZ   LYS  43          1HZ       LYS  43  -0.654  -0.303 -13.336
  380   2HZ   LYS  43          2HZ       LYS  43  -2.203  -0.818 -13.435
  381   3HZ   LYS  43          3HZ       LYS  43  -1.618   0.228 -14.541
  382    H    HIS  44           H        HIS  44  -1.397   2.995  -6.091
  383    HA   HIS  44           HA       HIS  44  -0.755   5.637  -6.751
  384   1HB   HIS  44          1HB       HIS  44  -0.634   4.147  -4.084
  385   2HB   HIS  44          2HB       HIS  44  -0.714   5.856  -4.357
  386    HD2  HIS  44           2HD      HIS  44  -3.118   5.013  -6.761
  387    HE1  HIS  44           1HE      HIS  44  -5.436   4.675  -3.220
  388    HE2  HIS  44           2HE      HIS  44  -5.506   4.749  -5.771
  389    H    ILE  45           H        ILE  45   1.265   3.057  -5.298
  390    HA   ILE  45           HA       ILE  45   3.592   4.600  -4.798
  391    HB   ILE  45           HB       ILE  45   2.864   1.722  -4.993
  392   1HG1  ILE  45          1HG1      ILE  45   4.154   1.617  -2.877
  393   2HG1  ILE  45          2HG1      ILE  45   4.637   3.295  -3.088
  394   1HG2  ILE  45          1HG2      ILE  45   4.819   1.585  -6.433
  395   2HG2  ILE  45          2HG2      ILE  45   5.785   2.517  -5.261
  396   3HG2  ILE  45          3HG2      ILE  45   5.177   0.899  -4.853
  397   1HD1  ILE  45          1HD1      ILE  45   2.268   4.009  -2.824
  398   2HD1  ILE  45          2HD1      ILE  45   1.818   2.300  -2.577
  399   3HD1  ILE  45          3HD1      ILE  45   2.887   3.107  -1.430
  400    H    GLU  46           H        GLU  46   2.612   3.066  -7.912
  401    HA   GLU  46           HA       GLU  46   5.030   3.759  -9.318
  402   1HB   GLU  46          1HB       GLU  46   2.162   3.209 -10.177
  403   2HB   GLU  46          2HB       GLU  46   3.430   3.573 -11.322
  404   1HG   GLU  46          1HG       GLU  46   3.622   1.257  -9.360
  405   2HG   GLU  46          2HG       GLU  46   2.887   1.121 -10.952
  406    H    TRP  47           H        TRP  47   1.981   5.552  -8.756
  407    HA   TRP  47           HA       TRP  47   2.642   7.713 -10.549
  408   1HB   TRP  47          1HB       TRP  47   0.705   7.663  -8.191
  409   2HB   TRP  47          2HB       TRP  47   0.703   8.776  -9.528
  410    HD1  TRP  47           1HD      TRP  47   0.975   5.953 -11.539
  411    HE1  TRP  47           1HE      TRP  47  -1.258   4.779 -12.068
  412    HE3  TRP  47           3HE      TRP  47  -1.918   8.087  -7.947
  413    HZ2  TRP  47           2HZ      TRP  47  -3.984   4.815 -11.062
  414    HZ3  TRP  47           3HZ      TRP  47  -4.337   7.552  -7.730
  415    HH2  TRP  47           2HH      TRP  47  -5.376   5.889  -9.282
  416    H    LEU  48           H        LEU  48   2.942   7.149  -7.065
  417    HA   LEU  48           HA       LEU  48   3.837   9.624  -6.136
  418   1HB   LEU  48          1HB       LEU  48   3.922   6.776  -5.351
  419   2HB   LEU  48          2HB       LEU  48   5.393   7.548  -4.899
  420    HG   LEU  48           HG       LEU  48   3.995   7.580  -3.088
  421   1HD1  LEU  48          1HD1      LEU  48   3.821   9.897  -2.471
  422   2HD1  LEU  48          2HD1      LEU  48   5.265   9.709  -3.481
  423   3HD1  LEU  48          3HD1      LEU  48   3.785  10.429  -4.151
  424   1HD2  LEU  48          1HD2      LEU  48   1.829   8.924  -4.742
  425   2HD2  LEU  48          2HD2      LEU  48   1.807   7.271  -4.084
  426   3HD2  LEU  48          3HD2      LEU  48   1.770   8.655  -2.987
  427    H    GLU  49           H        GLU  49   5.809   6.986  -7.447
  428    HA   GLU  49           HA       GLU  49   8.293   8.447  -7.474
  429   1HB   GLU  49          1HB       GLU  49   7.824   5.898  -7.742
  430   2HB   GLU  49          2HB       GLU  49   7.561   6.236  -9.428
  431   1HG   GLU  49          1HG       GLU  49   9.819   5.496  -9.206
  432   2HG   GLU  49          2HG       GLU  49   9.858   7.196  -9.624
  433    H    THR  50           H        THR  50   5.852   7.998  -9.999
  434    HA   THR  50           HA       THR  50   7.068   9.479 -12.080
  435    HB   THR  50           HB       THR  50   4.113   9.099 -11.446
  436    HG1  THR  50           1HG      THR  50   5.063   7.118 -11.694
  437   1HG2  THR  50          1HG2      THR  50   4.349  10.790 -13.130
  438   2HG2  THR  50          2HG2      THR  50   5.540   9.791 -14.016
  439   3HG2  THR  50          3HG2      THR  50   3.833   9.270 -13.887
  440    H    ILE  51           H        ILE  51   5.287  10.586  -9.294
  441    HA   ILE  51           HA       ILE  51   5.232  13.398 -10.072
  442    HB   ILE  51           HB       ILE  51   4.438  11.831  -7.601
  443   1HG1  ILE  51          1HG1      ILE  51   2.716  13.557  -9.433
  444   2HG1  ILE  51          2HG1      ILE  51   3.031  11.864  -9.770
  445   1HG2  ILE  51          1HG2      ILE  51   5.186  13.956  -6.693
  446   2HG2  ILE  51          2HG2      ILE  51   4.223  14.852  -7.894
  447   3HG2  ILE  51          3HG2      ILE  51   3.441  13.886  -6.624
  448   1HD1  ILE  51          1HD1      ILE  51   0.915  11.982  -8.675
  449   2HD1  ILE  51          2HD1      ILE  51   2.054  11.258  -7.528
  450   3HD1  ILE  51          3HD1      ILE  51   1.554  12.957  -7.347
  451    H    ASN  52           H        ASN  52   7.524  11.424  -8.636
  452    HA   ASN  52           HA       ASN  52   9.034  13.411  -7.126
  453   1HB   ASN  52          1HB       ASN  52   8.968  10.850  -6.789
  454   2HB   ASN  52          2HB       ASN  52  10.016  10.747  -8.204
  455   1HD2  ASN  52          2HD2      ASN  52  11.302   9.556  -6.569
  456   2HD2  ASN  52          1HD2      ASN  52  12.452  10.543  -5.645
  457    H    GLY  53           H        GLY  53  11.350  13.883  -7.659
  458   1HA   GLY  53          1HA       GLY  53  12.405  13.895 -10.324
  459   2HA   GLY  53          2HA       GLY  53  11.617  15.442 -10.015
  460   1H    MET   1          1H        MET   1  -6.482  -9.939  19.517
  461   2H    MET   1          2H        MET   1  -7.878 -10.766  19.293
  462   3H    MET   1          3H        MET   1  -6.450 -11.566  19.361
  463    HA   MET   1           HA       MET   1  -5.691 -10.523  17.334
  464   1HB   MET   1          1HB       MET   1  -6.856 -12.712  17.223
  465   2HB   MET   1          2HB       MET   1  -8.402 -11.883  17.010
  466   1HG   MET   1          1HG       MET   1  -7.506 -10.841  14.919
  467   2HG   MET   1          2HG       MET   1  -6.012 -11.756  15.118
  468   1HE   MET   1          1HE       MET   1  -5.738 -14.305  14.616
  469   2HE   MET   1          2HE       MET   1  -6.867 -14.703  15.935
  470   3HE   MET   1          3HE       MET   1  -7.088 -15.423  14.327
  471    H    ASP   2           H        ASP   2  -5.602  -8.485  16.618
  472    HA   ASP   2           HA       ASP   2  -8.002  -7.201  15.513
  473   1HB   ASP   2          1HB       ASP   2  -8.052  -6.307  17.777
  474   2HB   ASP   2          2HB       ASP   2  -6.326  -5.942  17.719
  475    H    TYR   3           H        TYR   3  -7.483  -6.263  13.638
  476    HA   TYR   3           HA       TYR   3  -4.836  -5.176  13.044
  477   1HB   TYR   3          1HB       TYR   3  -4.355  -6.724  11.189
  478   2HB   TYR   3          2HB       TYR   3  -4.356  -7.517  12.736
  479    HD1  TYR   3           1HD      TYR   3  -6.004  -7.322   9.455
  480    HD2  TYR   3           2HD      TYR   3  -6.106  -9.158  13.358
  481    HE1  TYR   3           1HE      TYR   3  -7.571  -9.047   8.604
  482    HE2  TYR   3           2HE      TYR   3  -7.649 -10.910  12.484
  483    HH   TYR   3           HH       TYR   3  -8.750 -11.733  10.669
  484    H    LEU   4           H        LEU   4  -7.541  -4.006  13.060
  485    HA   LEU   4           HA       LEU   4  -7.778  -3.321  10.174
  486   1HB   LEU   4          1HB       LEU   4 -10.096  -3.704  10.175
  487   2HB   LEU   4          2HB       LEU   4  -9.243  -5.134  10.787
  488    HG   LEU   4           HG       LEU   4  -9.842  -3.963  13.130
  489   1HD1  LEU   4          1HD1      LEU   4 -11.117  -2.062  12.132
  490   2HD1  LEU   4          2HD1      LEU   4 -12.185  -3.217  11.315
  491   3HD1  LEU   4          3HD1      LEU   4 -12.168  -3.107  13.087
  492   1HD2  LEU   4          1HD2      LEU   4 -11.776  -5.674  11.504
  493   2HD2  LEU   4          2HD2      LEU   4 -10.421  -6.274  12.486
  494   3HD2  LEU   4          3HD2      LEU   4 -11.794  -5.485  13.273
  495    H    ARG   5           H        ARG   5  -7.875  -1.926  13.274
  496    HA   ARG   5           HA       ARG   5  -9.148   0.589  12.297
  497   1HB   ARG   5          1HB       ARG   5  -9.670  -0.357  14.640
  498   2HB   ARG   5          2HB       ARG   5  -7.992   0.010  15.063
  499   1HG   ARG   5          1HG       ARG   5  -8.482   2.432  14.329
  500   2HG   ARG   5          2HG       ARG   5 -10.168   1.943  14.136
  501   1HD   ARG   5          1HD       ARG   5 -10.042   2.950  16.264
  502   2HD   ARG   5          2HD       ARG   5 -10.128   1.212  16.583
  503    HE   ARG   5           HE       ARG   5  -7.405   1.729  16.496
  504   1HH1  ARG   5          1HH2      ARG   5 -10.003   2.979  18.491
  505   2HH1  ARG   5          2HH2      ARG   5  -8.919   3.406  19.785
  506   1HH2  ARG   5          1HH1      ARG   5  -6.085   2.291  18.189
  507   2HH2  ARG   5          2HH1      ARG   5  -6.765   3.014  19.615
  508    H    GLU   6           H        GLU   6  -6.211  -0.957  13.420
  509    HA   GLU   6           HA       GLU   6  -4.226   0.900  12.917
  510   1HB   GLU   6          1HB       GLU   6  -4.272  -1.612  13.788
  511   2HB   GLU   6          2HB       GLU   6  -3.988  -2.030  12.108
  512   1HG   GLU   6          1HG       GLU   6  -1.931  -0.673  12.104
  513   2HG   GLU   6          2HG       GLU   6  -2.312  -0.025  13.695
  514    H    LEU   7           H        LEU   7  -5.938  -1.132  10.559
  515    HA   LEU   7           HA       LEU   7  -4.484  -0.117   8.226
  516   1HB   LEU   7          1HB       LEU   7  -7.024  -1.795   8.402
  517   2HB   LEU   7          2HB       LEU   7  -6.076  -1.505   6.949
  518    HG   LEU   7           HG       LEU   7  -5.181  -3.077   9.362
  519   1HD1  LEU   7          1HD1      LEU   7  -5.305  -4.969   7.836
  520   2HD1  LEU   7          2HD1      LEU   7  -6.853  -4.133   7.788
  521   3HD1  LEU   7          3HD1      LEU   7  -5.689  -3.906   6.463
  522   1HD2  LEU   7          1HD2      LEU   7  -3.679  -2.432   6.808
  523   2HD2  LEU   7          2HD2      LEU   7  -3.258  -1.945   8.475
  524   3HD2  LEU   7          3HD2      LEU   7  -3.188  -3.643   8.018
  525    H    TYR   8           H        TYR   8  -6.779   1.420  10.019
  526    HA   TYR   8           HA       TYR   8  -8.090   2.773   7.647
  527   1HB   TYR   8          1HB       TYR   8  -9.452   1.321   9.306
  528   2HB   TYR   8          2HB       TYR   8  -8.992   2.378  10.569
  529    HD1  TYR   8           1HD      TYR   8 -10.591   3.845  11.332
  530    HD2  TYR   8           2HD      TYR   8 -10.552   2.815   7.145
  531    HE1  TYR   8           1HE      TYR   8 -12.679   5.144  10.994
  532    HE2  TYR   8           2HE      TYR   8 -12.703   4.033   6.833
  533    HH   TYR   8           HH       TYR   8 -14.324   5.762   9.519
  534    H    LYS   9           H        LYS   9  -7.014   3.210  10.960
  535    HA   LYS   9           HA       LYS   9  -6.986   6.060  10.880
  536   1HB   LYS   9          1HB       LYS   9  -5.680   3.937  12.655
  537   2HB   LYS   9          2HB       LYS   9  -5.193   5.615  12.861
  538   1HG   LYS   9          1HG       LYS   9  -7.616   6.274  13.074
  539   2HG   LYS   9          2HG       LYS   9  -8.059   4.560  13.013
  540   1HD   LYS   9          1HD       LYS   9  -6.735   4.143  15.062
  541   2HD   LYS   9          2HD       LYS   9  -6.258   5.842  15.129
  542   1HE   LYS   9          1HE       LYS   9  -9.144   4.841  15.249
  543   2HE   LYS   9          2HE       LYS   9  -8.157   5.201  16.670
  544   1HZ   LYS   9          1HZ       LYS   9  -7.987   7.508  15.890
  545   2HZ   LYS   9          2HZ       LYS   9  -8.937   7.185  14.597
  546   3HZ   LYS   9          3HZ       LYS   9  -9.547   7.089  16.103
  547    H    LEU  10           H        LEU  10  -4.117   3.993  10.367
  548    HA   LEU  10           HA       LEU  10  -2.564   6.220   9.569
  549   1HB   LEU  10          1HB       LEU  10  -2.244   3.241   9.404
  550   2HB   LEU  10          2HB       LEU  10  -1.132   4.251   8.482
  551    HG   LEU  10           HG       LEU  10  -1.653   4.889  11.407
  552   1HD1  LEU  10          1HD1      LEU  10  -1.018   2.543  11.402
  553   2HD1  LEU  10          2HD1      LEU  10   0.404   2.903  10.385
  554   3HD1  LEU  10          3HD1      LEU  10   0.293   3.542  12.041
  555   1HD2  LEU  10          1HD2      LEU  10   0.800   5.247   9.623
  556   2HD2  LEU  10          2HD2      LEU  10  -0.387   6.516   9.979
  557   3HD2  LEU  10          3HD2      LEU  10   0.597   5.844  11.284
  558    H    GLU  11           H        GLU  11  -4.631   4.039   7.713
  559    HA   GLU  11           HA       GLU  11  -4.215   5.116   5.098
  560   1HB   GLU  11          1HB       GLU  11  -6.119   3.437   6.579
  561   2HB   GLU  11          2HB       GLU  11  -6.938   4.270   5.335
  562   1HG   GLU  11          1HG       GLU  11  -4.358   2.649   4.926
  563   2HG   GLU  11          2HG       GLU  11  -5.964   1.966   4.788
  564    H    GLN  12           H        GLN  12  -6.427   6.307   7.783
  565    HA   GLN  12           HA       GLN  12  -7.350   8.440   6.116
  566   1HB   GLN  12          1HB       GLN  12  -7.738   7.677   8.998
  567   2HB   GLN  12          2HB       GLN  12  -8.323   9.221   8.348
  568   1HG   GLN  12          1HG       GLN  12  -9.483   8.030   6.526
  569   2HG   GLN  12          2HG       GLN  12  -9.044   6.487   7.220
  570   1HE2  GLN  12          2HE2      GLN  12 -11.775   7.584   6.768
  571   2HE2  GLN  12          1HE2      GLN  12 -12.518   7.578   8.356
  572    H    GLN  13           H        GLN  13  -4.728   8.192   8.413
  573    HA   GLN  13           HA       GLN  13  -4.177  11.047   8.580
  574   1HB   GLN  13          1HB       GLN  13  -2.421   8.584   8.965
  575   2HB   GLN  13          2HB       GLN  13  -1.791  10.232   9.074
  576   1HG   GLN  13          1HG       GLN  13  -3.463  10.762  10.838
  577   2HG   GLN  13          2HG       GLN  13  -4.002   9.085  10.830
  578   1HE2  GLN  13          2HE2      GLN  13  -3.041  10.264  13.199
  579   2HE2  GLN  13          1HE2      GLN  13  -1.481   9.545  13.579
  580    H    ALA  14           H        ALA  14  -3.289   8.565   6.160
  581    HA   ALA  14           HA       ALA  14  -1.624  10.382   4.599
  582   1HB   ALA  14          1HB       ALA  14  -1.457   7.912   4.401
  583   2HB   ALA  14          2HB       ALA  14  -3.131   7.837   3.805
  584   3HB   ALA  14          3HB       ALA  14  -1.882   8.661   2.850
  585    H    MET  15           H        MET  15  -5.104   9.440   4.563
  586    HA   MET  15           HA       MET  15  -5.852  11.106   2.315
  587   1HB   MET  15          1HB       MET  15  -7.457  10.181   4.751
  588   2HB   MET  15          2HB       MET  15  -8.138  11.132   3.461
  589   1HG   MET  15          1HG       MET  15  -6.834   9.004   2.141
  590   2HG   MET  15          2HG       MET  15  -7.594   8.274   3.553
  591   1HE   MET  15          1HE       MET  15  -8.853  11.437   1.360
  592   2HE   MET  15          2HE       MET  15  -7.964  10.308   0.325
  593   3HE   MET  15          3HE       MET  15  -9.716  10.522   0.107
  594    H    LYS  16           H        LYS  16  -5.675  11.882   5.811
  595    HA   LYS  16           HA       LYS  16  -6.673  14.530   5.511
  596   1HB   LYS  16          1HB       LYS  16  -5.971  12.870   7.629
  597   2HB   LYS  16          2HB       LYS  16  -4.758  14.116   7.751
  598   1HG   LYS  16          1HG       LYS  16  -6.277  15.749   8.320
  599   2HG   LYS  16          2HG       LYS  16  -7.566  15.115   7.306
  600   1HD   LYS  16          1HD       LYS  16  -6.664  13.864   9.913
  601   2HD   LYS  16          2HD       LYS  16  -8.046  14.953   9.739
  602   1HE   LYS  16          1HE       LYS  16  -7.783  12.247   8.335
  603   2HE   LYS  16          2HE       LYS  16  -8.640  12.509   9.853
  604   1HZ   LYS  16          1HZ       LYS  16 -10.132  14.041   8.687
  605   2HZ   LYS  16          2HZ       LYS  16  -9.363  13.785   7.267
  606   3HZ   LYS  16          3HZ       LYS  16 -10.173  12.569   7.990
  607    H    LEU  17           H        LEU  17  -3.347  13.227   5.469
  608    HA   LEU  17           HA       LEU  17  -1.996  15.691   4.941
  609   1HB   LEU  17          1HB       LEU  17  -1.379  12.850   4.975
  610   2HB   LEU  17          2HB       LEU  17  -0.725  13.514   3.509
  611    HG   LEU  17           HG       LEU  17  -0.260  14.622   6.307
  612   1HD1  LEU  17          1HD1      LEU  17   0.759  12.412   5.989
  613   2HD1  LEU  17          2HD1      LEU  17   1.567  12.971   4.508
  614   3HD1  LEU  17          3HD1      LEU  17   2.007  13.662   6.087
  615   1HD2  LEU  17          1HD2      LEU  17   1.118  15.311   3.665
  616   2HD2  LEU  17          2HD2      LEU  17   0.049  16.387   4.581
  617   3HD2  LEU  17          3HD2      LEU  17   1.603  15.905   5.265
  618    H    TYR  18           H        TYR  18  -3.554  13.368   2.717
  619    HA   TYR  18           HA       TYR  18  -2.852  14.662   0.291
  620   1HB   TYR  18          1HB       TYR  18  -4.763  12.568   1.189
  621   2HB   TYR  18          2HB       TYR  18  -5.223  13.360  -0.267
  622    HD1  TYR  18           1HD      TYR  18  -3.296  13.620  -2.095
  623    HD2  TYR  18           2HD      TYR  18  -3.341  10.682   1.040
  624    HE1  TYR  18           1HE      TYR  18  -1.491  12.337  -3.266
  625    HE2  TYR  18           2HE      TYR  18  -1.501   9.446  -0.071
  626    HH   TYR  18           HH       TYR  18  -0.023   9.411  -1.816
  627    H    ARG  19           H        ARG  19  -5.637  15.379   2.427
  628    HA   ARG  19           HA       ARG  19  -6.897  17.329   0.739
  629   1HB   ARG  19          1HB       ARG  19  -8.000  16.558   2.729
  630   2HB   ARG  19          2HB       ARG  19  -6.662  17.070   3.761
  631   1HG   ARG  19          1HG       ARG  19  -7.132  19.427   3.316
  632   2HG   ARG  19          2HG       ARG  19  -8.430  18.991   2.189
  633   1HD   ARG  19          1HD       ARG  19  -9.778  18.099   3.994
  634   2HD   ARG  19          2HD       ARG  19  -8.405  18.115   5.101
  635    HE   ARG  19           HE       ARG  19  -8.731  20.335   5.562
  636   1HH1  ARG  19          1HH2      ARG  19 -10.693  19.674   2.729
  637   2HH1  ARG  19          2HH2      ARG  19 -11.425  21.254   2.770
  638   1HH2  ARG  19          1HH1      ARG  19  -9.701  22.315   5.546
  639   2HH2  ARG  19          2HH1      ARG  19 -10.878  22.702   4.327
  640    H    GLU  20           H        GLU  20  -4.164  17.731   2.998
  641    HA   GLU  20           HA       GLU  20  -3.984  20.608   2.468
  642   1HB   GLU  20          1HB       GLU  20  -3.319  18.928   4.545
  643   2HB   GLU  20          2HB       GLU  20  -1.746  19.115   3.817
  644   1HG   GLU  20          1HG       GLU  20  -3.552  21.422   4.678
  645   2HG   GLU  20          2HG       GLU  20  -2.310  20.710   5.698
  646    H    ALA  21           H        ALA  21  -2.115  17.752   1.550
  647    HA   ALA  21           HA       ALA  21  -0.114  18.980  -0.039
  648   1HB   ALA  21          1HB       ALA  21  -0.203  16.570   0.524
  649   2HB   ALA  21          2HB       ALA  21  -1.595  16.370  -0.567
  650   3HB   ALA  21          3HB       ALA  21  -0.014  16.843  -1.221
  651    H    SER  22           H        SER  22  -3.556  18.361  -0.830
  652    HA   SER  22           HA       SER  22  -3.504  19.240  -3.517
  653   1HB   SER  22          1HB       SER  22  -5.423  18.157  -2.231
  654   2HB   SER  22          2HB       SER  22  -5.813  19.788  -1.650
  655    HG   SER  22           HG       SER  22  -5.857  20.420  -3.903
  656    H    GLU  23           H        GLU  23  -3.254  21.304  -0.586
  657    HA   GLU  23           HA       GLU  23  -3.801  23.776  -2.089
  658   1HB   GLU  23          1HB       GLU  23  -3.858  23.233   0.524
  659   2HB   GLU  23          2HB       GLU  23  -2.172  23.731   0.440
  660   1HG   GLU  23          1HG       GLU  23  -2.852  25.875  -0.634
  661   2HG   GLU  23          2HG       GLU  23  -4.540  25.372  -0.581
  662    H    LYS  24           H        LYS  24  -0.890  21.975  -1.214
  663    HA   LYS  24           HA       LYS  24   0.947  23.821  -2.588
  664   1HB   LYS  24          1HB       LYS  24   1.228  20.912  -1.719
  665   2HB   LYS  24          2HB       LYS  24   2.506  21.830  -2.504
  666   1HG   LYS  24          1HG       LYS  24   1.242  22.648   0.143
  667   2HG   LYS  24          2HG       LYS  24   2.710  21.678  -0.019
  668   1HD   LYS  24          1HD       LYS  24   3.787  23.536  -1.304
  669   2HD   LYS  24          2HD       LYS  24   2.348  24.539  -1.018
  670   1HE   LYS  24          1HE       LYS  24   2.676  24.326   1.427
  671   2HE   LYS  24          2HE       LYS  24   4.095  23.304   1.156
  672   1HZ   LYS  24          1HZ       LYS  24   5.162  25.193   0.040
  673   2HZ   LYS  24          2HZ       LYS  24   3.852  26.138   0.287
  674   3HZ   LYS  24          3HZ       LYS  24   4.733  25.614   1.556
  675    H    ALA  25           H        ALA  25  -0.777  20.889  -3.547
  676    HA   ALA  25           HA       ALA  25   0.174  21.000  -6.315
  677   1HB   ALA  25          1HB       ALA  25  -0.103  18.874  -5.025
  678   2HB   ALA  25          2HB       ALA  25  -1.854  19.174  -4.971
  679   3HB   ALA  25          3HB       ALA  25  -1.052  18.908  -6.524
  680    H    ARG  26           H        ARG  26  -1.551  23.236  -5.287
  681    HA   ARG  26           HA       ARG  26  -4.173  23.266  -6.130
  682   1HB   ARG  26          1HB       ARG  26  -2.417  25.095  -5.091
  683   2HB   ARG  26          2HB       ARG  26  -2.521  25.709  -6.721
  684   1HG   ARG  26          1HG       ARG  26  -4.147  26.903  -5.539
  685   2HG   ARG  26          2HG       ARG  26  -5.109  25.673  -6.374
  686   1HD   ARG  26          1HD       ARG  26  -5.127  24.288  -4.321
  687   2HD   ARG  26          2HD       ARG  26  -4.056  25.430  -3.514
  688    HE   ARG  26           HE       ARG  26  -6.943  25.733  -4.004
  689   1HH1  ARG  26          1HH2      ARG  26  -4.045  27.463  -3.029
  690   2HH1  ARG  26          2HH2      ARG  26  -4.960  28.728  -2.258
  691   1HH2  ARG  26          1HH1      ARG  26  -8.032  27.384  -2.999
  692   2HH2  ARG  26          2HH1      ARG  26  -7.151  28.678  -2.244
  693    H    ASN  27           H        ASN  27  -1.434  23.326  -8.247
  694    HA   ASN  27           HA       ASN  27  -2.726  24.340 -10.633
  695   1HB   ASN  27          1HB       ASN  27  -0.288  24.492 -10.169
  696   2HB   ASN  27          2HB       ASN  27  -0.156  22.734 -10.230
  697   1HD2  ASN  27          2HD2      ASN  27   0.243  25.527 -12.073
  698   2HD2  ASN  27          1HD2      ASN  27   0.140  24.764 -13.652
  699    HA   PRO  28           HA       PRO  28  -5.107  20.726 -11.412
  700   1HB   PRO  28          1HB       PRO  28  -5.723  20.931 -14.084
  701   2HB   PRO  28          2HB       PRO  28  -6.422  21.952 -12.793
  702   1HG   PRO  28          1HG       PRO  28  -4.083  22.589 -14.610
  703   2HG   PRO  28          2HG       PRO  28  -5.494  23.625 -14.212
  704   1HD   PRO  28          1HD       PRO  28  -3.121  23.912 -12.944
  705   2HD   PRO  28          2HD       PRO  28  -4.660  24.072 -12.040
  706    H    GLU  29           H        GLU  29  -2.120  21.064 -13.178
  707    HA   GLU  29           HA       GLU  29  -1.995  18.546 -14.510
  708   1HB   GLU  29          1HB       GLU  29  -0.462  20.736 -14.482
  709   2HB   GLU  29          2HB       GLU  29   0.425  19.859 -13.261
  710   1HG   GLU  29          1HG       GLU  29   1.515  19.422 -15.326
  711   2HG   GLU  29          2HG       GLU  29   0.666  17.940 -14.911
  712    H    LYS  30           H        LYS  30  -1.446  19.457 -11.228
  713    HA   LYS  30           HA       LYS  30  -0.957  16.624 -10.434
  714   1HB   LYS  30          1HB       LYS  30  -0.250  19.180  -8.955
  715   2HB   LYS  30          2HB       LYS  30  -0.176  17.557  -8.245
  716   1HG   LYS  30          1HG       LYS  30   1.406  16.844 -10.033
  717   2HG   LYS  30          2HG       LYS  30   1.422  18.504 -10.659
  718   1HD   LYS  30          1HD       LYS  30   2.314  19.326  -8.511
  719   2HD   LYS  30          2HD       LYS  30   2.237  17.683  -7.832
  720   1HE   LYS  30          1HE       LYS  30   3.818  16.893  -9.582
  721   2HE   LYS  30          2HE       LYS  30   3.914  18.530 -10.239
  722   1HZ   LYS  30          1HZ       LYS  30   4.886  19.265  -8.138
  723   2HZ   LYS  30          2HZ       LYS  30   4.749  17.772  -7.483
  724   3HZ   LYS  30          3HZ       LYS  30   5.768  18.029  -8.731
  725    H    LYS  31           H        LYS  31  -3.068  19.413  -9.683
  726    HA   LYS  31           HA       LYS  31  -4.628  18.250  -7.726
  727   1HB   LYS  31          1HB       LYS  31  -4.715  20.613  -9.076
  728   2HB   LYS  31          2HB       LYS  31  -6.154  19.829  -9.722
  729   1HG   LYS  31          1HG       LYS  31  -5.507  20.445  -6.811
  730   2HG   LYS  31          2HG       LYS  31  -6.707  21.233  -7.842
  731   1HD   LYS  31          1HD       LYS  31  -7.860  18.948  -8.022
  732   2HD   LYS  31          2HD       LYS  31  -6.765  18.413  -6.721
  733   1HE   LYS  31          1HE       LYS  31  -7.597  20.325  -5.314
  734   2HE   LYS  31          2HE       LYS  31  -8.763  20.715  -6.583
  735   1HZ   LYS  31          1HZ       LYS  31  -9.721  18.482  -6.269
  736   2HZ   LYS  31          2HZ       LYS  31  -8.641  18.158  -5.077
  737   3HZ   LYS  31          3HZ       LYS  31  -9.763  19.323  -4.870
  738    H    SER  32           H        SER  32  -4.881  17.656 -11.167
  739    HA   SER  32           HA       SER  32  -7.116  15.761 -10.763
  740   1HB   SER  32          1HB       SER  32  -6.818  17.498 -12.703
  741   2HB   SER  32          2HB       SER  32  -5.726  16.296 -13.409
  742    HG   SER  32           HG       SER  32  -7.910  16.073 -14.129
  743    H    VAL  33           H        VAL  33  -4.022  15.348 -10.119
  744    HA   VAL  33           HA       VAL  33  -3.970  12.484 -11.029
  745    HB   VAL  33           HB       VAL  33  -1.633  14.304 -10.356
  746   1HG1  VAL  33          1HG1      VAL  33  -1.152  12.011  -9.590
  747   2HG1  VAL  33          2HG1      VAL  33  -1.671  11.358 -11.158
  748   3HG1  VAL  33          3HG1      VAL  33  -0.222  12.380 -11.042
  749   1HG2  VAL  33          1HG2      VAL  33  -2.470  12.951 -12.965
  750   2HG2  VAL  33          2HG2      VAL  33  -2.586  14.688 -12.618
  751   3HG2  VAL  33          3HG2      VAL  33  -1.000  13.919 -12.713
  752    H    LEU  34           H        LEU  34  -3.199  14.679  -8.173
  753    HA   LEU  34           HA       LEU  34  -3.143  12.377  -6.419
  754   1HB   LEU  34          1HB       LEU  34  -2.498  13.678  -4.821
  755   2HB   LEU  34          2HB       LEU  34  -1.990  14.704  -6.146
  756    HG   LEU  34           HG       LEU  34  -4.593  14.952  -4.671
  757   1HD1  LEU  34          1HD1      LEU  34  -3.619  16.759  -3.342
  758   2HD1  LEU  34          2HD1      LEU  34  -2.568  15.350  -3.165
  759   3HD1  LEU  34          3HD1      LEU  34  -2.091  16.658  -4.247
  760   1HD2  LEU  34          1HD2      LEU  34  -3.158  17.000  -6.370
  761   2HD2  LEU  34          2HD2      LEU  34  -4.606  16.077  -6.831
  762   3HD2  LEU  34          3HD2      LEU  34  -4.694  17.246  -5.504
  763    H    GLN  35           H        GLN  35  -5.813  14.375  -7.714
  764    HA   GLN  35           HA       GLN  35  -7.800  13.596  -5.860
  765   1HB   GLN  35          1HB       GLN  35  -8.122  15.283  -7.560
  766   2HB   GLN  35          2HB       GLN  35  -8.023  14.096  -8.860
  767   1HG   GLN  35          1HG       GLN  35 -10.143  14.089  -6.660
  768   2HG   GLN  35          2HG       GLN  35 -10.337  14.966  -8.169
  769   1HE2  GLN  35          2HE2      GLN  35 -12.043  12.802  -7.135
  770   2HE2  GLN  35          1HE2      GLN  35 -11.972  11.506  -8.322
  771    H    LYS  36           H        LYS  36  -6.369  11.703  -8.528
  772    HA   LYS  36           HA       LYS  36  -8.313   9.560  -8.412
  773   1HB   LYS  36          1HB       LYS  36  -5.405   9.486  -9.374
  774   2HB   LYS  36          2HB       LYS  36  -6.651   8.284  -9.725
  775   1HG   LYS  36          1HG       LYS  36  -7.965  10.001 -10.952
  776   2HG   LYS  36          2HG       LYS  36  -6.692  11.198 -10.638
  777   1HD   LYS  36          1HD       LYS  36  -5.049   9.728 -11.814
  778   2HD   LYS  36          2HD       LYS  36  -6.359   8.620 -12.238
  779   1HE   LYS  36          1HE       LYS  36  -6.185  11.568 -13.030
  780   2HE   LYS  36          2HE       LYS  36  -5.722  10.215 -14.064
  781   1HZ   LYS  36          1HZ       LYS  36  -8.034   9.436 -13.971
  782   2HZ   LYS  36          2HZ       LYS  36  -8.465  10.716 -13.044
  783   3HZ   LYS  36          3HZ       LYS  36  -7.959  10.949 -14.575
  784    H    ILE  37           H        ILE  37  -5.257  10.125  -6.718
  785    HA   ILE  37           HA       ILE  37  -5.309   7.608  -5.219
  786    HB   ILE  37           HB       ILE  37  -3.992  10.288  -4.634
  787   1HG1  ILE  37          1HG1      ILE  37  -2.778   7.799  -5.795
  788   2HG1  ILE  37          2HG1      ILE  37  -3.093   9.346  -6.611
  789   1HG2  ILE  37          1HG2      ILE  37  -4.264   9.174  -2.513
  790   2HG2  ILE  37          2HG2      ILE  37  -3.815   7.602  -3.215
  791   3HG2  ILE  37          3HG2      ILE  37  -2.606   8.862  -2.980
  792   1HD1  ILE  37          1HD1      ILE  37  -1.490  10.438  -4.991
  793   2HD1  ILE  37          2HD1      ILE  37  -1.003   8.788  -4.504
  794   3HD1  ILE  37          3HD1      ILE  37  -0.776   9.321  -6.165
  795    H    LEU  38           H        LEU  38  -6.442  11.021  -4.334
  796    HA   LEU  38           HA       LEU  38  -7.644  10.224  -1.926
  797   1HB   LEU  38          1HB       LEU  38  -8.453  12.388  -3.910
  798   2HB   LEU  38          2HB       LEU  38  -9.376  12.048  -2.464
  799    HG   LEU  38           HG       LEU  38  -7.039  12.279  -1.239
  800   1HD1  LEU  38          1HD1      LEU  38  -5.583  12.718  -3.059
  801   2HD1  LEU  38          2HD1      LEU  38  -6.684  13.944  -3.753
  802   3HD1  LEU  38          3HD1      LEU  38  -5.808  14.272  -2.254
  803   1HD2  LEU  38          1HD2      LEU  38  -8.680  14.662  -2.203
  804   2HD2  LEU  38          2HD2      LEU  38  -9.051  13.641  -0.793
  805   3HD2  LEU  38          3HD2      LEU  38  -7.597  14.645  -0.790
  806    H    GLU  39           H        GLU  39  -9.085   9.895  -5.216
  807    HA   GLU  39           HA       GLU  39 -11.584   8.939  -4.177
  808   1HB   GLU  39          1HB       GLU  39 -11.138   9.983  -6.440
  809   2HB   GLU  39          2HB       GLU  39 -10.327   8.493  -6.931
  810   1HG   GLU  39          1HG       GLU  39 -12.458   7.249  -6.598
  811   2HG   GLU  39          2HG       GLU  39 -13.250   8.748  -6.098
  812    H    ASP  40           H        ASP  40  -8.673   7.192  -5.265
  813    HA   ASP  40           HA       ASP  40  -9.623   4.526  -4.817
  814   1HB   ASP  40          1HB       ASP  40  -7.000   6.036  -5.025
  815   2HB   ASP  40          2HB       ASP  40  -6.964   4.445  -4.434
  816    H    GLU  41           H        GLU  41  -8.183   7.004  -2.655
  817    HA   GLU  41           HA       GLU  41  -7.841   5.067  -0.468
  818   1HB   GLU  41          1HB       GLU  41  -7.735   8.102  -0.372
  819   2HB   GLU  41          2HB       GLU  41  -7.374   7.016   0.960
  820   1HG   GLU  41          1HG       GLU  41  -5.652   7.596  -1.453
  821   2HG   GLU  41          2HG       GLU  41  -5.317   7.881   0.223
  822    H    GLU  42           H        GLU  42 -10.280   7.532  -1.325
  823    HA   GLU  42           HA       GLU  42 -11.972   7.087   0.934
  824   1HB   GLU  42          1HB       GLU  42 -12.154   8.980  -0.663
  825   2HB   GLU  42          2HB       GLU  42 -12.775   7.869  -1.895
  826   1HG   GLU  42          1HG       GLU  42 -14.730   7.366  -0.485
  827   2HG   GLU  42          2HG       GLU  42 -14.058   8.322   0.838
  828    H    LYS  43           H        LYS  43 -11.667   5.278  -2.135
  829    HA   LYS  43           HA       LYS  43 -13.868   3.483  -1.618
  830   1HB   LYS  43          1HB       LYS  43 -12.214   3.892  -3.789
  831   2HB   LYS  43          2HB       LYS  43 -11.545   2.401  -3.150
  832   1HG   LYS  43          1HG       LYS  43 -13.163   1.739  -4.721
  833   2HG   LYS  43          2HG       LYS  43 -13.962   1.500  -3.160
  834   1HD   LYS  43          1HD       LYS  43 -15.173   3.660  -3.455
  835   2HD   LYS  43          2HD       LYS  43 -14.316   3.924  -4.988
  836   1HE   LYS  43          1HE       LYS  43 -15.305   1.804  -5.875
  837   2HE   LYS  43          2HE       LYS  43 -16.202   1.604  -4.364
  838   1HZ   LYS  43          1HZ       LYS  43 -17.340   3.713  -4.846
  839   2HZ   LYS  43          2HZ       LYS  43 -16.510   3.888  -6.244
  840   3HZ   LYS  43          3HZ       LYS  43 -17.568   2.660  -6.071
  841    H    HIS  44           H        HIS  44 -10.333   3.227  -0.696
  842    HA   HIS  44           HA       HIS  44 -10.534   0.714   0.543
  843   1HB   HIS  44          1HB       HIS  44  -8.828   3.157   1.226
  844   2HB   HIS  44          2HB       HIS  44  -8.564   1.505   1.673
  845    HD2  HIS  44           2HD      HIS  44  -9.467   0.809  -1.629
  846    HE1  HIS  44           1HE      HIS  44  -5.498   2.175  -2.234
  847    HE2  HIS  44           2HE      HIS  44  -7.511   1.042  -3.312
  848    H    ILE  45           H        ILE  45 -10.953   4.025   1.862
  849    HA   ILE  45           HA       ILE  45 -11.607   3.253   4.527
  850    HB   ILE  45           HB       ILE  45 -11.819   5.701   2.806
  851   1HG1  ILE  45          1HG1      ILE  45 -10.847   6.807   4.790
  852   2HG1  ILE  45          2HG1      ILE  45 -10.977   5.308   5.705
  853   1HG2  ILE  45          1HG2      ILE  45 -14.097   5.780   3.628
  854   2HG2  ILE  45          2HG2      ILE  45 -13.544   5.538   5.302
  855   3HG2  ILE  45          3HG2      ILE  45 -13.127   7.016   4.411
  856   1HD1  ILE  45          1HD1      ILE  45  -9.323   4.250   4.164
  857   2HD1  ILE  45          2HD1      ILE  45  -9.215   5.792   3.274
  858   3HD1  ILE  45          3HD1      ILE  45  -8.695   5.706   4.955
  859    H    GLU  46           H        GLU  46 -13.842   3.630   1.683
  860    HA   GLU  46           HA       GLU  46 -16.234   3.027   3.069
  861   1HB   GLU  46          1HB       GLU  46 -15.247   2.561   0.248
  862   2HB   GLU  46          2HB       GLU  46 -16.744   1.825   0.759
  863   1HG   GLU  46          1HG       GLU  46 -16.185   4.796   0.904
  864   2HG   GLU  46          2HG       GLU  46 -16.977   3.977  -0.446
  865    H    TRP  47           H        TRP  47 -13.839   0.734   1.669
  866    HA   TRP  47           HA       TRP  47 -15.391  -1.571   2.424
  867   1HB   TRP  47          1HB       TRP  47 -12.419  -1.383   1.790
  868   2HB   TRP  47          2HB       TRP  47 -13.432  -2.798   1.689
  869    HD1  TRP  47           1HD      TRP  47 -15.728  -1.062  -0.102
  870    HE1  TRP  47           1HE      TRP  47 -15.184  -0.626  -2.589
  871    HE3  TRP  47           3HE      TRP  47 -10.735  -2.043  -0.027
  872    HZ2  TRP  47           2HZ      TRP  47 -12.888  -0.853  -4.344
  873    HZ3  TRP  47           3HZ      TRP  47  -9.364  -1.967  -2.101
  874    HH2  TRP  47           2HH      TRP  47 -10.439  -1.350  -4.271
  875    H    LEU  48           H        LEU  48 -12.630   0.109   3.852
  876    HA   LEU  48           HA       LEU  48 -12.075  -1.647   6.023
  877   1HB   LEU  48          1HB       LEU  48 -11.706   1.297   5.397
  878   2HB   LEU  48          2HB       LEU  48 -11.214   0.711   6.950
  879    HG   LEU  48           HG       LEU  48 -10.207  -0.561   4.372
  880   1HD1  LEU  48          1HD1      LEU  48  -9.610   1.844   4.389
  881   2HD1  LEU  48          2HD1      LEU  48  -8.891   1.644   5.992
  882   3HD1  LEU  48          3HD1      LEU  48  -8.198   0.807   4.594
  883   1HD2  LEU  48          1HD2      LEU  48  -9.122  -0.525   7.228
  884   2HD2  LEU  48          2HD2      LEU  48  -9.914  -1.908   6.442
  885   3HD2  LEU  48          3HD2      LEU  48  -8.363  -1.321   5.839
  886    H    GLU  49           H        GLU  49 -14.223   1.216   5.880
  887    HA   GLU  49           HA       GLU  49 -15.268   0.846   8.566
  888   1HB   GLU  49          1HB       GLU  49 -15.404   2.860   6.759
  889   2HB   GLU  49          2HB       GLU  49 -16.949   2.122   6.404
  890   1HG   GLU  49          1HG       GLU  49 -15.974   3.081   9.137
  891   2HG   GLU  49          2HG       GLU  49 -17.028   3.991   8.064
  892    H    THR  50           H        THR  50 -16.249  -0.312   5.319
  893    HA   THR  50           HA       THR  50 -18.625  -1.655   6.205
  894    HB   THR  50           HB       THR  50 -16.785  -2.189   3.862
  895    HG1  THR  50           1HG      THR  50 -17.799  -0.282   3.681
  896   1HG2  THR  50          1HG2      THR  50 -17.989  -4.216   4.200
  897   2HG2  THR  50          2HG2      THR  50 -19.518  -3.313   4.441
  898   3HG2  THR  50          3HG2      THR  50 -18.706  -3.325   2.843
  899    H    ILE  51           H        ILE  51 -15.294  -2.726   6.281
  900    HA   ILE  51           HA       ILE  51 -15.949  -5.398   7.230
  901    HB   ILE  51           HB       ILE  51 -13.516  -3.949   6.343
  902   1HG1  ILE  51          1HG1      ILE  51 -12.922  -6.215   5.466
  903   2HG1  ILE  51          2HG1      ILE  51 -14.328  -6.897   6.284
  904   1HG2  ILE  51          1HG2      ILE  51 -12.693  -4.435   8.585
  905   2HG2  ILE  51          2HG2      ILE  51 -13.115  -6.162   8.369
  906   3HG2  ILE  51          3HG2      ILE  51 -11.875  -5.398   7.352
  907   1HD1  ILE  51          1HD1      ILE  51 -15.806  -5.504   4.844
  908   2HD1  ILE  51          2HD1      ILE  51 -14.355  -4.847   4.040
  909   3HD1  ILE  51          3HD1      ILE  51 -14.744  -6.572   3.907
  910    H    ASN  52           H        ASN  52 -15.442  -2.453   8.778
  911    HA   ASN  52           HA       ASN  52 -14.719  -3.433  11.408
  912   1HB   ASN  52          1HB       ASN  52 -14.346  -1.093  10.585
  913   2HB   ASN  52          2HB       ASN  52 -16.095  -0.838  10.604
  914   1HD2  ASN  52          2HD2      ASN  52 -16.047   0.825  12.157
  915   2HD2  ASN  52          1HD2      ASN  52 -15.573   0.512  13.823
  916    H    GLY  53           H        GLY  53 -15.982  -3.836  13.222
  917   1HA   GLY  53          1HA       GLY  53 -18.653  -3.483  13.771
  918   2HA   GLY  53          2HA       GLY  53 -18.657  -4.941  12.778
  Start of MODEL   15
    1   1H    MET   1          1H        MET   1   6.916  20.923  -4.967
    2   2H    MET   1          2H        MET   1   8.405  20.809  -5.630
    3   3H    MET   1          3H        MET   1   7.134  20.031  -6.320
    4    HA   MET   1           HA       MET   1   6.875  18.634  -4.376
    5   1HB   MET   1          1HB       MET   1   8.764  17.161  -4.715
    6   2HB   MET   1          2HB       MET   1   8.140  17.746  -6.250
    7   1HG   MET   1          1HG       MET   1  10.062  19.420  -6.294
    8   2HG   MET   1          2HG       MET   1  10.682  18.638  -4.839
    9   1HE   MET   1          1HE       MET   1   9.170  17.269  -8.332
   10   2HE   MET   1          2HE       MET   1  10.320  18.584  -8.674
   11   3HE   MET   1          3HE       MET   1  10.716  16.915  -9.131
   12    H    ASP   2           H        ASP   2   7.109  18.422  -2.229
   13    HA   ASP   2           HA       ASP   2   9.489  19.422  -0.806
   14   1HB   ASP   2          1HB       ASP   2   8.134  21.475  -1.067
   15   2HB   ASP   2          2HB       ASP   2   6.741  20.664  -0.359
   16    H    TYR   3           H        TYR   3   6.118  18.266  -0.371
   17    HA   TYR   3           HA       TYR   3   6.905  16.761   2.059
   18   1HB   TYR   3          1HB       TYR   3   4.388  16.836   2.446
   19   2HB   TYR   3          2HB       TYR   3   5.215  18.380   2.449
   20    HD1  TYR   3           1HD      TYR   3   4.612  20.128   0.951
   21    HD2  TYR   3           2HD      TYR   3   3.114  16.132   0.260
   22    HE1  TYR   3           1HE      TYR   3   3.160  20.979  -0.875
   23    HE2  TYR   3           2HE      TYR   3   1.685  16.991  -1.567
   24    HH   TYR   3           HH       TYR   3   1.011  18.836  -2.753
   25    H    LEU   4           H        LEU   4   6.607  15.985  -1.101
   26    HA   LEU   4           HA       LEU   4   4.718  13.847  -1.125
   27   1HB   LEU   4          1HB       LEU   4   4.927  14.250  -3.267
   28   2HB   LEU   4          2HB       LEU   4   6.258  15.327  -2.959
   29    HG   LEU   4           HG       LEU   4   7.746  13.196  -3.024
   30   1HD1  LEU   4          1HD1      LEU   4   5.852  11.530  -3.118
   31   2HD1  LEU   4          2HD1      LEU   4   5.336  12.251  -4.655
   32   3HD1  LEU   4          3HD1      LEU   4   6.906  11.429  -4.535
   33   1HD2  LEU   4          1HD2      LEU   4   6.419  14.547  -5.378
   34   2HD2  LEU   4          2HD2      LEU   4   7.989  14.902  -4.634
   35   3HD2  LEU   4          3HD2      LEU   4   7.780  13.416  -5.568
   36    H    ARG   5           H        ARG   5   8.273  13.745  -0.684
   37    HA   ARG   5           HA       ARG   5   8.398  10.885  -0.438
   38   1HB   ARG   5          1HB       ARG   5  10.652  11.197   0.367
   39   2HB   ARG   5          2HB       ARG   5  10.320  12.236  -1.001
   40   1HG   ARG   5          1HG       ARG   5  11.509  13.669   0.308
   41   2HG   ARG   5          2HG       ARG   5   9.878  14.108   0.813
   42   1HD   ARG   5          1HD       ARG   5  10.158  12.653   2.838
   43   2HD   ARG   5          2HD       ARG   5  11.780  12.217   2.273
   44    HE   ARG   5           HE       ARG   5  11.658  15.039   2.379
   45   1HH1  ARG   5          1HH2      ARG   5  11.559  12.419   4.702
   46   2HH1  ARG   5          2HH2      ARG   5  12.244  13.399   5.970
   47   1HH2  ARG   5          1HH1      ARG   5  12.542  16.224   4.035
   48   2HH2  ARG   5          2HH1      ARG   5  12.789  15.493   5.592
   49    H    GLU   6           H        GLU   6   7.572  13.325   1.927
   50    HA   GLU   6           HA       GLU   6   7.696  11.543   4.234
   51   1HB   GLU   6          1HB       GLU   6   7.825  14.061   4.329
   52   2HB   GLU   6          2HB       GLU   6   6.123  14.137   3.880
   53   1HG   GLU   6          1HG       GLU   6   5.482  12.895   5.901
   54   2HG   GLU   6          2HG       GLU   6   7.178  12.634   6.316
   55    H    LEU   7           H        LEU   7   5.130  12.675   2.041
   56    HA   LEU   7           HA       LEU   7   3.062  11.173   3.260
   57   1HB   LEU   7          1HB       LEU   7   1.713  12.336   1.996
   58   2HB   LEU   7          2HB       LEU   7   3.143  13.204   1.495
   59    HG   LEU   7           HG       LEU   7   3.304  11.472  -0.385
   60   1HD1  LEU   7          1HD1      LEU   7   1.533   9.882   0.437
   61   2HD1  LEU   7          2HD1      LEU   7   0.344  11.177   0.260
   62   3HD1  LEU   7          3HD1      LEU   7   1.203  10.528  -1.158
   63   1HD2  LEU   7          1HD2      LEU   7   0.937  13.406  -0.362
   64   2HD2  LEU   7          2HD2      LEU   7   2.612  13.875  -0.681
   65   3HD2  LEU   7          3HD2      LEU   7   1.774  12.792  -1.806
   66    H    TYR   8           H        TYR   8   5.125  10.312   0.518
   67    HA   TYR   8           HA       TYR   8   4.108   7.786  -0.260
   68   1HB   TYR   8          1HB       TYR   8   6.158   9.440  -0.925
   69   2HB   TYR   8          2HB       TYR   8   7.089   8.411   0.081
   70    HD1  TYR   8           1HD      TYR   8   7.679   9.107  -2.704
   71    HD2  TYR   8           2HD      TYR   8   5.464   5.772  -1.082
   72    HE1  TYR   8           1HE      TYR   8   8.435   7.687  -4.594
   73    HE2  TYR   8           2HE      TYR   8   6.297   4.347  -2.944
   74    HH   TYR   8           HH       TYR   8   8.479   5.558  -5.466
   75    H    LYS   9           H        LYS   9   6.429   8.506   2.359
   76    HA   LYS   9           HA       LYS   9   6.802   5.779   3.147
   77   1HB   LYS   9          1HB       LYS   9   7.166   8.450   4.575
   78   2HB   LYS   9          2HB       LYS   9   7.275   6.955   5.504
   79   1HG   LYS   9          1HG       LYS   9   9.047   6.116   3.995
   80   2HG   LYS   9          2HG       LYS   9   9.011   7.653   3.102
   81   1HD   LYS   9          1HD       LYS   9   9.673   8.886   5.113
   82   2HD   LYS   9          2HD       LYS   9   9.529   7.420   6.107
   83   1HE   LYS   9          1HE       LYS   9  11.327   6.343   4.761
   84   2HE   LYS   9          2HE       LYS   9  11.518   7.837   3.832
   85   1HZ   LYS   9          1HZ       LYS   9  12.135   8.962   5.914
   86   2HZ   LYS   9          2HZ       LYS   9  11.937   7.584   6.770
   87   3HZ   LYS   9          3HZ       LYS   9  13.126   7.691   5.661
   88    H    LEU  10           H        LEU  10   4.531   8.067   4.675
   89    HA   LEU  10           HA       LEU  10   3.341   6.025   6.203
   90   1HB   LEU  10          1HB       LEU  10   1.465   7.696   6.563
   91   2HB   LEU  10          2HB       LEU  10   3.093   8.035   7.110
   92    HG   LEU  10           HG       LEU  10   3.189   9.339   4.738
   93   1HD1  LEU  10          1HD1      LEU  10   0.827   8.840   4.189
   94   2HD1  LEU  10          2HD1      LEU  10   0.324   9.624   5.706
   95   3HD1  LEU  10          3HD1      LEU  10   1.096  10.575   4.421
   96   1HD2  LEU  10          1HD2      LEU  10   2.025  10.545   7.255
   97   2HD2  LEU  10          2HD2      LEU  10   3.748  10.149   7.033
   98   3HD2  LEU  10          3HD2      LEU  10   3.006  11.328   5.978
   99    H    GLU  11           H        GLU  11   2.575   7.113   2.911
  100    HA   GLU  11           HA       GLU  11   0.413   5.327   2.405
  101   1HB   GLU  11          1HB       GLU  11   2.382   6.967   0.942
  102   2HB   GLU  11          2HB       GLU  11   2.047   5.597   0.018
  103   1HG   GLU  11          1HG       GLU  11  -0.070   7.475   1.218
  104   2HG   GLU  11          2HG       GLU  11   0.650   7.682  -0.365
  105    H    GLN  12           H        GLN  12   4.008   4.584   2.306
  106    HA   GLN  12           HA       GLN  12   3.368   1.841   1.590
  107   1HB   GLN  12          1HB       GLN  12   5.900   3.366   2.196
  108   2HB   GLN  12          2HB       GLN  12   5.877   1.612   1.916
  109   1HG   GLN  12          1HG       GLN  12   4.706   1.931  -0.212
  110   2HG   GLN  12          2HG       GLN  12   4.753   3.677  -0.009
  111   1HE2  GLN  12          2HE2      GLN  12   7.172   4.512   0.510
  112   2HE2  GLN  12          1HE2      GLN  12   8.395   3.815  -0.543
  113    H    GLN  13           H        GLN  13   3.925   3.454   4.615
  114    HA   GLN  13           HA       GLN  13   4.444   1.075   6.156
  115   1HB   GLN  13          1HB       GLN  13   3.207   3.773   6.860
  116   2HB   GLN  13          2HB       GLN  13   3.363   2.493   8.060
  117   1HG   GLN  13          1HG       GLN  13   5.735   3.610   6.506
  118   2HG   GLN  13          2HG       GLN  13   5.223   4.185   8.090
  119   1HE2  GLN  13          2HE2      GLN  13   5.335   2.632   9.946
  120   2HE2  GLN  13          1HE2      GLN  13   6.470   1.296   9.833
  121    H    ALA  14           H        ALA  14   1.340   2.466   4.978
  122    HA   ALA  14           HA       ALA  14  -0.282   0.544   6.458
  123   1HB   ALA  14          1HB       ALA  14  -1.192   2.680   5.506
  124   2HB   ALA  14          2HB       ALA  14  -0.848   2.093   3.868
  125   3HB   ALA  14          3HB       ALA  14  -2.050   1.261   4.879
  126    H    MET  15           H        MET  15   1.313   0.561   3.270
  127    HA   MET  15           HA       MET  15   0.156  -1.935   2.326
  128   1HB   MET  15          1HB       MET  15   2.795  -0.511   1.613
  129   2HB   MET  15          2HB       MET  15   2.218  -1.949   0.823
  130   1HG   MET  15          1HG       MET  15   0.031  -0.195   0.652
  131   2HG   MET  15          2HG       MET  15   1.439   0.844   0.430
  132   1HE   MET  15          1HE       MET  15   0.840  -3.003  -0.550
  133   2HE   MET  15          2HE       MET  15  -0.664  -2.078  -0.682
  134   3HE   MET  15          3HE       MET  15   0.107  -2.734  -2.147
  135    H    LYS  16           H        LYS  16   3.252  -1.186   4.074
  136    HA   LYS  16           HA       LYS  16   4.221  -3.887   3.994
  137   1HB   LYS  16          1HB       LYS  16   5.378  -1.545   4.609
  138   2HB   LYS  16          2HB       LYS  16   4.900  -1.982   6.246
  139   1HG   LYS  16          1HG       LYS  16   7.106  -2.803   6.019
  140   2HG   LYS  16          2HG       LYS  16   6.102  -4.243   5.813
  141   1HD   LYS  16          1HD       LYS  16   6.332  -3.940   3.284
  142   2HD   LYS  16          2HD       LYS  16   7.358  -2.543   3.602
  143   1HE   LYS  16          1HE       LYS  16   8.849  -4.298   3.139
  144   2HE   LYS  16          2HE       LYS  16   8.926  -4.063   4.887
  145   1HZ   LYS  16          1HZ       LYS  16   7.434  -5.996   5.124
  146   2HZ   LYS  16          2HZ       LYS  16   7.372  -6.190   3.497
  147   3HZ   LYS  16          3HZ       LYS  16   8.775  -6.417   4.296
  148    H    LEU  17           H        LEU  17   2.305  -2.132   6.423
  149    HA   LEU  17           HA       LEU  17   1.876  -4.328   8.195
  150   1HB   LEU  17          1HB       LEU  17   1.013  -1.591   7.862
  151   2HB   LEU  17          2HB       LEU  17  -0.427  -2.519   8.055
  152    HG   LEU  17           HG       LEU  17   2.027  -2.793   9.849
  153   1HD1  LEU  17          1HD1      LEU  17   1.245  -0.496   9.935
  154   2HD1  LEU  17          2HD1      LEU  17  -0.416  -1.041  10.280
  155   3HD1  LEU  17          3HD1      LEU  17   0.901  -1.325  11.454
  156   1HD2  LEU  17          1HD2      LEU  17  -0.903  -3.537  10.326
  157   2HD2  LEU  17          2HD2      LEU  17   0.413  -4.684  10.003
  158   3HD2  LEU  17          3HD2      LEU  17   0.422  -3.734  11.494
  159    H    TYR  18           H        TYR  18   0.056  -3.282   5.286
  160    HA   TYR  18           HA       TYR  18  -1.946  -5.267   5.459
  161   1HB   TYR  18          1HB       TYR  18  -0.972  -3.376   3.399
  162   2HB   TYR  18          2HB       TYR  18  -1.731  -4.792   2.763
  163    HD1  TYR  18           1HD      TYR  18  -3.935  -5.476   4.366
  164    HD2  TYR  18           2HD      TYR  18  -2.479  -1.541   3.414
  165    HE1  TYR  18           1HE      TYR  18  -6.253  -4.633   4.440
  166    HE2  TYR  18           2HE      TYR  18  -4.827  -0.646   3.738
  167    HH   TYR  18           HH       TYR  18  -6.938  -1.075   4.187
  168    H    ARG  19           H        ARG  19   1.315  -5.524   4.033
  169    HA   ARG  19           HA       ARG  19   1.011  -8.077   2.803
  170   1HB   ARG  19          1HB       ARG  19   2.936  -6.348   2.730
  171   2HB   ARG  19          2HB       ARG  19   3.569  -7.123   4.170
  172   1HG   ARG  19          1HG       ARG  19   2.963  -8.792   1.697
  173   2HG   ARG  19          2HG       ARG  19   4.343  -7.713   1.697
  174   1HD   ARG  19          1HD       ARG  19   5.215  -9.800   2.270
  175   2HD   ARG  19          2HD       ARG  19   5.217  -8.854   3.766
  176    HE   ARG  19           HE       ARG  19   2.780 -10.321   3.617
  177   1HH1  ARG  19          1HH2      ARG  19   6.171 -11.144   4.108
  178   2HH1  ARG  19          2HH2      ARG  19   5.738 -12.529   5.081
  179   1HH2  ARG  19          1HH1      ARG  19   2.354 -11.993   4.824
  180   2HH2  ARG  19          2HH1      ARG  19   3.602 -13.021   5.491
  181    H    GLU  20           H        GLU  20   1.780  -7.281   6.192
  182    HA   GLU  20           HA       GLU  20   1.940 -10.087   7.017
  183   1HB   GLU  20          1HB       GLU  20   2.909  -7.828   8.080
  184   2HB   GLU  20          2HB       GLU  20   1.378  -7.799   8.924
  185   1HG   GLU  20          1HG       GLU  20   1.794 -10.124   9.763
  186   2HG   GLU  20          2HG       GLU  20   3.361 -10.120   8.951
  187    H    ALA  21           H        ALA  21  -0.468  -7.516   7.294
  188    HA   ALA  21           HA       ALA  21  -2.544  -8.936   8.580
  189   1HB   ALA  21          1HB       ALA  21  -2.578  -6.500   8.043
  190   2HB   ALA  21          2HB       ALA  21  -2.911  -6.923   6.340
  191   3HB   ALA  21          3HB       ALA  21  -4.076  -7.345   7.594
  192    H    SER  22           H        SER  22  -1.678  -9.004   5.087
  193    HA   SER  22           HA       SER  22  -3.693 -10.780   4.196
  194   1HB   SER  22          1HB       SER  22  -2.060  -9.488   2.783
  195   2HB   SER  22          2HB       SER  22  -0.814 -10.666   3.226
  196    HG   SER  22           HG       SER  22  -2.215 -12.298   2.354
  197    H    GLU  23           H        GLU  23  -0.714 -11.545   6.037
  198    HA   GLU  23           HA       GLU  23  -1.017 -14.452   5.670
  199   1HB   GLU  23          1HB       GLU  23   1.121 -13.031   6.144
  200   2HB   GLU  23          2HB       GLU  23   0.609 -13.088   7.824
  201   1HG   GLU  23          1HG       GLU  23   0.615 -15.568   7.744
  202   2HG   GLU  23          2HG       GLU  23   1.097 -15.515   6.046
  203    H    LYS  24           H        LYS  24  -1.648 -12.066   8.251
  204    HA   LYS  24           HA       LYS  24  -2.881 -13.829  10.151
  205   1HB   LYS  24          1HB       LYS  24  -3.228 -10.857   9.617
  206   2HB   LYS  24          2HB       LYS  24  -4.028 -11.700  10.944
  207   1HG   LYS  24          1HG       LYS  24  -1.899 -12.352  11.928
  208   2HG   LYS  24          2HG       LYS  24  -0.999 -11.632  10.576
  209   1HD   LYS  24          1HD       LYS  24  -1.807  -9.419  11.116
  210   2HD   LYS  24          2HD       LYS  24  -2.888 -10.050  12.366
  211   1HE   LYS  24          1HE       LYS  24   0.106 -10.479  12.546
  212   2HE   LYS  24          2HE       LYS  24  -0.613  -8.948  13.043
  213   1HZ   LYS  24          1HZ       LYS  24  -1.978 -10.097  14.662
  214   2HZ   LYS  24          2HZ       LYS  24  -1.424 -11.570  14.174
  215   3HZ   LYS  24          3HZ       LYS  24  -0.425 -10.507  14.902
  216    H    ALA  25           H        ALA  25  -4.184 -12.261   7.300
  217    HA   ALA  25           HA       ALA  25  -6.916 -13.276   7.790
  218   1HB   ALA  25          1HB       ALA  25  -6.375 -10.805   7.411
  219   2HB   ALA  25          2HB       ALA  25  -6.016 -11.239   5.724
  220   3HB   ALA  25          3HB       ALA  25  -7.631 -11.518   6.404
  221    H    ARG  26           H        ARG  26  -4.928 -15.133   6.883
  222    HA   ARG  26           HA       ARG  26  -4.801 -15.837   4.248
  223   1HB   ARG  26          1HB       ARG  26  -4.410 -18.094   4.948
  224   2HB   ARG  26          2HB       ARG  26  -3.634 -16.995   6.069
  225   1HG   ARG  26          1HG       ARG  26  -6.349 -18.266   6.663
  226   2HG   ARG  26          2HG       ARG  26  -4.831 -19.086   6.993
  227   1HD   ARG  26          1HD       ARG  26  -4.123 -17.368   8.540
  228   2HD   ARG  26          2HD       ARG  26  -5.561 -16.389   8.199
  229    HE   ARG  26           HE       ARG  26  -6.691 -18.728   8.988
  230   1HH1  ARG  26          1HH2      ARG  26  -4.281 -16.729  10.560
  231   2HH1  ARG  26          2HH2      ARG  26  -4.800 -17.201  12.156
  232   1HH2  ARG  26          1HH1      ARG  26  -7.345 -19.230  11.048
  233   2HH2  ARG  26          2HH1      ARG  26  -6.504 -18.564  12.415
  234    H    ASN  27           H        ASN  27  -7.786 -16.007   6.012
  235    HA   ASN  27           HA       ASN  27  -9.212 -17.885   4.393
  236   1HB   ASN  27          1HB       ASN  27  -9.816 -17.085   6.699
  237   2HB   ASN  27          2HB       ASN  27 -10.216 -15.506   6.024
  238   1HD2  ASN  27          2HD2      ASN  27 -12.442 -15.317   5.975
  239   2HD2  ASN  27          1HD2      ASN  27 -13.519 -16.625   5.511
  240    HA   PRO  28           HA       PRO  28  -9.206 -15.442   0.708
  241   1HB   PRO  28          1HB       PRO  28 -11.107 -16.672  -0.857
  242   2HB   PRO  28          2HB       PRO  28  -9.484 -17.336  -0.505
  243   1HG   PRO  28          1HG       PRO  28 -12.099 -17.964   0.890
  244   2HG   PRO  28          2HG       PRO  28 -10.858 -19.111   0.289
  245   1HD   PRO  28          1HD       PRO  28 -10.967 -18.372   2.885
  246   2HD   PRO  28          2HD       PRO  28  -9.387 -18.587   2.071
  247    H    GLU  29           H        GLU  29 -12.195 -15.653   2.504
  248    HA   GLU  29           HA       GLU  29 -13.788 -13.709   1.207
  249   1HB   GLU  29          1HB       GLU  29 -14.147 -15.297   3.315
  250   2HB   GLU  29          2HB       GLU  29 -13.578 -13.915   4.221
  251   1HG   GLU  29          1HG       GLU  29 -15.940 -13.784   4.250
  252   2HG   GLU  29          2HG       GLU  29 -15.407 -12.523   3.146
  253    H    LYS  30           H        LYS  30 -11.113 -13.356   3.390
  254    HA   LYS  30           HA       LYS  30 -11.159 -10.390   3.291
  255   1HB   LYS  30          1HB       LYS  30 -10.322 -12.277   5.283
  256   2HB   LYS  30          2HB       LYS  30  -8.860 -11.553   4.646
  257   1HG   LYS  30          1HG       LYS  30  -9.476 -10.189   6.467
  258   2HG   LYS  30          2HG       LYS  30  -9.940  -9.256   5.041
  259   1HD   LYS  30          1HD       LYS  30 -12.302  -9.942   5.351
  260   2HD   LYS  30          2HD       LYS  30 -11.822 -11.029   6.672
  261   1HE   LYS  30          1HE       LYS  30 -10.884  -9.005   7.884
  262   2HE   LYS  30          2HE       LYS  30 -11.622  -7.986   6.642
  263   1HZ   LYS  30          1HZ       LYS  30 -13.794  -8.915   7.287
  264   2HZ   LYS  30          2HZ       LYS  30 -13.098  -9.871   8.415
  265   3HZ   LYS  30          3HZ       LYS  30 -13.066  -8.255   8.600
  266    H    LYS  31           H        LYS  31  -8.852 -13.032   2.559
  267    HA   LYS  31           HA       LYS  31  -6.890 -11.609   1.328
  268   1HB   LYS  31          1HB       LYS  31  -7.509 -14.306   1.682
  269   2HB   LYS  31          2HB       LYS  31  -7.446 -14.162  -0.068
  270   1HG   LYS  31          1HG       LYS  31  -5.258 -13.555   1.954
  271   2HG   LYS  31          2HG       LYS  31  -5.335 -14.893   0.805
  272   1HD   LYS  31          1HD       LYS  31  -5.266 -13.098  -1.058
  273   2HD   LYS  31          2HD       LYS  31  -4.838 -11.955   0.238
  274   1HE   LYS  31          1HE       LYS  31  -3.025 -13.768   0.856
  275   2HE   LYS  31          2HE       LYS  31  -3.309 -14.376  -0.777
  276   1HZ   LYS  31          1HZ       LYS  31  -2.768 -12.077  -1.570
  277   2HZ   LYS  31          2HZ       LYS  31  -2.400 -11.654  -0.018
  278   3HZ   LYS  31          3HZ       LYS  31  -1.510 -12.779  -0.795
  279    H    SER  32           H        SER  32  -9.940 -12.292  -0.180
  280    HA   SER  32           HA       SER  32  -9.046 -11.077  -2.741
  281   1HB   SER  32          1HB       SER  32 -11.778 -12.251  -2.102
  282   2HB   SER  32          2HB       SER  32 -11.093 -11.900  -3.696
  283    HG   SER  32           HG       SER  32 -10.422 -13.934  -1.853
  284    H    VAL  33           H        VAL  33 -10.018  -9.764   0.021
  285    HA   VAL  33           HA       VAL  33 -11.565  -7.529  -1.259
  286    HB   VAL  33           HB       VAL  33 -11.714  -8.666   1.547
  287   1HG1  VAL  33          1HG1      VAL  33 -11.731  -6.237   1.838
  288   2HG1  VAL  33          2HG1      VAL  33 -12.910  -6.057   0.516
  289   3HG1  VAL  33          3HG1      VAL  33 -13.365  -6.870   2.030
  290   1HG2  VAL  33          1HG2      VAL  33 -13.815  -8.153  -0.615
  291   2HG2  VAL  33          2HG2      VAL  33 -13.119  -9.737  -0.216
  292   3HG2  VAL  33          3HG2      VAL  33 -14.103  -8.885   0.979
  293    H    LEU  34           H        LEU  34  -8.917  -8.240   1.200
  294    HA   LEU  34           HA       LEU  34  -8.080  -5.452   1.024
  295   1HB   LEU  34          1HB       LEU  34  -6.466  -5.830   2.450
  296   2HB   LEU  34          2HB       LEU  34  -7.594  -7.077   2.968
  297    HG   LEU  34           HG       LEU  34  -5.275  -7.459   1.110
  298   1HD1  LEU  34          1HD1      LEU  34  -4.101  -6.989   2.993
  299   2HD1  LEU  34          2HD1      LEU  34  -5.344  -7.654   4.105
  300   3HD1  LEU  34          3HD1      LEU  34  -4.258  -8.715   3.188
  301   1HD2  LEU  34          1HD2      LEU  34  -6.937  -9.256   0.922
  302   2HD2  LEU  34          2HD2      LEU  34  -5.441  -9.865   1.634
  303   3HD2  LEU  34          3HD2      LEU  34  -6.838  -9.527   2.685
  304    H    GLN  35           H        GLN  35  -7.763  -8.173  -1.111
  305    HA   GLN  35           HA       GLN  35  -5.461  -7.476  -2.554
  306   1HB   GLN  35          1HB       GLN  35  -7.529  -9.348  -2.766
  307   2HB   GLN  35          2HB       GLN  35  -7.714  -8.404  -4.232
  308   1HG   GLN  35          1HG       GLN  35  -5.319  -8.802  -4.789
  309   2HG   GLN  35          2HG       GLN  35  -5.122  -9.702  -3.281
  310   1HE2  GLN  35          2HE2      GLN  35  -4.334 -11.387  -4.934
  311   2HE2  GLN  35          1HE2      GLN  35  -5.578 -12.442  -5.590
  312    H    LYS  36           H        LYS  36  -8.725  -6.037  -2.795
  313    HA   LYS  36           HA       LYS  36  -8.040  -4.572  -5.212
  314   1HB   LYS  36          1HB       LYS  36 -10.386  -5.421  -4.433
  315   2HB   LYS  36          2HB       LYS  36 -10.389  -4.045  -3.344
  316   1HG   LYS  36          1HG       LYS  36 -11.610  -3.277  -5.143
  317   2HG   LYS  36          2HG       LYS  36 -10.026  -2.595  -5.491
  318   1HD   LYS  36          1HD       LYS  36 -11.248  -5.099  -6.755
  319   2HD   LYS  36          2HD       LYS  36 -11.169  -3.494  -7.489
  320   1HE   LYS  36          1HE       LYS  36  -8.646  -3.613  -7.322
  321   2HE   LYS  36          2HE       LYS  36  -8.820  -5.294  -6.790
  322   1HZ   LYS  36          1HZ       LYS  36  -9.862  -5.809  -8.908
  323   2HZ   LYS  36          2HZ       LYS  36  -9.704  -4.255  -9.416
  324   3HZ   LYS  36          3HZ       LYS  36  -8.366  -5.160  -9.115
  325    H    ILE  37           H        ILE  37  -8.141  -3.717  -1.798
  326    HA   ILE  37           HA       ILE  37  -7.134  -0.990  -2.088
  327    HB   ILE  37           HB       ILE  37  -7.033  -3.137   0.050
  328   1HG1  ILE  37          1HG1      ILE  37  -8.139  -0.533   0.851
  329   2HG1  ILE  37          2HG1      ILE  37  -9.016  -1.267  -0.462
  330   1HG2  ILE  37          1HG2      ILE  37  -4.932  -1.920   0.400
  331   2HG2  ILE  37          2HG2      ILE  37  -5.789  -0.361   0.244
  332   3HG2  ILE  37          3HG2      ILE  37  -6.089  -1.419   1.628
  333   1HD1  ILE  37          1HD1      ILE  37  -9.399  -3.300   0.832
  334   2HD1  ILE  37          2HD1      ILE  37  -8.321  -2.725   2.122
  335   3HD1  ILE  37          3HD1      ILE  37  -9.859  -1.897   1.824
  336    H    LEU  38           H        LEU  38  -5.395  -4.189  -1.701
  337    HA   LEU  38           HA       LEU  38  -2.804  -3.097  -1.841
  338   1HB   LEU  38          1HB       LEU  38  -3.908  -5.783  -2.722
  339   2HB   LEU  38          2HB       LEU  38  -2.205  -5.405  -2.856
  340    HG   LEU  38           HG       LEU  38  -3.712  -5.332  -0.205
  341   1HD1  LEU  38          1HD1      LEU  38  -3.661  -7.619  -1.142
  342   2HD1  LEU  38          2HD1      LEU  38  -1.904  -7.486  -1.383
  343   3HD1  LEU  38          3HD1      LEU  38  -2.593  -7.476   0.258
  344   1HD2  LEU  38          1HD2      LEU  38  -0.768  -5.164  -0.953
  345   2HD2  LEU  38          2HD2      LEU  38  -1.748  -3.979  -0.047
  346   3HD2  LEU  38          3HD2      LEU  38  -1.340  -5.534   0.679
  347    H    GLU  39           H        GLU  39  -4.861  -4.083  -4.646
  348    HA   GLU  39           HA       GLU  39  -2.878  -3.314  -6.584
  349   1HB   GLU  39          1HB       GLU  39  -5.908  -3.679  -6.719
  350   2HB   GLU  39          2HB       GLU  39  -4.947  -3.235  -8.134
  351   1HG   GLU  39          1HG       GLU  39  -3.660  -5.287  -8.009
  352   2HG   GLU  39          2HG       GLU  39  -4.446  -5.748  -6.501
  353    H    ASP  40           H        ASP  40  -5.557  -1.435  -5.151
  354    HA   ASP  40           HA       ASP  40  -5.153   0.967  -6.670
  355   1HB   ASP  40          1HB       ASP  40  -6.391   0.074  -4.047
  356   2HB   ASP  40          2HB       ASP  40  -6.220   1.740  -4.340
  357    H    GLU  41           H        GLU  41  -3.619  -0.334  -3.708
  358    HA   GLU  41           HA       GLU  41  -2.312   2.242  -3.116
  359   1HB   GLU  41          1HB       GLU  41  -1.798  -0.519  -1.950
  360   2HB   GLU  41          2HB       GLU  41  -0.984   0.964  -1.459
  361   1HG   GLU  41          1HG       GLU  41  -3.847   0.189  -0.845
  362   2HG   GLU  41          2HG       GLU  41  -2.532   0.401   0.257
  363    H    GLU  42           H        GLU  42  -1.360  -0.840  -4.655
  364    HA   GLU  42           HA       GLU  42   1.302  -0.059  -5.327
  365   1HB   GLU  42          1HB       GLU  42   0.375  -2.353  -5.531
  366   2HB   GLU  42          2HB       GLU  42  -0.590  -1.831  -6.920
  367   1HG   GLU  42          1HG       GLU  42   1.457  -1.313  -8.181
  368   2HG   GLU  42          2HG       GLU  42   2.451  -1.650  -6.761
  369    H    LYS  43           H        LYS  43  -1.802   0.721  -6.922
  370    HA   LYS  43           HA       LYS  43  -0.621   2.119  -9.148
  371   1HB   LYS  43          1HB       LYS  43  -3.242   1.430  -8.418
  372   2HB   LYS  43          2HB       LYS  43  -3.245   3.175  -8.260
  373   1HG   LYS  43          1HG       LYS  43  -3.914   2.684 -10.495
  374   2HG   LYS  43          2HG       LYS  43  -2.237   3.245 -10.618
  375   1HD   LYS  43          1HD       LYS  43  -1.519   0.801 -10.598
  376   2HD   LYS  43          2HD       LYS  43  -3.224   0.349 -10.676
  377   1HE   LYS  43          1HE       LYS  43  -3.488   1.276 -12.855
  378   2HE   LYS  43          2HE       LYS  43  -2.021   2.257 -12.704
  379   1HZ   LYS  43          1HZ       LYS  43  -0.691   0.275 -12.732
  380   2HZ   LYS  43          2HZ       LYS  43  -2.010  -0.703 -12.869
  381   3HZ   LYS  43          3HZ       LYS  43  -1.613   0.311 -14.092
  382    H    HIS  44           H        HIS  44  -1.564   3.388  -5.848
  383    HA   HIS  44           HA       HIS  44  -0.878   6.062  -6.395
  384   1HB   HIS  44          1HB       HIS  44  -0.684   4.405  -3.831
  385   2HB   HIS  44          2HB       HIS  44  -0.728   6.134  -3.995
  386    HD2  HIS  44           2HD      HIS  44  -3.199   5.498  -6.380
  387    HE1  HIS  44           1HE      HIS  44  -5.470   4.824  -2.874
  388    HE2  HIS  44           2HE      HIS  44  -5.546   5.069  -5.401
  389    H    ILE  45           H        ILE  45   1.054   3.310  -5.159
  390    HA   ILE  45           HA       ILE  45   3.515   4.743  -4.919
  391    HB   ILE  45           HB       ILE  45   2.649   1.860  -4.933
  392   1HG1  ILE  45          1HG1      ILE  45   4.036   1.894  -2.800
  393   2HG1  ILE  45          2HG1      ILE  45   4.306   3.609  -3.069
  394   1HG2  ILE  45          1HG2      ILE  45   4.624   1.692  -6.334
  395   2HG2  ILE  45          2HG2      ILE  45   5.560   2.691  -5.189
  396   3HG2  ILE  45          3HG2      ILE  45   4.977   1.074  -4.725
  397   1HD1  ILE  45          1HD1      ILE  45   1.841   4.001  -2.817
  398   2HD1  ILE  45          2HD1      ILE  45   1.666   2.261  -2.453
  399   3HD1  ILE  45          3HD1      ILE  45   2.614   3.301  -1.390
  400    H    GLU  46           H        GLU  46   2.148   3.015  -7.836
  401    HA   GLU  46           HA       GLU  46   4.379   3.446  -9.524
  402   1HB   GLU  46          1HB       GLU  46   1.379   3.353 -10.050
  403   2HB   GLU  46          2HB       GLU  46   2.514   3.792 -11.301
  404   1HG   GLU  46          1HG       GLU  46   3.752   1.641 -10.818
  405   2HG   GLU  46          2HG       GLU  46   2.349   1.170  -9.836
  406    H    TRP  47           H        TRP  47   1.658   5.681  -8.809
  407    HA   TRP  47           HA       TRP  47   2.671   7.726 -10.556
  408   1HB   TRP  47          1HB       TRP  47   0.714   7.984  -8.246
  409   2HB   TRP  47          2HB       TRP  47   0.868   9.037  -9.631
  410    HD1  TRP  47           1HD      TRP  47   0.853   6.322 -11.682
  411    HE1  TRP  47           1HE      TRP  47  -1.418   5.170 -12.104
  412    HE3  TRP  47           3HE      TRP  47  -1.805   8.343  -7.855
  413    HZ2  TRP  47           2HZ      TRP  47  -4.103   5.272 -11.005
  414    HZ3  TRP  47           3HZ      TRP  47  -4.216   7.863  -7.540
  415    HH2  TRP  47           2HH      TRP  47  -5.377   6.286  -9.106
  416    H    LEU  48           H        LEU  48   2.821   7.245  -7.031
  417    HA   LEU  48           HA       LEU  48   4.219   9.589  -6.283
  418   1HB   LEU  48          1HB       LEU  48   4.017   6.749  -5.251
  419   2HB   LEU  48          2HB       LEU  48   5.066   7.849  -4.437
  420    HG   LEU  48           HG       LEU  48   2.117   8.440  -4.891
  421   1HD1  LEU  48          1HD1      LEU  48   2.367   6.418  -3.496
  422   2HD1  LEU  48          2HD1      LEU  48   3.487   7.282  -2.428
  423   3HD1  LEU  48          3HD1      LEU  48   1.783   7.784  -2.536
  424   1HD2  LEU  48          1HD2      LEU  48   4.136   9.648  -2.949
  425   2HD2  LEU  48          2HD2      LEU  48   3.501  10.442  -4.408
  426   3HD2  LEU  48          3HD2      LEU  48   2.414  10.067  -3.074
  427    H    GLU  49           H        GLU  49   5.562   6.429  -7.327
  428    HA   GLU  49           HA       GLU  49   8.305   7.339  -7.323
  429   1HB   GLU  49          1HB       GLU  49   7.170   4.905  -7.601
  430   2HB   GLU  49          2HB       GLU  49   7.393   5.240  -9.300
  431   1HG   GLU  49          1HG       GLU  49   9.560   5.283  -7.145
  432   2HG   GLU  49          2HG       GLU  49   9.245   3.944  -8.238
  433    H    THR  50           H        THR  50   5.812   7.228  -9.939
  434    HA   THR  50           HA       THR  50   7.467   8.345 -11.977
  435    HB   THR  50           HB       THR  50   4.516   8.162 -11.463
  436    HG1  THR  50           1HG      THR  50   4.682   6.769 -13.173
  437   1HG2  THR  50          1HG2      THR  50   4.603  10.238 -12.671
  438   2HG2  THR  50          2HG2      THR  50   5.727   9.532 -13.868
  439   3HG2  THR  50          3HG2      THR  50   4.045   8.942 -13.737
  440    H    ILE  51           H        ILE  51   5.975   9.931  -9.288
  441    HA   ILE  51           HA       ILE  51   6.514  12.626 -10.371
  442    HB   ILE  51           HB       ILE  51   4.895  11.572  -8.034
  443   1HG1  ILE  51          1HG1      ILE  51   3.997  13.183 -10.478
  444   2HG1  ILE  51          2HG1      ILE  51   4.032  11.431 -10.472
  445   1HG2  ILE  51          1HG2      ILE  51   5.799  13.703  -7.290
  446   2HG2  ILE  51          2HG2      ILE  51   5.290  14.497  -8.795
  447   3HG2  ILE  51          3HG2      ILE  51   4.092  13.886  -7.626
  448   1HD1  ILE  51          1HD1      ILE  51   2.475  11.454  -8.469
  449   2HD1  ILE  51          2HD1      ILE  51   2.269  13.200  -8.750
  450   3HD1  ILE  51          3HD1      ILE  51   1.801  12.037 -10.000
  451    H    ASN  52           H        ASN  52   8.095  10.471  -8.369
  452    HA   ASN  52           HA       ASN  52   9.392  12.331  -6.578
  453   1HB   ASN  52          1HB       ASN  52   8.874   9.903  -6.127
  454   2HB   ASN  52          2HB       ASN  52  10.186   9.470  -7.224
  455   1HD2  ASN  52          2HD2      ASN  52  11.650   8.583  -5.751
  456   2HD2  ASN  52          1HD2      ASN  52  12.249   9.457  -4.349
  457    H    GLY  53           H        GLY  53   9.827  12.964  -9.457
  458   1HA   GLY  53          1HA       GLY  53  11.769  14.461  -9.875
  459   2HA   GLY  53          2HA       GLY  53  12.836  13.109  -9.516
  460   1H    MET   1          1H        MET   1 -10.705  -9.004  17.839
  461   2H    MET   1          2H        MET   1 -10.038  -9.777  16.563
  462   3H    MET   1          3H        MET   1 -11.496  -9.058  16.404
  463    HA   MET   1           HA       MET   1  -9.790  -7.723  15.344
  464   1HB   MET   1          1HB       MET   1 -11.027  -6.508  17.850
  465   2HB   MET   1          2HB       MET   1 -10.091  -5.579  16.675
  466   1HG   MET   1          1HG       MET   1 -11.665  -6.171  14.882
  467   2HG   MET   1          2HG       MET   1 -12.596  -7.162  16.004
  468   1HE   MET   1          1HE       MET   1 -11.052  -3.435  16.393
  469   2HE   MET   1          2HE       MET   1 -11.746  -3.556  14.756
  470   3HE   MET   1          3HE       MET   1 -12.515  -2.521  15.975
  471    H    ASP   2           H        ASP   2  -7.693  -7.406  15.222
  472    HA   ASP   2           HA       ASP   2  -5.994  -6.978  17.618
  473   1HB   ASP   2          1HB       ASP   2  -5.990  -9.379  17.484
  474   2HB   ASP   2          2HB       ASP   2  -5.773  -9.357  15.741
  475    H    TYR   3           H        TYR   3  -6.256  -7.108  14.059
  476    HA   TYR   3           HA       TYR   3  -3.954  -5.225  13.823
  477   1HB   TYR   3          1HB       TYR   3  -3.203  -6.563  11.923
  478   2HB   TYR   3          2HB       TYR   3  -3.318  -7.550  13.362
  479    HD1  TYR   3           1HD      TYR   3  -5.084  -9.271  13.596
  480    HD2  TYR   3           2HD      TYR   3  -4.652  -6.985   9.966
  481    HE1  TYR   3           1HE      TYR   3  -6.575 -10.873  12.424
  482    HE2  TYR   3           2HE      TYR   3  -6.113  -8.622   8.778
  483    HH   TYR   3           HH       TYR   3  -7.601 -11.420  10.468
  484    H    LEU   4           H        LEU   4  -7.194  -5.104  13.307
  485    HA   LEU   4           HA       LEU   4  -7.143  -4.185  10.527
  486   1HB   LEU   4          1HB       LEU   4  -8.997  -5.428  10.704
  487   2HB   LEU   4          2HB       LEU   4  -9.052  -5.301  12.447
  488    HG   LEU   4           HG       LEU   4 -10.066  -3.072  12.263
  489   1HD1  LEU   4          1HD1      LEU   4  -9.514  -2.517   9.844
  490   2HD1  LEU   4          2HD1      LEU   4 -10.527  -3.870   9.330
  491   3HD1  LEU   4          3HD1      LEU   4 -11.252  -2.467  10.144
  492   1HD2  LEU   4          1HD2      LEU   4 -11.601  -5.364  10.978
  493   2HD2  LEU   4          2HD2      LEU   4 -11.387  -5.086  12.720
  494   3HD2  LEU   4          3HD2      LEU   4 -12.317  -3.934  11.755
  495    H    ARG   5           H        ARG   5  -7.826  -2.765  13.760
  496    HA   ARG   5           HA       ARG   5  -8.442  -0.120  12.925
  497   1HB   ARG   5          1HB       ARG   5  -7.837  -1.524  15.408
  498   2HB   ARG   5          2HB       ARG   5  -6.927  -0.020  15.389
  499   1HG   ARG   5          1HG       ARG   5  -8.975   1.273  14.998
  500   2HG   ARG   5          2HG       ARG   5  -9.930  -0.226  14.903
  501   1HD   ARG   5          1HD       ARG   5  -9.323  -0.794  17.213
  502   2HD   ARG   5          2HD       ARG   5  -8.311   0.659  17.333
  503    HE   ARG   5           HE       ARG   5 -10.798   1.647  16.635
  504   1HH1  ARG   5          1HH2      ARG   5  -9.677  -0.300  19.329
  505   2HH1  ARG   5          2HH2      ARG   5 -10.905   0.316  20.401
  506   1HH2  ARG   5          1HH1      ARG   5 -12.326   2.402  18.067
  507   2HH2  ARG   5          2HH1      ARG   5 -12.354   1.808  19.701
  508    H    GLU   6           H        GLU   6  -5.330  -1.636  13.464
  509    HA   GLU   6           HA       GLU   6  -3.631   0.615  13.228
  510   1HB   GLU   6          1HB       GLU   6  -3.223  -1.873  14.031
  511   2HB   GLU   6          2HB       GLU   6  -2.896  -2.198  12.339
  512   1HG   GLU   6          1HG       GLU   6  -0.787  -1.771  13.294
  513   2HG   GLU   6          2HG       GLU   6  -1.176  -0.268  12.460
  514    H    LEU   7           H        LEU   7  -5.032  -1.457  10.726
  515    HA   LEU   7           HA       LEU   7  -3.529  -0.470   8.456
  516   1HB   LEU   7          1HB       LEU   7  -6.322  -1.728   8.622
  517   2HB   LEU   7          2HB       LEU   7  -5.396  -1.526   7.149
  518    HG   LEU   7           HG       LEU   7  -4.578  -3.215   9.503
  519   1HD1  LEU   7          1HD1      LEU   7  -5.181  -5.152   8.133
  520   2HD1  LEU   7          2HD1      LEU   7  -6.587  -4.098   8.356
  521   3HD1  LEU   7          3HD1      LEU   7  -5.706  -4.071   6.824
  522   1HD2  LEU   7          1HD2      LEU   7  -3.377  -3.058   6.744
  523   2HD2  LEU   7          2HD2      LEU   7  -2.639  -2.510   8.275
  524   3HD2  LEU   7          3HD2      LEU   7  -2.943  -4.231   8.017
  525    H    TYR   8           H        TYR   8  -6.795   0.191   9.623
  526    HA   TYR   8           HA       TYR   8  -7.667   2.205   7.867
  527   1HB   TYR   8          1HB       TYR   8  -8.604   0.769  10.044
  528   2HB   TYR   8          2HB       TYR   8  -8.364   2.263  10.846
  529    HD1  TYR   8           1HD      TYR   8  -9.302   4.264   8.720
  530    HD2  TYR   8           2HD      TYR   8 -10.906   0.477  10.041
  531    HE1  TYR   8           1HE      TYR   8 -11.586   5.003   8.095
  532    HE2  TYR   8           2HE      TYR   8 -13.190   1.239   9.432
  533    HH   TYR   8           HH       TYR   8 -14.468   2.969   8.615
  534    H    LYS   9           H        LYS   9  -5.958   2.665  10.993
  535    HA   LYS   9           HA       LYS   9  -6.132   5.503  10.824
  536   1HB   LYS   9          1HB       LYS   9  -5.604   3.931  12.880
  537   2HB   LYS   9          2HB       LYS   9  -3.929   4.052  12.358
  538   1HG   LYS   9          1HG       LYS   9  -4.242   5.663  14.069
  539   2HG   LYS   9          2HG       LYS   9  -4.154   6.592  12.569
  540   1HD   LYS   9          1HD       LYS   9  -6.630   6.780  12.529
  541   2HD   LYS   9          2HD       LYS   9  -6.753   5.786  13.980
  542   1HE   LYS   9          1HE       LYS   9  -5.329   8.483  13.820
  543   2HE   LYS   9          2HE       LYS   9  -7.003   8.265  14.334
  544   1HZ   LYS   9          1HZ       LYS   9  -6.199   6.870  16.169
  545   2HZ   LYS   9          2HZ       LYS   9  -4.644   7.116  15.725
  546   3HZ   LYS   9          3HZ       LYS   9  -5.552   8.363  16.250
  547    H    LEU  10           H        LEU  10  -3.383   3.480   9.811
  548    HA   LEU  10           HA       LEU  10  -1.854   5.643   8.806
  549   1HB   LEU  10          1HB       LEU  10  -1.934   2.681   8.194
  550   2HB   LEU  10          2HB       LEU  10  -0.844   3.769   7.333
  551    HG   LEU  10           HG       LEU  10  -0.835   3.592  10.370
  552   1HD1  LEU  10          1HD1      LEU  10  -0.364   1.378   9.438
  553   2HD1  LEU  10          2HD1      LEU  10   0.863   2.069   8.355
  554   3HD1  LEU  10          3HD1      LEU  10   1.106   2.098  10.117
  555   1HD2  LEU  10          1HD2      LEU  10   1.211   4.575   8.316
  556   2HD2  LEU  10          2HD2      LEU  10   0.262   5.601   9.411
  557   3HD2  LEU  10          3HD2      LEU  10   1.466   4.494  10.075
  558    H    GLU  11           H        GLU  11  -4.284   3.525   7.303
  559    HA   GLU  11           HA       GLU  11  -4.416   4.652   4.717
  560   1HB   GLU  11          1HB       GLU  11  -6.131   3.065   6.563
  561   2HB   GLU  11          2HB       GLU  11  -7.056   3.816   5.375
  562   1HG   GLU  11          1HG       GLU  11  -4.662   1.944   4.899
  563   2HG   GLU  11          2HG       GLU  11  -6.340   1.480   4.862
  564    H    GLN  12           H        GLN  12  -5.923   5.994   7.754
  565    HA   GLN  12           HA       GLN  12  -6.920   8.243   6.194
  566   1HB   GLN  12          1HB       GLN  12  -6.996   7.466   9.115
  567   2HB   GLN  12          2HB       GLN  12  -7.605   9.021   8.510
  568   1HG   GLN  12          1HG       GLN  12  -9.036   7.839   6.885
  569   2HG   GLN  12          2HG       GLN  12  -8.513   6.301   7.543
  570   1HE2  GLN  12          2HE2      GLN  12 -11.207   8.047   7.534
  571   2HE2  GLN  12          1HE2      GLN  12 -11.735   7.845   9.197
  572    H    GLN  13           H        GLN  13  -4.026   7.725   8.070
  573    HA   GLN  13           HA       GLN  13  -3.381  10.554   8.272
  574   1HB   GLN  13          1HB       GLN  13  -1.766   7.992   8.440
  575   2HB   GLN  13          2HB       GLN  13  -0.917   9.523   8.213
  576   1HG   GLN  13          1HG       GLN  13  -2.055  10.473  10.205
  577   2HG   GLN  13          2HG       GLN  13  -2.828   8.914  10.504
  578   1HE2  GLN  13          2HE2      GLN  13  -0.007  10.814  11.121
  579   2HE2  GLN  13          1HE2      GLN  13   0.967   9.512  11.786
  580    H    ALA  14           H        ALA  14  -2.979   8.218   5.585
  581    HA   ALA  14           HA       ALA  14  -1.523  10.138   3.921
  582   1HB   ALA  14          1HB       ALA  14  -1.512   7.684   3.494
  583   2HB   ALA  14          2HB       ALA  14  -3.264   7.721   3.193
  584   3HB   ALA  14          3HB       ALA  14  -2.152   8.583   2.105
  585    H    MET  15           H        MET  15  -4.963   9.339   4.412
  586    HA   MET  15           HA       MET  15  -6.074  11.069   2.392
  587   1HB   MET  15          1HB       MET  15  -7.274   9.226   3.543
  588   2HB   MET  15          2HB       MET  15  -7.285  10.150   5.038
  589   1HG   MET  15          1HG       MET  15  -9.012  11.428   4.420
  590   2HG   MET  15          2HG       MET  15  -8.371  11.718   2.806
  591   1HE   MET  15          1HE       MET  15  -8.934  10.530   0.718
  592   2HE   MET  15          2HE       MET  15  -8.020   9.164   1.384
  593   3HE   MET  15          3HE       MET  15  -9.607   8.890   0.627
  594    H    LYS  16           H        LYS  16  -5.328  11.687   5.864
  595    HA   LYS  16           HA       LYS  16  -6.332  14.384   5.858
  596   1HB   LYS  16          1HB       LYS  16  -5.840  12.736   7.788
  597   2HB   LYS  16          2HB       LYS  16  -4.160  13.237   7.650
  598   1HG   LYS  16          1HG       LYS  16  -4.545  15.184   8.754
  599   2HG   LYS  16          2HG       LYS  16  -5.951  15.583   7.774
  600   1HD   LYS  16          1HD       LYS  16  -5.998  13.652  10.131
  601   2HD   LYS  16          2HD       LYS  16  -6.454  15.363  10.202
  602   1HE   LYS  16          1HE       LYS  16  -8.231  14.977   8.511
  603   2HE   LYS  16          2HE       LYS  16  -7.804  13.263   8.441
  604   1HZ   LYS  16          1HZ       LYS  16  -8.414  13.086  10.799
  605   2HZ   LYS  16          2HZ       LYS  16  -8.813  14.670  10.858
  606   3HZ   LYS  16          3HZ       LYS  16  -9.678  13.645   9.933
  607    H    LEU  17           H        LEU  17  -3.036  13.066   5.337
  608    HA   LEU  17           HA       LEU  17  -1.833  15.595   4.802
  609   1HB   LEU  17          1HB       LEU  17  -1.081  12.832   4.792
  610   2HB   LEU  17          2HB       LEU  17  -0.678  13.404   3.198
  611    HG   LEU  17           HG       LEU  17   0.013  14.814   5.810
  612   1HD1  LEU  17          1HD1      LEU  17   1.081  12.649   5.715
  613   2HD1  LEU  17          2HD1      LEU  17   1.773  13.012   4.112
  614   3HD1  LEU  17          3HD1      LEU  17   2.295  13.929   5.545
  615   1HD2  LEU  17          1HD2      LEU  17   1.152  15.207   2.993
  616   2HD2  LEU  17          2HD2      LEU  17   0.105  16.354   3.853
  617   3HD2  LEU  17          3HD2      LEU  17   1.732  16.028   4.459
  618    H    TYR  18           H        TYR  18  -3.434  13.294   2.604
  619    HA   TYR  18           HA       TYR  18  -3.110  14.705   0.220
  620   1HB   TYR  18          1HB       TYR  18  -4.918  12.549   1.233
  621   2HB   TYR  18          2HB       TYR  18  -5.417  13.342  -0.211
  622    HD1  TYR  18           1HD      TYR  18  -3.247  13.829  -1.874
  623    HD2  TYR  18           2HD      TYR  18  -3.828  10.481   0.754
  624    HE1  TYR  18           1HE      TYR  18  -1.567  12.506  -3.184
  625    HE2  TYR  18           2HE      TYR  18  -2.156   9.170  -0.538
  626    HH   TYR  18           HH       TYR  18  -0.697   9.169  -2.330
  627    H    ARG  19           H        ARG  19  -5.686  15.216   2.674
  628    HA   ARG  19           HA       ARG  19  -7.184  17.171   1.181
  629   1HB   ARG  19          1HB       ARG  19  -6.699  16.778   4.163
  630   2HB   ARG  19          2HB       ARG  19  -7.688  18.095   3.531
  631   1HG   ARG  19          1HG       ARG  19  -9.238  16.544   2.484
  632   2HG   ARG  19          2HG       ARG  19  -8.234  15.160   2.928
  633   1HD   ARG  19          1HD       ARG  19 -10.162  15.389   4.457
  634   2HD   ARG  19          2HD       ARG  19  -8.624  15.540   5.295
  635    HE   ARG  19           HE       ARG  19  -9.112  17.721   5.870
  636   1HH1  ARG  19          1HH2      ARG  19 -11.472  16.822   3.435
  637   2HH1  ARG  19          2HH2      ARG  19 -12.388  18.286   3.667
  638   1HH2  ARG  19          1HH1      ARG  19 -10.325  19.553   6.104
  639   2HH2  ARG  19          2HH1      ARG  19 -11.752  19.782   5.140
  640    H    GLU  20           H        GLU  20  -4.336  17.625   3.291
  641    HA   GLU  20           HA       GLU  20  -4.297  20.526   2.877
  642   1HB   GLU  20          1HB       GLU  20  -3.314  18.931   4.802
  643   2HB   GLU  20          2HB       GLU  20  -1.879  18.950   3.797
  644   1HG   GLU  20          1HG       GLU  20  -1.859  21.438   3.842
  645   2HG   GLU  20          2HG       GLU  20  -3.321  21.437   4.830
  646    H    ALA  21           H        ALA  21  -2.406  17.819   1.644
  647    HA   ALA  21           HA       ALA  21  -0.718  19.178  -0.177
  648   1HB   ALA  21          1HB       ALA  21  -0.521  16.778   0.353
  649   2HB   ALA  21          2HB       ALA  21  -2.058  16.462  -0.488
  650   3HB   ALA  21          3HB       ALA  21  -0.657  17.035  -1.400
  651    H    SER  22           H        SER  22  -4.145  18.108  -0.690
  652    HA   SER  22           HA       SER  22  -4.366  19.072  -3.362
  653   1HB   SER  22          1HB       SER  22  -5.976  17.541  -2.148
  654   2HB   SER  22          2HB       SER  22  -6.580  18.962  -1.281
  655    HG   SER  22           HG       SER  22  -6.903  18.184  -3.941
  656    H    GLU  23           H        GLU  23  -4.793  20.821  -0.239
  657    HA   GLU  23           HA       GLU  23  -5.736  23.271  -1.438
  658   1HB   GLU  23          1HB       GLU  23  -5.861  22.514   1.018
  659   2HB   GLU  23          2HB       GLU  23  -4.181  22.992   1.145
  660   1HG   GLU  23          1HG       GLU  23  -5.462  24.809   1.966
  661   2HG   GLU  23          2HG       GLU  23  -4.803  25.316   0.419
  662    H    LYS  24           H        LYS  24  -2.528  22.148  -0.376
  663    HA   LYS  24           HA       LYS  24  -0.959  24.402  -1.138
  664   1HB   LYS  24          1HB       LYS  24  -0.494  22.066   0.188
  665   2HB   LYS  24          2HB       LYS  24   0.242  21.642  -1.344
  666   1HG   LYS  24          1HG       LYS  24   0.923  24.022   0.442
  667   2HG   LYS  24          2HG       LYS  24   1.830  22.517   0.310
  668   1HD   LYS  24          1HD       LYS  24   2.300  23.066  -2.111
  669   2HD   LYS  24          2HD       LYS  24   1.525  24.646  -1.846
  670   1HE   LYS  24          1HE       LYS  24   3.125  25.111   0.006
  671   2HE   LYS  24          2HE       LYS  24   3.913  23.558  -0.286
  672   1HZ   LYS  24          1HZ       LYS  24   4.498  24.356  -2.521
  673   2HZ   LYS  24          2HZ       LYS  24   3.775  25.795  -2.240
  674   3HZ   LYS  24          3HZ       LYS  24   5.095  25.365  -1.387
  675    H    ALA  25           H        ALA  25  -1.742  21.472  -2.956
  676    HA   ALA  25           HA       ALA  25  -0.361  22.301  -5.380
  677   1HB   ALA  25          1HB       ALA  25  -0.326  19.982  -4.399
  678   2HB   ALA  25          2HB       ALA  25  -2.052  19.826  -4.804
  679   3HB   ALA  25          3HB       ALA  25  -0.845  20.039  -6.080
  680    H    ARG  26           H        ARG  26  -2.702  23.961  -4.695
  681    HA   ARG  26           HA       ARG  26  -5.027  23.394  -6.071
  682   1HB   ARG  26          1HB       ARG  26  -5.643  25.624  -5.868
  683   2HB   ARG  26          2HB       ARG  26  -4.667  25.248  -4.470
  684   1HG   ARG  26          1HG       ARG  26  -3.680  26.782  -6.931
  685   2HG   ARG  26          2HG       ARG  26  -4.270  27.511  -5.440
  686   1HD   ARG  26          1HD       ARG  26  -2.452  26.404  -4.170
  687   2HD   ARG  26          2HD       ARG  26  -1.788  25.766  -5.689
  688    HE   ARG  26           HE       ARG  26  -1.850  28.355  -6.320
  689   1HH1  ARG  26          1HH2      ARG  26  -0.643  26.903  -3.373
  690   2HH1  ARG  26          2HH2      ARG  26   0.403  28.259  -3.027
  691   1HH2  ARG  26          1HH1      ARG  26  -0.436  29.999  -5.875
  692   2HH2  ARG  26          2HH1      ARG  26   0.550  29.940  -4.444
  693    H    ASN  27           H        ASN  27  -2.093  24.072  -7.701
  694    HA   ASN  27           HA       ASN  27  -3.038  24.954 -10.250
  695   1HB   ASN  27          1HB       ASN  27  -0.678  25.007  -9.450
  696   2HB   ASN  27          2HB       ASN  27  -0.626  23.244  -9.482
  697   1HD2  ASN  27          2HD2      ASN  27   0.229  22.383 -11.363
  698   2HD2  ASN  27          1HD2      ASN  27   0.271  23.243 -12.893
  699    HA   PRO  28           HA       PRO  28  -5.531  21.525 -11.074
  700   1HB   PRO  28          1HB       PRO  28  -6.089  21.692 -13.759
  701   2HB   PRO  28          2HB       PRO  28  -6.696  22.832 -12.521
  702   1HG   PRO  28          1HG       PRO  28  -4.277  23.150 -14.319
  703   2HG   PRO  28          2HG       PRO  28  -5.581  24.338 -13.993
  704   1HD   PRO  28          1HD       PRO  28  -3.208  24.424 -12.690
  705   2HD   PRO  28          2HD       PRO  28  -4.736  24.800 -11.831
  706    H    GLU  29           H        GLU  29  -2.497  21.519 -12.874
  707    HA   GLU  29           HA       GLU  29  -2.700  18.928 -14.061
  708   1HB   GLU  29          1HB       GLU  29  -0.969  20.731 -14.527
  709   2HB   GLU  29          2HB       GLU  29  -0.201  20.308 -13.006
  710   1HG   GLU  29          1HG       GLU  29   1.029  19.180 -14.665
  711   2HG   GLU  29          2HG       GLU  29   0.058  17.929 -13.904
  712    H    LYS  30           H        LYS  30  -1.044  19.850 -11.101
  713    HA   LYS  30           HA       LYS  30  -0.781  17.210  -9.935
  714   1HB   LYS  30          1HB       LYS  30   0.285  19.680  -9.421
  715   2HB   LYS  30          2HB       LYS  30  -0.971  19.671  -8.210
  716   1HG   LYS  30          1HG       LYS  30   1.395  17.786  -8.542
  717   2HG   LYS  30          2HG       LYS  30   1.123  18.951  -7.254
  718   1HD   LYS  30          1HD       LYS  30  -0.761  17.536  -6.398
  719   2HD   LYS  30          2HD       LYS  30  -0.393  16.338  -7.671
  720   1HE   LYS  30          1HE       LYS  30   1.959  16.222  -6.865
  721   2HE   LYS  30          2HE       LYS  30   1.575  17.367  -5.578
  722   1HZ   LYS  30          1HZ       LYS  30   0.397  14.649  -5.875
  723   2HZ   LYS  30          2HZ       LYS  30   1.513  15.084  -4.771
  724   3HZ   LYS  30          3HZ       LYS  30   0.009  15.712  -4.678
  725    H    LYS  31           H        LYS  31  -3.244  19.772  -9.414
  726    HA   LYS  31           HA       LYS  31  -4.712  18.307  -7.515
  727   1HB   LYS  31          1HB       LYS  31  -4.878  20.762  -8.058
  728   2HB   LYS  31          2HB       LYS  31  -5.999  20.324  -9.349
  729   1HG   LYS  31          1HG       LYS  31  -7.669  19.673  -7.870
  730   2HG   LYS  31          2HG       LYS  31  -6.529  19.190  -6.603
  731   1HD   LYS  31          1HD       LYS  31  -5.999  21.487  -6.089
  732   2HD   LYS  31          2HD       LYS  31  -7.091  22.091  -7.347
  733   1HE   LYS  31          1HE       LYS  31  -7.931  20.388  -4.949
  734   2HE   LYS  31          2HE       LYS  31  -7.953  22.150  -4.953
  735   1HZ   LYS  31          1HZ       LYS  31  -9.544  22.077  -6.795
  736   2HZ   LYS  31          2HZ       LYS  31  -9.546  20.439  -6.787
  737   3HZ   LYS  31          3HZ       LYS  31 -10.129  21.265  -5.508
  738    H    SER  32           H        SER  32  -4.704  17.752 -10.918
  739    HA   SER  32           HA       SER  32  -6.986  15.869 -10.669
  740   1HB   SER  32          1HB       SER  32  -6.766  17.611 -12.543
  741   2HB   SER  32          2HB       SER  32  -5.473  16.591 -13.200
  742    HG   SER  32           HG       SER  32  -7.556  16.138 -14.104
  743    H    VAL  33           H        VAL  33  -3.768  15.683 -10.191
  744    HA   VAL  33           HA       VAL  33  -3.501  12.827 -11.074
  745    HB   VAL  33           HB       VAL  33  -1.472  14.891 -10.187
  746   1HG1  VAL  33          1HG1      VAL  33  -0.755  12.835  -9.070
  747   2HG1  VAL  33          2HG1      VAL  33  -1.005  11.902 -10.565
  748   3HG1  VAL  33          3HG1      VAL  33   0.265  13.142 -10.474
  749   1HG2  VAL  33          1HG2      VAL  33  -1.653  13.111 -12.662
  750   2HG2  VAL  33          2HG2      VAL  33  -2.207  14.791 -12.601
  751   3HG2  VAL  33          3HG2      VAL  33  -0.492  14.426 -12.372
  752    H    LEU  34           H        LEU  34  -3.061  14.838  -8.025
  753    HA   LEU  34           HA       LEU  34  -3.046  12.423  -6.395
  754   1HB   LEU  34          1HB       LEU  34  -2.533  13.721  -4.720
  755   2HB   LEU  34          2HB       LEU  34  -2.041  14.831  -5.987
  756    HG   LEU  34           HG       LEU  34  -4.706  14.839  -4.603
  757   1HD1  LEU  34          1HD1      LEU  34  -3.920  16.580  -3.139
  758   2HD1  LEU  34          2HD1      LEU  34  -2.603  15.403  -3.128
  759   3HD1  LEU  34          3HD1      LEU  34  -2.458  16.858  -4.107
  760   1HD2  LEU  34          1HD2      LEU  34  -3.398  17.025  -6.227
  761   2HD2  LEU  34          2HD2      LEU  34  -4.770  16.019  -6.750
  762   3HD2  LEU  34          3HD2      LEU  34  -4.963  17.138  -5.393
  763    H    GLN  35           H        GLN  35  -5.652  14.181  -7.851
  764    HA   GLN  35           HA       GLN  35  -7.756  13.387  -6.147
  765   1HB   GLN  35          1HB       GLN  35  -7.943  14.990  -8.030
  766   2HB   GLN  35          2HB       GLN  35  -7.803  13.648  -9.180
  767   1HG   GLN  35          1HG       GLN  35  -9.881  12.654  -8.113
  768   2HG   GLN  35          2HG       GLN  35 -10.021  14.102  -7.122
  769   1HE2  GLN  35          2HE2      GLN  35 -11.510  12.721  -9.587
  770   2HE2  GLN  35          1HE2      GLN  35 -11.864  14.136 -10.594
  771    H    LYS  36           H        LYS  36  -5.957  11.513  -8.616
  772    HA   LYS  36           HA       LYS  36  -7.877   9.344  -8.757
  773   1HB   LYS  36          1HB       LYS  36  -4.877   9.394  -9.416
  774   2HB   LYS  36          2HB       LYS  36  -6.010   8.129  -9.904
  775   1HG   LYS  36          1HG       LYS  36  -7.207   9.668 -11.368
  776   2HG   LYS  36          2HG       LYS  36  -6.274  11.041 -10.773
  777   1HD   LYS  36          1HD       LYS  36  -5.405  10.397 -12.937
  778   2HD   LYS  36          2HD       LYS  36  -4.204  10.126 -11.683
  779   1HE   LYS  36          1HE       LYS  36  -4.090   8.280 -13.190
  780   2HE   LYS  36          2HE       LYS  36  -4.769   7.683 -11.678
  781   1HZ   LYS  36          1HZ       LYS  36  -6.986   7.800 -12.722
  782   2HZ   LYS  36          2HZ       LYS  36  -6.343   8.382 -14.109
  783   3HZ   LYS  36          3HZ       LYS  36  -5.996   6.866 -13.622
  784    H    ILE  37           H        ILE  37  -4.912   9.781  -6.851
  785    HA   ILE  37           HA       ILE  37  -5.202   7.277  -5.353
  786    HB   ILE  37           HB       ILE  37  -3.920   9.956  -4.635
  787   1HG1  ILE  37          1HG1      ILE  37  -1.786   8.236  -4.716
  788   2HG1  ILE  37          2HG1      ILE  37  -2.743   7.648  -6.044
  789   1HG2  ILE  37          1HG2      ILE  37  -4.448   8.846  -2.547
  790   2HG2  ILE  37          2HG2      ILE  37  -4.032   7.251  -3.219
  791   3HG2  ILE  37          3HG2      ILE  37  -2.773   8.394  -2.821
  792   1HD1  ILE  37          1HD1      ILE  37  -2.736   9.938  -7.037
  793   2HD1  ILE  37          2HD1      ILE  37  -1.937  10.569  -5.574
  794   3HD1  ILE  37          3HD1      ILE  37  -1.068   9.465  -6.627
  795    H    LEU  38           H        LEU  38  -6.323  10.699  -4.696
  796    HA   LEU  38           HA       LEU  38  -7.643  10.098  -2.299
  797   1HB   LEU  38          1HB       LEU  38  -8.027  12.155  -4.448
  798   2HB   LEU  38          2HB       LEU  38  -9.295  12.003  -3.256
  799    HG   LEU  38           HG       LEU  38  -6.373  12.470  -2.517
  800   1HD1  LEU  38          1HD1      LEU  38  -7.268  14.366  -3.824
  801   2HD1  LEU  38          2HD1      LEU  38  -8.672  14.461  -2.735
  802   3HD1  LEU  38          3HD1      LEU  38  -7.034  14.805  -2.127
  803   1HD2  LEU  38          1HD2      LEU  38  -7.599  13.310  -0.372
  804   2HD2  LEU  38          2HD2      LEU  38  -9.012  12.455  -0.987
  805   3HD2  LEU  38          3HD2      LEU  38  -7.509  11.564  -0.633
  806    H    GLU  39           H        GLU  39  -9.028   9.606  -5.627
  807    HA   GLU  39           HA       GLU  39 -11.542   8.700  -4.500
  808   1HB   GLU  39          1HB       GLU  39 -10.270   8.464  -7.267
  809   2HB   GLU  39          2HB       GLU  39 -11.849   7.772  -6.882
  810   1HG   GLU  39          1HG       GLU  39 -12.711   9.996  -6.250
  811   2HG   GLU  39          2HG       GLU  39 -11.147  10.724  -6.610
  812    H    ASP  40           H        ASP  40  -8.599   6.944  -5.459
  813    HA   ASP  40           HA       ASP  40  -9.618   4.284  -5.058
  814   1HB   ASP  40          1HB       ASP  40  -6.951   5.738  -5.138
  815   2HB   ASP  40          2HB       ASP  40  -6.987   4.145  -4.585
  816    H    GLU  41           H        GLU  41  -8.205   6.741  -2.872
  817    HA   GLU  41           HA       GLU  41  -7.977   4.807  -0.655
  818   1HB   GLU  41          1HB       GLU  41  -7.709   7.837  -0.664
  819   2HB   GLU  41          2HB       GLU  41  -7.405   6.807   0.733
  820   1HG   GLU  41          1HG       GLU  41  -5.820   6.791  -1.851
  821   2HG   GLU  41          2HG       GLU  41  -5.344   7.578  -0.357
  822    H    GLU  42           H        GLU  42 -10.239   7.398  -1.596
  823    HA   GLU  42           HA       GLU  42 -12.020   7.153   0.619
  824   1HB   GLU  42          1HB       GLU  42 -12.110   8.949  -1.066
  825   2HB   GLU  42          2HB       GLU  42 -12.627   7.786  -2.297
  826   1HG   GLU  42          1HG       GLU  42 -14.700   7.351  -1.047
  827   2HG   GLU  42          2HG       GLU  42 -14.148   8.380   0.278
  828    H    LYS  43           H        LYS  43 -11.695   5.185  -2.351
  829    HA   LYS  43           HA       LYS  43 -13.970   3.509  -1.807
  830   1HB   LYS  43          1HB       LYS  43 -12.309   3.813  -3.977
  831   2HB   LYS  43          2HB       LYS  43 -11.676   2.318  -3.318
  832   1HG   LYS  43          1HG       LYS  43 -13.331   1.676  -4.866
  833   2HG   LYS  43          2HG       LYS  43 -14.130   1.498  -3.295
  834   1HD   LYS  43          1HD       LYS  43 -15.187   3.757  -3.625
  835   2HD   LYS  43          2HD       LYS  43 -14.443   3.857  -5.219
  836   1HE   LYS  43          1HE       LYS  43 -16.393   1.680  -4.322
  837   2HE   LYS  43          2HE       LYS  43 -16.861   3.143  -5.186
  838   1HZ   LYS  43          1HZ       LYS  43 -15.453   2.442  -7.044
  839   2HZ   LYS  43          2HZ       LYS  43 -15.034   1.064  -6.267
  840   3HZ   LYS  43          3HZ       LYS  43 -16.579   1.309  -6.723
  841    H    HIS  44           H        HIS  44 -10.434   2.991  -0.924
  842    HA   HIS  44           HA       HIS  44 -10.790   0.553   0.388
  843   1HB   HIS  44          1HB       HIS  44  -8.945   2.887   1.110
  844   2HB   HIS  44          2HB       HIS  44  -8.794   1.208   1.499
  845    HD2  HIS  44           2HD      HIS  44  -9.648   0.641  -1.821
  846    HE1  HIS  44           1HE      HIS  44  -5.588   1.791  -2.277
  847    HE2  HIS  44           2HE      HIS  44  -7.639   0.818  -3.449
  848    H    ILE  45           H        ILE  45 -10.915   3.898   1.662
  849    HA   ILE  45           HA       ILE  45 -11.615   3.254   4.337
  850    HB   ILE  45           HB       ILE  45 -11.927   5.695   2.537
  851   1HG1  ILE  45          1HG1      ILE  45  -9.649   5.066   3.204
  852   2HG1  ILE  45          2HG1      ILE  45 -10.153   6.644   3.780
  853   1HG2  ILE  45          1HG2      ILE  45 -13.760   5.948   4.049
  854   2HG2  ILE  45          2HG2      ILE  45 -12.756   5.495   5.446
  855   3HG2  ILE  45          3HG2      ILE  45 -12.455   7.022   4.569
  856   1HD1  ILE  45          1HD1      ILE  45 -10.485   5.727   6.043
  857   2HD1  ILE  45          2HD1      ILE  45 -10.012   4.110   5.468
  858   3HD1  ILE  45          3HD1      ILE  45  -8.842   5.437   5.436
  859    H    GLU  46           H        GLU  46 -13.813   3.693   1.523
  860    HA   GLU  46           HA       GLU  46 -16.224   3.382   2.990
  861   1HB   GLU  46          1HB       GLU  46 -15.691   3.939   0.403
  862   2HB   GLU  46          2HB       GLU  46 -15.964   2.213   0.225
  863   1HG   GLU  46          1HG       GLU  46 -18.049   3.159  -0.189
  864   2HG   GLU  46          2HG       GLU  46 -18.199   2.624   1.481
  865    H    TRP  47           H        TRP  47 -14.090   0.872   1.570
  866    HA   TRP  47           HA       TRP  47 -15.787  -1.337   2.350
  867   1HB   TRP  47          1HB       TRP  47 -12.794  -1.317   1.727
  868   2HB   TRP  47          2HB       TRP  47 -13.887  -2.673   1.628
  869    HD1  TRP  47           1HD      TRP  47 -16.056  -0.778  -0.160
  870    HE1  TRP  47           1HE      TRP  47 -15.534  -0.461  -2.655
  871    HE3  TRP  47           3HE      TRP  47 -11.107  -2.119  -0.172
  872    HZ2  TRP  47           2HZ      TRP  47 -13.316  -0.860  -4.443
  873    HZ3  TRP  47           3HZ      TRP  47  -9.836  -2.232  -2.303
  874    HH2  TRP  47           2HH      TRP  47 -10.910  -1.519  -4.430
  875    H    LEU  48           H        LEU  48 -12.899   0.184   3.753
  876    HA   LEU  48           HA       LEU  48 -12.496  -1.499   5.989
  877   1HB   LEU  48          1HB       LEU  48 -11.989   1.398   5.302
  878   2HB   LEU  48          2HB       LEU  48 -11.629   0.878   6.910
  879    HG   LEU  48           HG       LEU  48 -10.521  -0.533   4.465
  880   1HD1  LEU  48          1HD1      LEU  48  -9.747   1.802   4.471
  881   2HD1  LEU  48          2HD1      LEU  48  -9.226   1.642   6.163
  882   3HD1  LEU  48          3HD1      LEU  48  -8.432   0.697   4.877
  883   1HD2  LEU  48          1HD2      LEU  48  -9.638  -0.522   7.391
  884   2HD2  LEU  48          2HD2      LEU  48 -10.428  -1.873   6.554
  885   3HD2  LEU  48          3HD2      LEU  48  -8.812  -1.366   6.065
  886    H    GLU  49           H        GLU  49 -14.669   1.317   5.668
  887    HA   GLU  49           HA       GLU  49 -15.801   1.080   8.305
  888   1HB   GLU  49          1HB       GLU  49 -16.021   2.980   6.483
  889   2HB   GLU  49          2HB       GLU  49 -17.369   2.045   5.871
  890   1HG   GLU  49          1HG       GLU  49 -18.433   2.116   8.141
  891   2HG   GLU  49          2HG       GLU  49 -17.089   3.099   8.723
  892    H    THR  50           H        THR  50 -16.986  -0.256   5.186
  893    HA   THR  50           HA       THR  50 -19.194  -1.685   6.152
  894    HB   THR  50           HB       THR  50 -17.289  -2.331   3.861
  895    HG1  THR  50           1HG      THR  50 -18.144  -0.330   3.532
  896   1HG2  THR  50          1HG2      THR  50 -18.700  -4.234   4.237
  897   2HG2  THR  50          2HG2      THR  50 -20.143  -3.188   4.383
  898   3HG2  THR  50          3HG2      THR  50 -19.288  -3.347   2.819
  899    H    ILE  51           H        ILE  51 -15.820  -2.498   6.336
  900    HA   ILE  51           HA       ILE  51 -16.312  -5.227   7.288
  901    HB   ILE  51           HB       ILE  51 -13.833  -3.668   6.518
  902   1HG1  ILE  51          1HG1      ILE  51 -15.017  -6.220   5.316
  903   2HG1  ILE  51          2HG1      ILE  51 -15.459  -4.618   4.757
  904   1HG2  ILE  51          1HG2      ILE  51 -13.081  -5.132   8.318
  905   2HG2  ILE  51          2HG2      ILE  51 -13.911  -6.520   7.573
  906   3HG2  ILE  51          3HG2      ILE  51 -12.502  -5.762   6.788
  907   1HD1  ILE  51          1HD1      ILE  51 -13.028  -4.170   4.229
  908   2HD1  ILE  51          2HD1      ILE  51 -12.712  -5.892   4.555
  909   3HD1  ILE  51          3HD1      ILE  51 -13.816  -5.423   3.255
  910    H    ASN  52           H        ASN  52 -15.565  -2.232   8.721
  911    HA   ASN  52           HA       ASN  52 -14.609  -3.369  11.255
  912   1HB   ASN  52          1HB       ASN  52 -13.875  -1.147  10.313
  913   2HB   ASN  52          2HB       ASN  52 -15.491  -0.519  10.653
  914   1HD2  ASN  52          2HD2      ASN  52 -14.444   1.078  12.060
  915   2HD2  ASN  52          1HD2      ASN  52 -13.873   0.576  13.644
  916    H    GLY  53           H        GLY  53 -15.649  -3.099  13.314
  917   1HA   GLY  53          1HA       GLY  53 -17.533  -2.701  14.746
  918   2HA   GLY  53          2HA       GLY  53 -18.632  -2.857  13.381
  Start of MODEL   16
    1   1H    MET   1          1H        MET   1   9.431  19.566  -8.351
    2   2H    MET   1          2H        MET   1  10.346  18.865  -7.182
    3   3H    MET   1          3H        MET   1   9.954  20.445  -7.070
    4    HA   MET   1           HA       MET   1   7.632  19.947  -6.775
    5   1HB   MET   1          1HB       MET   1   8.611  17.116  -7.261
    6   2HB   MET   1          2HB       MET   1   7.205  17.389  -6.241
    7   1HG   MET   1          1HG       MET   1   7.417  18.387  -9.095
    8   2HG   MET   1          2HG       MET   1   6.614  16.912  -8.573
    9   1HE   MET   1          1HE       MET   1   6.439  20.834  -8.715
   10   2HE   MET   1          2HE       MET   1   5.705  19.934 -10.063
   11   3HE   MET   1          3HE       MET   1   4.685  20.907  -8.981
   12    H    ASP   2           H        ASP   2   6.666  19.276  -4.740
   13    HA   ASP   2           HA       ASP   2   8.486  18.593  -2.503
   14   1HB   ASP   2          1HB       ASP   2   8.261  21.084  -2.582
   15   2HB   ASP   2          2HB       ASP   2   6.510  20.916  -2.533
   16    H    TYR   3           H        TYR   3   7.066  17.988  -0.552
   17    HA   TYR   3           HA       TYR   3   5.624  16.488   0.330
   18   1HB   TYR   3          1HB       TYR   3   4.300  18.765  -0.468
   19   2HB   TYR   3          2HB       TYR   3   3.234  17.532  -1.071
   20    HD1  TYR   3           1HD      TYR   3   3.216  19.711   1.310
   21    HD2  TYR   3           2HD      TYR   3   3.503  15.425   1.109
   22    HE1  TYR   3           1HE      TYR   3   2.077  19.529   3.527
   23    HE2  TYR   3           2HE      TYR   3   2.403  15.242   3.334
   24    HH   TYR   3           HH       TYR   3   1.462  16.388   5.094
   25    H    LEU   4           H        LEU   4   6.834  14.942  -1.037
   26    HA   LEU   4           HA       LEU   4   5.072  13.214  -2.723
   27   1HB   LEU   4          1HB       LEU   4   6.884  12.921  -4.309
   28   2HB   LEU   4          2HB       LEU   4   6.283  14.561  -4.215
   29    HG   LEU   4           HG       LEU   4   8.402  14.666  -2.429
   30   1HD1  LEU   4          1HD1      LEU   4   9.188  12.383  -3.143
   31   2HD1  LEU   4          2HD1      LEU   4   9.302  12.994  -4.789
   32   3HD1  LEU   4          3HD1      LEU   4  10.343  13.670  -3.524
   33   1HD2  LEU   4          1HD2      LEU   4   7.861  16.320  -4.156
   34   2HD2  LEU   4          2HD2      LEU   4   9.584  15.909  -4.170
   35   3HD2  LEU   4          3HD2      LEU   4   8.501  15.234  -5.414
   36    H    ARG   5           H        ARG   5   8.353  13.182  -1.096
   37    HA   ARG   5           HA       ARG   5   8.250  10.330  -0.595
   38   1HB   ARG   5          1HB       ARG   5  10.344  11.813  -0.655
   39   2HB   ARG   5          2HB       ARG   5   9.868  12.412   0.942
   40   1HG   ARG   5          1HG       ARG   5   9.835   9.899   1.658
   41   2HG   ARG   5          2HG       ARG   5  10.659   9.587   0.120
   42   1HD   ARG   5          1HD       ARG   5  12.463  11.178   0.836
   43   2HD   ARG   5          2HD       ARG   5  11.597  11.409   2.370
   44    HE   ARG   5           HE       ARG   5  12.312   8.628   1.624
   45   1HH1  ARG   5          1HH2      ARG   5  13.218  11.368   3.619
   46   2HH1  ARG   5          2HH2      ARG   5  14.235  10.392   4.644
   47   1HH2  ARG   5          1HH1      ARG   5  13.633   7.460   2.954
   48   2HH2  ARG   5          2HH1      ARG   5  14.478   8.244   4.255
   49    H    GLU   6           H        GLU   6   7.434  13.174   1.335
   50    HA   GLU   6           HA       GLU   6   6.737  11.913   3.765
   51   1HB   GLU   6          1HB       GLU   6   7.000  14.423   3.077
   52   2HB   GLU   6          2HB       GLU   6   5.286  14.359   2.687
   53   1HG   GLU   6          1HG       GLU   6   4.734  13.687   4.979
   54   2HG   GLU   6          2HG       GLU   6   6.442  13.508   5.387
   55    H    LEU   7           H        LEU   7   4.930  12.180   0.750
   56    HA   LEU   7           HA       LEU   7   2.445  11.046   1.826
   57   1HB   LEU   7          1HB       LEU   7   3.463  11.138  -1.044
   58   2HB   LEU   7          2HB       LEU   7   1.824  10.797  -0.510
   59    HG   LEU   7           HG       LEU   7   3.349  13.411  -0.515
   60   1HD1  LEU   7          1HD1      LEU   7   2.088  12.762  -2.536
   61   2HD1  LEU   7          2HD1      LEU   7   0.638  12.522  -1.538
   62   3HD1  LEU   7          3HD1      LEU   7   1.307  14.153  -1.739
   63   1HD2  LEU   7          1HD2      LEU   7   0.729  12.857   0.891
   64   2HD2  LEU   7          2HD2      LEU   7   2.261  13.404   1.639
   65   3HD2  LEU   7          3HD2      LEU   7   1.391  14.475   0.527
   66    H    TYR   8           H        TYR   8   4.971   9.768  -0.325
   67    HA   TYR   8           HA       TYR   8   4.264   7.104  -0.583
   68   1HB   TYR   8          1HB       TYR   8   6.317   8.778  -1.352
   69   2HB   TYR   8          2HB       TYR   8   7.187   7.902  -0.162
   70    HD1  TYR   8           1HD      TYR   8   6.996   8.214  -3.465
   71    HD2  TYR   8           2HD      TYR   8   6.675   5.091  -0.504
   72    HE1  TYR   8           1HE      TYR   8   7.778   6.549  -5.134
   73    HE2  TYR   8           2HE      TYR   8   7.485   3.443  -2.183
   74    HH   TYR   8           HH       TYR   8   8.375   4.336  -5.511
   75    H    LYS   9           H        LYS   9   6.353   8.374   2.025
   76    HA   LYS   9           HA       LYS   9   6.896   5.753   3.001
   77   1HB   LYS   9          1HB       LYS   9   8.219   7.936   3.400
   78   2HB   LYS   9          2HB       LYS   9   7.057   8.304   4.684
   79   1HG   LYS   9          1HG       LYS   9   7.702   6.169   5.830
   80   2HG   LYS   9          2HG       LYS   9   8.843   5.829   4.512
   81   1HD   LYS   9          1HD       LYS   9  10.045   7.971   5.061
   82   2HD   LYS   9          2HD       LYS   9   8.945   8.191   6.442
   83   1HE   LYS   9          1HE       LYS   9   9.698   5.975   7.345
   84   2HE   LYS   9          2HE       LYS   9  10.824   5.825   5.989
   85   1HZ   LYS   9          1HZ       LYS   9  11.935   7.857   6.789
   86   2HZ   LYS   9          2HZ       LYS   9  10.906   7.961   8.058
   87   3HZ   LYS   9          3HZ       LYS   9  11.942   6.706   7.947
   88    H    LEU  10           H        LEU  10   4.561   8.048   4.444
   89    HA   LEU  10           HA       LEU  10   3.456   6.085   6.139
   90   1HB   LEU  10          1HB       LEU  10   2.372   8.743   5.150
   91   2HB   LEU  10          2HB       LEU  10   1.529   7.699   6.294
   92    HG   LEU  10           HG       LEU  10   4.114   7.777   7.363
   93   1HD1  LEU  10          1HD1      LEU  10   4.836   9.569   5.895
   94   2HD1  LEU  10          2HD1      LEU  10   3.462  10.568   6.388
   95   3HD1  LEU  10          3HD1      LEU  10   4.720  10.138   7.564
   96   1HD2  LEU  10          1HD2      LEU  10   1.722   9.518   8.075
   97   2HD2  LEU  10          2HD2      LEU  10   2.052   7.874   8.657
   98   3HD2  LEU  10          3HD2      LEU  10   3.125   9.199   9.123
   99    H    GLU  11           H        GLU  11   2.717   6.949   2.769
  100    HA   GLU  11           HA       GLU  11   0.521   5.157   2.367
  101   1HB   GLU  11          1HB       GLU  11   2.587   6.554   0.746
  102   2HB   GLU  11          2HB       GLU  11   1.977   5.205  -0.057
  103   1HG   GLU  11          1HG       GLU  11   0.201   7.378   1.185
  104   2HG   GLU  11          2HG       GLU  11   0.863   7.494  -0.438
  105    H    GLN  12           H        GLN  12   4.127   4.419   2.342
  106    HA   GLN  12           HA       GLN  12   3.521   1.622   2.023
  107   1HB   GLN  12          1HB       GLN  12   6.026   3.224   2.489
  108   2HB   GLN  12          2HB       GLN  12   6.021   1.451   2.561
  109   1HG   GLN  12          1HG       GLN  12   4.919   1.380   0.335
  110   2HG   GLN  12          2HG       GLN  12   5.109   3.116   0.196
  111   1HE2  GLN  12          2HE2      GLN  12   6.413   0.526  -1.163
  112   2HE2  GLN  12          1HE2      GLN  12   8.120   0.940  -1.139
  113    H    GLN  13           H        GLN  13   3.714   3.602   4.836
  114    HA   GLN  13           HA       GLN  13   4.313   1.457   6.673
  115   1HB   GLN  13          1HB       GLN  13   4.562   3.973   7.048
  116   2HB   GLN  13          2HB       GLN  13   2.787   4.082   7.121
  117   1HG   GLN  13          1HG       GLN  13   2.773   2.511   8.976
  118   2HG   GLN  13          2HG       GLN  13   4.542   2.367   8.892
  119   1HE2  GLN  13          2HE2      GLN  13   4.165   3.005  11.309
  120   2HE2  GLN  13          1HE2      GLN  13   4.162   4.734  11.630
  121    H    ALA  14           H        ALA  14   1.215   2.659   5.321
  122    HA   ALA  14           HA       ALA  14  -0.391   0.720   6.811
  123   1HB   ALA  14          1HB       ALA  14  -1.373   2.724   5.716
  124   2HB   ALA  14          2HB       ALA  14  -0.861   2.112   4.124
  125   3HB   ALA  14          3HB       ALA  14  -2.076   1.226   5.072
  126    H    MET  15           H        MET  15   1.520   0.638   3.828
  127    HA   MET  15           HA       MET  15   0.520  -1.903   2.836
  128   1HB   MET  15          1HB       MET  15   3.103  -0.426   2.233
  129   2HB   MET  15          2HB       MET  15   2.638  -1.907   1.462
  130   1HG   MET  15          1HG       MET  15   0.998   0.653   1.416
  131   2HG   MET  15          2HG       MET  15   2.041   0.082   0.116
  132   1HE   MET  15          1HE       MET  15   1.825  -2.258  -0.854
  133   2HE   MET  15          2HE       MET  15   1.103  -3.271   0.422
  134   3HE   MET  15          3HE       MET  15   0.275  -3.082  -1.146
  135    H    LYS  16           H        LYS  16   3.414  -1.100   4.834
  136    HA   LYS  16           HA       LYS  16   4.339  -3.823   4.972
  137   1HB   LYS  16          1HB       LYS  16   5.303  -1.327   5.760
  138   2HB   LYS  16          2HB       LYS  16   4.908  -2.071   7.302
  139   1HG   LYS  16          1HG       LYS  16   7.186  -2.639   6.860
  140   2HG   LYS  16          2HG       LYS  16   6.265  -4.113   6.537
  141   1HD   LYS  16          1HD       LYS  16   6.311  -3.510   4.063
  142   2HD   LYS  16          2HD       LYS  16   7.328  -2.118   4.478
  143   1HE   LYS  16          1HE       LYS  16   9.014  -3.677   5.463
  144   2HE   LYS  16          2HE       LYS  16   7.991  -5.049   5.020
  145   1HZ   LYS  16          1HZ       LYS  16   8.255  -4.388   2.676
  146   2HZ   LYS  16          2HZ       LYS  16   9.221  -3.139   3.099
  147   3HZ   LYS  16          3HZ       LYS  16   9.710  -4.672   3.355
  148    H    LEU  17           H        LEU  17   2.274  -1.916   7.128
  149    HA   LEU  17           HA       LEU  17   1.584  -3.974   8.998
  150   1HB   LEU  17          1HB       LEU  17   0.662  -1.318   8.208
  151   2HB   LEU  17          2HB       LEU  17  -0.736  -2.323   8.386
  152    HG   LEU  17           HG       LEU  17   1.449  -1.972  10.491
  153   1HD1  LEU  17          1HD1      LEU  17  -0.180  -0.556  11.649
  154   2HD1  LEU  17          2HD1      LEU  17   0.159   0.088  10.035
  155   3HD1  LEU  17          3HD1      LEU  17  -1.357  -0.789  10.332
  156   1HD2  LEU  17          1HD2      LEU  17  -1.316  -3.256  10.707
  157   2HD2  LEU  17          2HD2      LEU  17   0.231  -4.126  10.758
  158   3HD2  LEU  17          3HD2      LEU  17  -0.178  -2.989  12.043
  159    H    TYR  18           H        TYR  18  -0.035  -3.095   5.986
  160    HA   TYR  18           HA       TYR  18  -1.954  -5.117   5.868
  161   1HB   TYR  18          1HB       TYR  18  -0.596  -3.349   3.879
  162   2HB   TYR  18          2HB       TYR  18  -1.382  -4.740   3.235
  163    HD1  TYR  18           1HD      TYR  18  -3.789  -5.139   4.653
  164    HD2  TYR  18           2HD      TYR  18  -1.952  -1.442   3.451
  165    HE1  TYR  18           1HE      TYR  18  -6.031  -4.111   4.460
  166    HE2  TYR  18           2HE      TYR  18  -4.180  -0.338   3.450
  167    HH   TYR  18           HH       TYR  18  -6.425  -0.601   3.788
  168    H    ARG  19           H        ARG  19   1.426  -5.349   4.698
  169    HA   ARG  19           HA       ARG  19   1.180  -7.885   3.444
  170   1HB   ARG  19          1HB       ARG  19   3.094  -6.136   3.391
  171   2HB   ARG  19          2HB       ARG  19   3.706  -6.933   4.846
  172   1HG   ARG  19          1HG       ARG  19   3.851  -9.081   3.575
  173   2HG   ARG  19          2HG       ARG  19   3.149  -8.279   2.157
  174   1HD   ARG  19          1HD       ARG  19   5.126  -6.644   2.254
  175   2HD   ARG  19          2HD       ARG  19   5.831  -7.700   3.473
  176    HE   ARG  19           HE       ARG  19   6.306  -9.312   1.846
  177   1HH1  ARG  19          1HH2      ARG  19   4.357  -6.823   0.321
  178   2HH1  ARG  19          2HH2      ARG  19   4.708  -7.408  -1.282
  179   1HH2  ARG  19          1HH1      ARG  19   6.704  -9.998  -0.230
  180   2HH2  ARG  19          2HH1      ARG  19   5.996  -9.155  -1.577
  181    H    GLU  20           H        GLU  20   1.676  -7.123   6.854
  182    HA   GLU  20           HA       GLU  20   1.888  -9.962   7.666
  183   1HB   GLU  20          1HB       GLU  20   2.726  -7.639   8.809
  184   2HB   GLU  20          2HB       GLU  20   1.152  -7.732   9.556
  185   1HG   GLU  20          1HG       GLU  20   2.641  -8.771  11.076
  186   2HG   GLU  20          2HG       GLU  20   1.712 -10.074  10.345
  187    H    ALA  21           H        ALA  21  -0.570  -7.409   7.793
  188    HA   ALA  21           HA       ALA  21  -2.661  -8.930   8.935
  189   1HB   ALA  21          1HB       ALA  21  -2.749  -6.498   8.508
  190   2HB   ALA  21          2HB       ALA  21  -2.968  -6.824   6.767
  191   3HB   ALA  21          3HB       ALA  21  -4.193  -7.355   7.929
  192    H    SER  22           H        SER  22  -1.671  -8.895   5.465
  193    HA   SER  22           HA       SER  22  -3.577 -10.691   4.445
  194   1HB   SER  22          1HB       SER  22  -1.856  -9.375   3.166
  195   2HB   SER  22          2HB       SER  22  -0.627 -10.519   3.726
  196    HG   SER  22           HG       SER  22  -2.872 -11.014   2.039
  197    H    GLU  23           H        GLU  23  -0.663 -11.462   6.441
  198    HA   GLU  23           HA       GLU  23  -0.840 -14.324   6.014
  199   1HB   GLU  23          1HB       GLU  23   1.119 -12.866   6.951
  200   2HB   GLU  23          2HB       GLU  23   0.273 -12.986   8.484
  201   1HG   GLU  23          1HG       GLU  23   1.926 -14.700   8.463
  202   2HG   GLU  23          2HG       GLU  23   0.358 -15.482   8.330
  203    H    LYS  24           H        LYS  24  -2.067 -12.136   8.546
  204    HA   LYS  24           HA       LYS  24  -3.467 -14.140  10.118
  205   1HB   LYS  24          1HB       LYS  24  -3.800 -11.118   9.852
  206   2HB   LYS  24          2HB       LYS  24  -4.874 -12.101  10.831
  207   1HG   LYS  24          1HG       LYS  24  -3.304 -11.184  12.300
  208   2HG   LYS  24          2HG       LYS  24  -2.956 -12.909  12.181
  209   1HD   LYS  24          1HD       LYS  24  -1.049 -12.425  10.673
  210   2HD   LYS  24          2HD       LYS  24  -1.413 -10.693  10.744
  211   1HE   LYS  24          1HE       LYS  24  -0.702 -12.434  13.150
  212   2HE   LYS  24          2HE       LYS  24   0.480 -11.512  12.218
  213   1HZ   LYS  24          1HZ       LYS  24  -0.714  -9.474  12.824
  214   2HZ   LYS  24          2HZ       LYS  24  -1.793 -10.324  13.717
  215   3HZ   LYS  24          3HZ       LYS  24  -0.227 -10.272  14.161
  216    H    ALA  25           H        ALA  25  -4.549 -12.031   7.502
  217    HA   ALA  25           HA       ALA  25  -7.252 -13.102   7.460
  218   1HB   ALA  25          1HB       ALA  25  -6.674 -10.679   7.231
  219   2HB   ALA  25          2HB       ALA  25  -5.878 -11.042   5.682
  220   3HB   ALA  25          3HB       ALA  25  -7.621 -11.296   5.868
  221    H    ARG  26           H        ARG  26  -5.008 -14.967   6.583
  222    HA   ARG  26           HA       ARG  26  -4.987 -15.377   3.831
  223   1HB   ARG  26          1HB       ARG  26  -4.190 -17.565   4.192
  224   2HB   ARG  26          2HB       ARG  26  -3.486 -16.530   5.414
  225   1HG   ARG  26          1HG       ARG  26  -5.919 -18.286   5.992
  226   2HG   ARG  26          2HG       ARG  26  -4.276 -18.907   6.051
  227   1HD   ARG  26          1HD       ARG  26  -3.651 -17.352   7.800
  228   2HD   ARG  26          2HD       ARG  26  -5.230 -16.564   7.716
  229    HE   ARG  26           HE       ARG  26  -4.834 -19.434   8.513
  230   1HH1  ARG  26          1HH2      ARG  26  -6.347 -16.346   9.297
  231   2HH1  ARG  26          2HH2      ARG  26  -7.458 -17.111  10.405
  232   1HH2  ARG  26          1HH1      ARG  26  -6.190 -20.273  10.011
  233   2HH2  ARG  26          2HH1      ARG  26  -7.321 -19.249  10.850
  234    H    ASN  27           H        ASN  27  -7.717 -16.011   5.837
  235    HA   ASN  27           HA       ASN  27  -9.152 -17.857   4.190
  236   1HB   ASN  27          1HB       ASN  27  -9.635 -17.245   6.581
  237   2HB   ASN  27          2HB       ASN  27 -10.185 -15.658   6.041
  238   1HD2  ASN  27          2HD2      ASN  27 -12.410 -15.548   5.857
  239   2HD2  ASN  27          1HD2      ASN  27 -13.426 -16.932   5.487
  240    HA   PRO  28           HA       PRO  28  -9.500 -15.292   0.669
  241   1HB   PRO  28          1HB       PRO  28 -11.524 -16.446  -0.806
  242   2HB   PRO  28          2HB       PRO  28  -9.878 -17.117  -0.609
  243   1HG   PRO  28          1HG       PRO  28 -12.378 -17.823   0.947
  244   2HG   PRO  28          2HG       PRO  28 -11.176 -18.932   0.213
  245   1HD   PRO  28          1HD       PRO  28 -11.107 -18.303   2.841
  246   2HD   PRO  28          2HD       PRO  28  -9.587 -18.469   1.907
  247    H    GLU  29           H        GLU  29 -12.408 -15.598   2.581
  248    HA   GLU  29           HA       GLU  29 -14.076 -13.633   1.472
  249   1HB   GLU  29          1HB       GLU  29 -14.175 -15.339   3.577
  250   2HB   GLU  29          2HB       GLU  29 -13.818 -13.882   4.462
  251   1HG   GLU  29          1HG       GLU  29 -16.180 -14.088   4.471
  252   2HG   GLU  29          2HG       GLU  29 -15.821 -12.780   3.350
  253    H    LYS  30           H        LYS  30 -11.237 -13.231   3.393
  254    HA   LYS  30           HA       LYS  30 -11.418 -10.249   3.218
  255   1HB   LYS  30          1HB       LYS  30  -9.962 -12.007   5.232
  256   2HB   LYS  30          2HB       LYS  30  -9.518 -10.329   4.930
  257   1HG   LYS  30          1HG       LYS  30 -10.855 -10.201   6.796
  258   2HG   LYS  30          2HG       LYS  30 -11.872  -9.635   5.472
  259   1HD   LYS  30          1HD       LYS  30 -13.007 -11.850   5.420
  260   2HD   LYS  30          2HD       LYS  30 -11.984 -12.417   6.745
  261   1HE   LYS  30          1HE       LYS  30 -13.934 -10.063   6.851
  262   2HE   LYS  30          2HE       LYS  30 -14.296 -11.696   7.411
  263   1HZ   LYS  30          1HZ       LYS  30 -12.502 -11.474   9.050
  264   2HZ   LYS  30          2HZ       LYS  30 -12.190  -9.943   8.562
  265   3HZ   LYS  30          3HZ       LYS  30 -13.621 -10.306   9.257
  266    H    LYS  31           H        LYS  31  -9.190 -12.989   2.617
  267    HA   LYS  31           HA       LYS  31  -7.084 -11.490   1.612
  268   1HB   LYS  31          1HB       LYS  31  -7.246 -14.035   1.972
  269   2HB   LYS  31          2HB       LYS  31  -7.853 -14.092   0.306
  270   1HG   LYS  31          1HG       LYS  31  -5.796 -12.992  -0.500
  271   2HG   LYS  31          2HG       LYS  31  -5.190 -12.888   1.167
  272   1HD   LYS  31          1HD       LYS  31  -5.186 -15.345   1.336
  273   2HD   LYS  31          2HD       LYS  31  -5.876 -15.474  -0.299
  274   1HE   LYS  31          1HE       LYS  31  -3.873 -14.289  -1.215
  275   2HE   LYS  31          2HE       LYS  31  -3.180 -14.217   0.409
  276   1HZ   LYS  31          1HZ       LYS  31  -3.150 -16.659   0.427
  277   2HZ   LYS  31          2HZ       LYS  31  -3.796 -16.721  -1.074
  278   3HZ   LYS  31          3HZ       LYS  31  -2.305 -16.101  -0.852
  279    H    SER  32           H        SER  32 -10.030 -12.216  -0.117
  280    HA   SER  32           HA       SER  32  -9.043 -10.873  -2.553
  281   1HB   SER  32          1HB       SER  32 -11.175 -11.490  -3.562
  282   2HB   SER  32          2HB       SER  32 -10.465 -12.896  -2.759
  283    HG   SER  32           HG       SER  32 -11.908 -12.678  -1.082
  284    H    VAL  33           H        VAL  33 -10.181  -9.656   0.236
  285    HA   VAL  33           HA       VAL  33 -11.535  -7.297  -1.031
  286    HB   VAL  33           HB       VAL  33 -11.484  -8.166   1.882
  287   1HG1  VAL  33          1HG1      VAL  33 -11.583  -5.716   1.770
  288   2HG1  VAL  33          2HG1      VAL  33 -12.854  -5.797   0.529
  289   3HG1  VAL  33          3HG1      VAL  33 -13.175  -6.348   2.185
  290   1HG2  VAL  33          1HG2      VAL  33 -13.740  -8.089  -0.176
  291   2HG2  VAL  33          2HG2      VAL  33 -12.959  -9.557   0.444
  292   3HG2  VAL  33          3HG2      VAL  33 -13.901  -8.540   1.537
  293    H    LEU  34           H        LEU  34  -8.902  -8.063   1.431
  294    HA   LEU  34           HA       LEU  34  -7.934  -5.336   1.199
  295   1HB   LEU  34          1HB       LEU  34  -6.440  -5.754   2.764
  296   2HB   LEU  34          2HB       LEU  34  -7.643  -6.960   3.201
  297    HG   LEU  34           HG       LEU  34  -5.195  -7.398   1.548
  298   1HD1  LEU  34          1HD1      LEU  34  -4.500  -6.851   3.800
  299   2HD1  LEU  34          2HD1      LEU  34  -5.644  -8.010   4.505
  300   3HD1  LEU  34          3HD1      LEU  34  -4.236  -8.566   3.570
  301   1HD2  LEU  34          1HD2      LEU  34  -6.943  -9.458   2.943
  302   2HD2  LEU  34          2HD2      LEU  34  -6.909  -9.146   1.191
  303   3HD2  LEU  34          3HD2      LEU  34  -5.481  -9.811   1.992
  304    H    GLN  35           H        GLN  35  -7.456  -8.172  -0.846
  305    HA   GLN  35           HA       GLN  35  -5.089  -7.308  -2.139
  306   1HB   GLN  35          1HB       GLN  35  -5.963  -9.535  -2.425
  307   2HB   GLN  35          2HB       GLN  35  -7.446  -8.919  -3.163
  308   1HG   GLN  35          1HG       GLN  35  -5.982  -9.875  -4.848
  309   2HG   GLN  35          2HG       GLN  35  -6.164  -8.156  -5.128
  310   1HE2  GLN  35          2HE2      GLN  35  -4.174  -8.417  -6.468
  311   2HE2  GLN  35          1HE2      GLN  35  -2.616  -8.437  -5.650
  312    H    LYS  36           H        LYS  36  -8.467  -6.236  -2.711
  313    HA   LYS  36           HA       LYS  36  -7.774  -4.837  -5.156
  314   1HB   LYS  36          1HB       LYS  36 -10.173  -5.571  -3.922
  315   2HB   LYS  36          2HB       LYS  36 -10.127  -3.849  -3.587
  316   1HG   LYS  36          1HG       LYS  36 -11.299  -4.060  -5.625
  317   2HG   LYS  36          2HG       LYS  36  -9.686  -3.513  -6.109
  318   1HD   LYS  36          1HD       LYS  36  -9.091  -5.955  -6.543
  319   2HD   LYS  36          2HD       LYS  36 -10.765  -6.380  -6.206
  320   1HE   LYS  36          1HE       LYS  36  -9.823  -4.484  -8.406
  321   2HE   LYS  36          2HE       LYS  36 -10.187  -6.196  -8.637
  322   1HZ   LYS  36          1HZ       LYS  36 -12.483  -5.741  -7.947
  323   2HZ   LYS  36          2HZ       LYS  36 -12.157  -4.144  -7.780
  324   3HZ   LYS  36          3HZ       LYS  36 -12.084  -4.846  -9.249
  325    H    ILE  37           H        ILE  37  -7.809  -3.869  -1.792
  326    HA   ILE  37           HA       ILE  37  -6.984  -1.088  -2.226
  327    HB   ILE  37           HB       ILE  37  -6.599  -3.028   0.089
  328   1HG1  ILE  37          1HG1      ILE  37  -8.654  -0.876  -0.268
  329   2HG1  ILE  37          2HG1      ILE  37  -8.888  -2.633  -0.273
  330   1HG2  ILE  37          1HG2      ILE  37  -4.847  -1.329   0.232
  331   2HG2  ILE  37          2HG2      ILE  37  -6.042  -0.044  -0.042
  332   3HG2  ILE  37          3HG2      ILE  37  -6.047  -0.981   1.456
  333   1HD1  ILE  37          1HD1      ILE  37  -8.138  -2.688   2.119
  334   2HD1  ILE  37          2HD1      ILE  37  -8.208  -0.900   2.105
  335   3HD1  ILE  37          3HD1      ILE  37  -9.669  -1.845   1.819
  336    H    LEU  38           H        LEU  38  -5.111  -4.161  -1.551
  337    HA   LEU  38           HA       LEU  38  -2.568  -3.005  -1.763
  338   1HB   LEU  38          1HB       LEU  38  -3.505  -5.779  -2.580
  339   2HB   LEU  38          2HB       LEU  38  -1.821  -5.309  -2.555
  340    HG   LEU  38           HG       LEU  38  -3.588  -5.190  -0.071
  341   1HD1  LEU  38          1HD1      LEU  38  -3.382  -7.532  -0.840
  342   2HD1  LEU  38          2HD1      LEU  38  -1.622  -7.347  -0.950
  343   3HD1  LEU  38          3HD1      LEU  38  -2.443  -7.260   0.627
  344   1HD2  LEU  38          1HD2      LEU  38  -0.582  -5.082  -0.472
  345   2HD2  LEU  38          2HD2      LEU  38  -1.641  -3.764   0.115
  346   3HD2  LEU  38          3HD2      LEU  38  -1.397  -5.212   1.092
  347    H    GLU  39           H        GLU  39  -4.630  -4.050  -4.550
  348    HA   GLU  39           HA       GLU  39  -2.610  -3.306  -6.486
  349   1HB   GLU  39          1HB       GLU  39  -5.638  -3.686  -6.690
  350   2HB   GLU  39          2HB       GLU  39  -4.607  -3.324  -8.076
  351   1HG   GLU  39          1HG       GLU  39  -3.300  -5.388  -7.670
  352   2HG   GLU  39          2HG       GLU  39  -4.343  -5.783  -6.305
  353    H    ASP  40           H        ASP  40  -5.354  -1.449  -5.122
  354    HA   ASP  40           HA       ASP  40  -5.019   0.909  -6.717
  355   1HB   ASP  40          1HB       ASP  40  -6.254   0.074  -4.073
  356   2HB   ASP  40          2HB       ASP  40  -6.053   1.730  -4.362
  357    H    GLU  41           H        GLU  41  -3.436  -0.249  -3.735
  358    HA   GLU  41           HA       GLU  41  -2.184   2.368  -3.208
  359   1HB   GLU  41          1HB       GLU  41  -1.638  -0.354  -2.003
  360   2HB   GLU  41          2HB       GLU  41  -0.934   1.157  -1.438
  361   1HG   GLU  41          1HG       GLU  41  -3.895   0.450  -1.333
  362   2HG   GLU  41          2HG       GLU  41  -2.768   0.309  -0.002
  363    H    GLU  42           H        GLU  42  -1.186  -0.700  -4.723
  364    HA   GLU  42           HA       GLU  42   1.527   0.068  -5.262
  365   1HB   GLU  42          1HB       GLU  42   0.451  -2.217  -5.453
  366   2HB   GLU  42          2HB       GLU  42  -0.246  -1.714  -6.985
  367   1HG   GLU  42          1HG       GLU  42   2.738  -1.691  -6.318
  368   2HG   GLU  42          2HG       GLU  42   1.917  -3.081  -7.012
  369    H    LYS  43           H        LYS  43  -1.533   0.737  -6.983
  370    HA   LYS  43           HA       LYS  43  -0.365   2.178  -9.172
  371   1HB   LYS  43          1HB       LYS  43  -2.939   1.386  -8.553
  372   2HB   LYS  43          2HB       LYS  43  -3.040   3.106  -8.232
  373   1HG   LYS  43          1HG       LYS  43  -3.669   2.855 -10.482
  374   2HG   LYS  43          2HG       LYS  43  -1.996   3.427 -10.579
  375   1HD   LYS  43          1HD       LYS  43  -1.227   1.080 -10.946
  376   2HD   LYS  43          2HD       LYS  43  -2.902   0.516 -10.789
  377   1HE   LYS  43          1HE       LYS  43  -3.536   1.947 -12.743
  378   2HE   LYS  43          2HE       LYS  43  -1.841   2.423 -12.922
  379   1HZ   LYS  43          1HZ       LYS  43  -1.301   0.069 -13.308
  380   2HZ   LYS  43          2HZ       LYS  43  -2.871  -0.358 -13.151
  381   3HZ   LYS  43          3HZ       LYS  43  -2.400   0.579 -14.400
  382    H    HIS  44           H        HIS  44  -1.422   3.408  -5.888
  383    HA   HIS  44           HA       HIS  44  -0.853   6.107  -6.374
  384   1HB   HIS  44          1HB       HIS  44  -0.647   4.411  -3.836
  385   2HB   HIS  44          2HB       HIS  44  -0.709   6.138  -3.961
  386    HD2  HIS  44           2HD      HIS  44  -3.162   5.381  -6.395
  387    HE1  HIS  44           1HE      HIS  44  -5.448   4.980  -2.855
  388    HE2  HIS  44           2HE      HIS  44  -5.527   5.072  -5.393
  389    H    ILE  45           H        ILE  45   1.225   3.506  -5.018
  390    HA   ILE  45           HA       ILE  45   3.601   5.067  -4.798
  391    HB   ILE  45           HB       ILE  45   2.866   2.170  -4.767
  392   1HG1  ILE  45          1HG1      ILE  45   4.419   2.210  -2.785
  393   2HG1  ILE  45          2HG1      ILE  45   4.726   3.917  -3.102
  394   1HG2  ILE  45          1HG2      ILE  45   4.676   1.955  -6.363
  395   2HG2  ILE  45          2HG2      ILE  45   5.736   2.961  -5.345
  396   3HG2  ILE  45          3HG2      ILE  45   5.193   1.365  -4.789
  397   1HD1  ILE  45          1HD1      ILE  45   2.343   4.428  -2.640
  398   2HD1  ILE  45          2HD1      ILE  45   2.031   2.692  -2.383
  399   3HD1  ILE  45          3HD1      ILE  45   3.106   3.573  -1.289
  400    H    GLU  46           H        GLU  46   2.379   3.252  -7.649
  401    HA   GLU  46           HA       GLU  46   4.529   3.788  -9.394
  402   1HB   GLU  46          1HB       GLU  46   1.723   3.000  -9.632
  403   2HB   GLU  46          2HB       GLU  46   2.131   4.129 -10.909
  404   1HG   GLU  46          1HG       GLU  46   3.639   1.576 -10.270
  405   2HG   GLU  46          2HG       GLU  46   2.404   1.757 -11.520
  406    H    TRP  47           H        TRP  47   1.699   5.903  -8.716
  407    HA   TRP  47           HA       TRP  47   2.616   7.956 -10.519
  408   1HB   TRP  47          1HB       TRP  47   0.667   8.194  -8.189
  409   2HB   TRP  47          2HB       TRP  47   0.766   9.220  -9.596
  410    HD1  TRP  47           1HD      TRP  47   0.715   6.596 -11.683
  411    HE1  TRP  47           1HE      TRP  47  -1.552   5.440 -12.075
  412    HE3  TRP  47           3HE      TRP  47  -1.802   8.365  -7.621
  413    HZ2  TRP  47           2HZ      TRP  47  -4.167   5.386 -10.820
  414    HZ3  TRP  47           3HZ      TRP  47  -4.194   7.791  -7.230
  415    HH2  TRP  47           2HH      TRP  47  -5.376   6.275  -8.821
  416    H    LEU  48           H        LEU  48   2.788   7.514  -7.004
  417    HA   LEU  48           HA       LEU  48   3.985   9.968  -6.245
  418   1HB   LEU  48          1HB       LEU  48   3.972   7.107  -5.223
  419   2HB   LEU  48          2HB       LEU  48   4.913   8.283  -4.373
  420    HG   LEU  48           HG       LEU  48   1.956   8.728  -4.915
  421   1HD1  LEU  48          1HD1      LEU  48   2.213   6.643  -3.603
  422   2HD1  LEU  48          2HD1      LEU  48   3.268   7.486  -2.461
  423   3HD1  LEU  48          3HD1      LEU  48   1.554   7.947  -2.612
  424   1HD2  LEU  48          1HD2      LEU  48   3.907   9.837  -2.850
  425   2HD2  LEU  48          2HD2      LEU  48   3.277  10.727  -4.251
  426   3HD2  LEU  48          3HD2      LEU  48   2.173  10.228  -2.958
  427    H    GLU  49           H        GLU  49   5.552   6.929  -7.301
  428    HA   GLU  49           HA       GLU  49   8.243   7.989  -7.201
  429   1HB   GLU  49          1HB       GLU  49   7.346   5.513  -7.460
  430   2HB   GLU  49          2HB       GLU  49   7.374   5.855  -9.180
  431   1HG   GLU  49          1HG       GLU  49   9.784   6.536  -8.984
  432   2HG   GLU  49          2HG       GLU  49   9.739   6.139  -7.267
  433    H    THR  50           H        THR  50   5.816   7.783  -9.832
  434    HA   THR  50           HA       THR  50   7.439   9.021 -11.830
  435    HB   THR  50           HB       THR  50   4.463   8.689 -11.449
  436    HG1  THR  50           1HG      THR  50   4.794   7.078 -12.887
  437   1HG2  THR  50          1HG2      THR  50   4.636  10.619 -12.885
  438   2HG2  THR  50          2HG2      THR  50   5.883   9.808 -13.875
  439   3HG2  THR  50          3HG2      THR  50   4.203   9.196 -13.844
  440    H    ILE  51           H        ILE  51   5.646  10.482  -9.229
  441    HA   ILE  51           HA       ILE  51   6.120  13.210 -10.227
  442    HB   ILE  51           HB       ILE  51   4.426  11.952  -8.106
  443   1HG1  ILE  51          1HG1      ILE  51   2.857  13.811  -8.924
  444   2HG1  ILE  51          2HG1      ILE  51   4.109  14.298 -10.058
  445   1HG2  ILE  51          1HG2      ILE  51   5.625  13.541  -6.686
  446   2HG2  ILE  51          2HG2      ILE  51   5.223  14.864  -7.821
  447   3HG2  ILE  51          3HG2      ILE  51   3.942  14.009  -6.935
  448   1HD1  ILE  51          1HD1      ILE  51   3.943  12.057 -11.146
  449   2HD1  ILE  51          2HD1      ILE  51   2.651  11.632  -9.990
  450   3HD1  ILE  51          3HD1      ILE  51   2.415  12.945 -11.157
  451    H    ASN  52           H        ASN  52   7.832  11.052  -8.356
  452    HA   ASN  52           HA       ASN  52   9.510  12.993  -6.939
  453   1HB   ASN  52          1HB       ASN  52   9.052  10.569  -6.246
  454   2HB   ASN  52          2HB       ASN  52  10.107  10.073  -7.569
  455   1HD2  ASN  52          2HD2      ASN  52  11.049   9.021  -5.488
  456   2HD2  ASN  52          1HD2      ASN  52  12.303   9.971  -4.704
  457    H    GLY  53           H        GLY  53  11.884  13.090  -7.361
  458   1HA   GLY  53          1HA       GLY  53  13.039  12.675  -9.965
  459   2HA   GLY  53          2HA       GLY  53  12.489  14.345  -9.809
  460   1H    MET   1          1H        MET   1  -7.599  -4.610  21.947
  461   2H    MET   1          2H        MET   1  -8.465  -5.903  21.429
  462   3H    MET   1          3H        MET   1  -8.434  -4.528  20.543
  463    HA   MET   1           HA       MET   1  -6.102  -4.780  20.084
  464   1HB   MET   1          1HB       MET   1  -5.561  -5.926  22.196
  465   2HB   MET   1          2HB       MET   1  -6.344  -7.399  21.628
  466   1HG   MET   1          1HG       MET   1  -4.015  -6.080  20.170
  467   2HG   MET   1          2HG       MET   1  -3.798  -7.223  21.489
  468   1HE   MET   1          1HE       MET   1  -2.300  -7.749  18.824
  469   2HE   MET   1          2HE       MET   1  -2.285  -8.834  20.235
  470   3HE   MET   1          3HE       MET   1  -2.618  -9.487  18.617
  471    H    ASP   2           H        ASP   2  -6.197  -4.999  17.987
  472    HA   ASP   2           HA       ASP   2  -6.853  -7.473  16.668
  473   1HB   ASP   2          1HB       ASP   2  -9.106  -6.077  17.050
  474   2HB   ASP   2          2HB       ASP   2  -8.497  -5.117  15.706
  475    H    TYR   3           H        TYR   3  -6.735  -6.795  14.068
  476    HA   TYR   3           HA       TYR   3  -4.329  -5.028  13.845
  477   1HB   TYR   3          1HB       TYR   3  -3.518  -6.490  12.060
  478   2HB   TYR   3          2HB       TYR   3  -3.736  -7.374  13.545
  479    HD1  TYR   3           1HD      TYR   3  -5.257  -9.234  13.700
  480    HD2  TYR   3           2HD      TYR   3  -5.117  -6.844  10.104
  481    HE1  TYR   3           1HE      TYR   3  -6.605 -10.950  12.503
  482    HE2  TYR   3           2HE      TYR   3  -6.469  -8.557   8.922
  483    HH   TYR   3           HH       TYR   3  -7.580 -10.563   9.082
  484    H    LEU   4           H        LEU   4  -7.499  -4.938  13.069
  485    HA   LEU   4           HA       LEU   4  -7.048  -3.878  10.376
  486   1HB   LEU   4          1HB       LEU   4  -9.312  -4.340   9.830
  487   2HB   LEU   4          2HB       LEU   4  -8.609  -5.715  10.669
  488    HG   LEU   4           HG       LEU   4  -9.718  -4.562  12.798
  489   1HD1  LEU   4          1HD1      LEU   4 -10.665  -2.577  11.555
  490   2HD1  LEU   4          2HD1      LEU   4 -11.596  -3.693  10.548
  491   3HD1  LEU   4          3HD1      LEU   4 -11.906  -3.578  12.297
  492   1HD2  LEU   4          1HD2      LEU   4 -11.338  -6.117  10.728
  493   2HD2  LEU   4          2HD2      LEU   4 -10.249  -6.825  11.939
  494   3HD2  LEU   4          3HD2      LEU   4 -11.706  -5.977  12.466
  495    H    ARG   5           H        ARG   5  -8.446  -2.571  13.336
  496    HA   ARG   5           HA       ARG   5  -9.149   0.001  12.250
  497   1HB   ARG   5          1HB       ARG   5  -9.763  -0.903  14.531
  498   2HB   ARG   5          2HB       ARG   5  -8.098  -0.604  15.051
  499   1HG   ARG   5          1HG       ARG   5  -8.413   1.833  14.534
  500   2HG   ARG   5          2HG       ARG   5 -10.083   1.489  14.037
  501   1HD   ARG   5          1HD       ARG   5 -10.553   0.622  16.332
  502   2HD   ARG   5          2HD       ARG   5  -8.885   1.016  16.798
  503    HE   ARG   5           HE       ARG   5 -10.345   3.292  15.692
  504   1HH1  ARG   5          1HH2      ARG   5  -9.841   1.550  18.692
  505   2HH1  ARG   5          2HH2      ARG   5 -10.276   2.926  19.668
  506   1HH2  ARG   5          1HH1      ARG   5 -10.898   5.003  16.999
  507   2HH2  ARG   5          2HH1      ARG   5 -10.863   4.821  18.728
  508    H    GLU   6           H        GLU   6  -6.110  -1.342  13.325
  509    HA   GLU   6           HA       GLU   6  -4.362   0.856  13.191
  510   1HB   GLU   6          1HB       GLU   6  -3.932  -1.468  14.053
  511   2HB   GLU   6          2HB       GLU   6  -3.837  -2.050  12.402
  512   1HG   GLU   6          1HG       GLU   6  -1.850  -0.762  11.957
  513   2HG   GLU   6          2HG       GLU   6  -2.080   0.225  13.400
  514    H    LEU   7           H        LEU   7  -5.473  -1.280  10.564
  515    HA   LEU   7           HA       LEU   7  -3.853  -0.146   8.464
  516   1HB   LEU   7          1HB       LEU   7  -6.508  -1.650   8.303
  517   2HB   LEU   7          2HB       LEU   7  -5.455  -1.309   6.936
  518    HG   LEU   7           HG       LEU   7  -4.706  -3.011   9.329
  519   1HD1  LEU   7          1HD1      LEU   7  -6.485  -4.006   7.907
  520   2HD1  LEU   7          2HD1      LEU   7  -5.422  -3.843   6.493
  521   3HD1  LEU   7          3HD1      LEU   7  -4.971  -4.914   7.838
  522   1HD2  LEU   7          1HD2      LEU   7  -3.259  -2.549   6.700
  523   2HD2  LEU   7          2HD2      LEU   7  -2.726  -2.020   8.320
  524   3HD2  LEU   7          3HD2      LEU   7  -2.806  -3.737   7.947
  525    H    TYR   8           H        TYR   8  -7.297   0.322   9.197
  526    HA   TYR   8           HA       TYR   8  -8.099   2.239   7.310
  527   1HB   TYR   8          1HB       TYR   8  -9.166   0.916   9.459
  528   2HB   TYR   8          2HB       TYR   8  -8.854   2.389  10.282
  529    HD1  TYR   8           1HD      TYR   8 -11.468   0.925   9.959
  530    HD2  TYR   8           2HD      TYR   8  -9.767   4.276   7.830
  531    HE1  TYR   8           1HE      TYR   8 -13.748   1.811   9.519
  532    HE2  TYR   8           2HE      TYR   8 -12.049   5.166   7.441
  533    HH   TYR   8           HH       TYR   8 -14.987   3.543   8.632
  534    H    LYS   9           H        LYS   9  -6.559   2.845  10.453
  535    HA   LYS   9           HA       LYS   9  -6.714   5.686  10.226
  536   1HB   LYS   9          1HB       LYS   9  -5.066   3.762  11.947
  537   2HB   LYS   9          2HB       LYS   9  -4.869   5.513  12.118
  538   1HG   LYS   9          1HG       LYS   9  -7.238   5.798  12.665
  539   2HG   LYS   9          2HG       LYS   9  -7.570   4.102  12.317
  540   1HD   LYS   9          1HD       LYS   9  -7.512   4.380  14.684
  541   2HD   LYS   9          2HD       LYS   9  -6.105   3.417  14.197
  542   1HE   LYS   9          1HE       LYS   9  -4.666   5.440  14.364
  543   2HE   LYS   9          2HE       LYS   9  -6.078   6.416  14.791
  544   1HZ   LYS   9          1HZ       LYS   9  -6.322   5.068  16.806
  545   2HZ   LYS   9          2HZ       LYS   9  -5.018   4.159  16.413
  546   3HZ   LYS   9          3HZ       LYS   9  -4.838   5.742  16.766
  547    H    LEU  10           H        LEU  10  -3.743   3.756   9.655
  548    HA   LEU  10           HA       LEU  10  -2.438   5.910   8.432
  549   1HB   LEU  10          1HB       LEU  10  -1.981   2.917   8.239
  550   2HB   LEU  10          2HB       LEU  10  -0.951   4.129   7.470
  551    HG   LEU  10           HG       LEU  10  -1.118   5.205   9.978
  552   1HD1  LEU  10          1HD1      LEU  10  -2.322   3.471  11.068
  553   2HD1  LEU  10          2HD1      LEU  10  -1.223   2.227  10.446
  554   3HD1  LEU  10          3HD1      LEU  10  -0.657   3.419  11.635
  555   1HD2  LEU  10          1HD2      LEU  10   0.887   3.089   9.100
  556   2HD2  LEU  10          2HD2      LEU  10   0.949   4.820   8.694
  557   3HD2  LEU  10          3HD2      LEU  10   1.139   4.302  10.375
  558    H    GLU  11           H        GLU  11  -4.695   3.573   6.962
  559    HA   GLU  11           HA       GLU  11  -4.546   4.527   4.289
  560   1HB   GLU  11          1HB       GLU  11  -6.373   2.985   6.016
  561   2HB   GLU  11          2HB       GLU  11  -7.279   3.815   4.860
  562   1HG   GLU  11          1HG       GLU  11  -4.837   2.041   4.273
  563   2HG   GLU  11          2HG       GLU  11  -6.502   1.483   4.283
  564    H    GLN  12           H        GLN  12  -6.450   5.967   7.087
  565    HA   GLN  12           HA       GLN  12  -7.278   8.135   5.345
  566   1HB   GLN  12          1HB       GLN  12  -7.567   7.508   8.290
  567   2HB   GLN  12          2HB       GLN  12  -8.077   9.060   7.593
  568   1HG   GLN  12          1HG       GLN  12  -9.424   7.876   5.911
  569   2HG   GLN  12          2HG       GLN  12  -9.026   6.337   6.655
  570   1HE2  GLN  12          2HE2      GLN  12 -11.595   8.320   6.429
  571   2HE2  GLN  12          1HE2      GLN  12 -12.247   8.166   8.052
  572    H    GLN  13           H        GLN  13  -4.495   7.670   7.372
  573    HA   GLN  13           HA       GLN  13  -3.828  10.464   7.613
  574   1HB   GLN  13          1HB       GLN  13  -2.055   7.977   7.528
  575   2HB   GLN  13          2HB       GLN  13  -1.419   9.590   7.777
  576   1HG   GLN  13          1HG       GLN  13  -3.621   9.135   9.646
  577   2HG   GLN  13          2HG       GLN  13  -2.460   7.816   9.745
  578   1HE2  GLN  13          2HE2      GLN  13  -2.674  11.429   9.867
  579   2HE2  GLN  13          1HE2      GLN  13  -1.251  11.586  10.885
  580    H    ALA  14           H        ALA  14  -3.502   8.259   4.838
  581    HA   ALA  14           HA       ALA  14  -1.896  10.187   3.295
  582   1HB   ALA  14          1HB       ALA  14  -1.821   7.745   2.826
  583   2HB   ALA  14          2HB       ALA  14  -3.558   7.750   2.447
  584   3HB   ALA  14          3HB       ALA  14  -2.416   8.655   1.427
  585    H    MET  15           H        MET  15  -5.389   9.209   3.352
  586    HA   MET  15           HA       MET  15  -6.445  11.170   1.580
  587   1HB   MET  15          1HB       MET  15  -7.636  10.138   4.219
  588   2HB   MET  15          2HB       MET  15  -8.494  11.052   3.008
  589   1HG   MET  15          1HG       MET  15  -7.377   8.979   1.517
  590   2HG   MET  15          2HG       MET  15  -7.752   8.198   3.052
  591   1HE   MET  15          1HE       MET  15  -9.594  11.199   1.138
  592   2HE   MET  15          2HE       MET  15  -8.894  10.072  -0.029
  593   3HE   MET  15          3HE       MET  15 -10.659  10.225   0.103
  594    H    LYS  16           H        LYS  16  -5.726  11.636   5.162
  595    HA   LYS  16           HA       LYS  16  -6.655  14.376   5.097
  596   1HB   LYS  16          1HB       LYS  16  -5.908  12.550   7.115
  597   2HB   LYS  16          2HB       LYS  16  -4.678  13.817   7.195
  598   1HG   LYS  16          1HG       LYS  16  -6.635  15.506   7.138
  599   2HG   LYS  16          2HG       LYS  16  -7.711  14.111   7.374
  600   1HD   LYS  16          1HD       LYS  16  -6.462  13.589   9.494
  601   2HD   LYS  16          2HD       LYS  16  -5.495  15.066   9.229
  602   1HE   LYS  16          1HE       LYS  16  -7.691  16.357   9.148
  603   2HE   LYS  16          2HE       LYS  16  -8.514  14.873   9.656
  604   1HZ   LYS  16          1HZ       LYS  16  -7.134  14.912  11.686
  605   2HZ   LYS  16          2HZ       LYS  16  -6.425  16.310  11.210
  606   3HZ   LYS  16          3HZ       LYS  16  -8.016  16.278  11.561
  607    H    LEU  17           H        LEU  17  -3.494  12.865   4.602
  608    HA   LEU  17           HA       LEU  17  -1.991  15.320   4.349
  609   1HB   LEU  17          1HB       LEU  17  -1.668  12.409   3.749
  610   2HB   LEU  17          2HB       LEU  17  -0.711  13.428   2.764
  611    HG   LEU  17           HG       LEU  17  -0.753  13.512   5.823
  612   1HD1  LEU  17          1HD1      LEU  17   0.099  11.366   4.975
  613   2HD1  LEU  17          2HD1      LEU  17   1.239  12.222   3.913
  614   3HD1  LEU  17          3HD1      LEU  17   1.401  12.337   5.683
  615   1HD2  LEU  17          1HD2      LEU  17   1.215  14.733   3.835
  616   2HD2  LEU  17          2HD2      LEU  17   0.076  15.639   4.865
  617   3HD2  LEU  17          3HD2      LEU  17   1.394  14.730   5.601
  618    H    TYR  18           H        TYR  18  -3.848  13.334   2.029
  619    HA   TYR  18           HA       TYR  18  -3.363  14.842  -0.299
  620   1HB   TYR  18          1HB       TYR  18  -5.403  12.847   0.648
  621   2HB   TYR  18          2HB       TYR  18  -5.766  13.714  -0.793
  622    HD1  TYR  18           1HD      TYR  18  -3.597  13.907  -2.436
  623    HD2  TYR  18           2HD      TYR  18  -4.522  10.674   0.220
  624    HE1  TYR  18           1HE      TYR  18  -2.088  12.420  -3.730
  625    HE2  TYR  18           2HE      TYR  18  -2.879   9.225  -0.952
  626    HH   TYR  18           HH       TYR  18  -1.278   9.113  -2.600
  627    H    ARG  19           H        ARG  19  -5.861  15.386   2.224
  628    HA   ARG  19           HA       ARG  19  -7.195  17.573   0.908
  629   1HB   ARG  19          1HB       ARG  19  -6.772  17.019   3.877
  630   2HB   ARG  19          2HB       ARG  19  -7.806  18.296   3.242
  631   1HG   ARG  19          1HG       ARG  19  -9.269  16.673   2.150
  632   2HG   ARG  19          2HG       ARG  19  -8.203  15.346   2.610
  633   1HD   ARG  19          1HD       ARG  19  -9.999  15.305   4.170
  634   2HD   ARG  19          2HD       ARG  19  -8.594  15.911   5.028
  635    HE   ARG  19           HE       ARG  19  -9.570  18.039   5.211
  636   1HH1  ARG  19          1HH2      ARG  19 -11.690  16.030   3.271
  637   2HH1  ARG  19          2HH2      ARG  19 -13.025  17.139   3.425
  638   1HH2  ARG  19          1HH1      ARG  19 -11.310  19.409   5.350
  639   2HH2  ARG  19          2HH1      ARG  19 -12.806  18.999   4.566
  640    H    GLU  20           H        GLU  20  -4.369  17.634   3.106
  641    HA   GLU  20           HA       GLU  20  -4.093  20.540   2.909
  642   1HB   GLU  20          1HB       GLU  20  -3.274  18.680   4.714
  643   2HB   GLU  20          2HB       GLU  20  -1.813  18.767   3.762
  644   1HG   GLU  20          1HG       GLU  20  -1.522  20.325   5.530
  645   2HG   GLU  20          2HG       GLU  20  -1.801  21.282   4.080
  646    H    ALA  21           H        ALA  21  -2.435  17.781   1.471
  647    HA   ALA  21           HA       ALA  21  -0.572  19.125  -0.174
  648   1HB   ALA  21          1HB       ALA  21  -0.671  16.658   0.092
  649   2HB   ALA  21          2HB       ALA  21  -2.167  16.631  -0.870
  650   3HB   ALA  21          3HB       ALA  21  -0.642  17.152  -1.609
  651    H    SER  22           H        SER  22  -4.106  18.650  -0.745
  652    HA   SER  22           HA       SER  22  -4.120  19.912  -3.299
  653   1HB   SER  22          1HB       SER  22  -5.985  18.573  -2.157
  654   2HB   SER  22          2HB       SER  22  -6.407  20.074  -1.316
  655    HG   SER  22           HG       SER  22  -6.653  21.053  -3.399
  656    H    GLU  23           H        GLU  23  -3.837  21.428  -0.099
  657    HA   GLU  23           HA       GLU  23  -4.520  24.121  -1.031
  658   1HB   GLU  23          1HB       GLU  23  -4.593  23.212   1.357
  659   2HB   GLU  23          2HB       GLU  23  -2.857  23.451   1.398
  660   1HG   GLU  23          1HG       GLU  23  -4.329  25.822   0.370
  661   2HG   GLU  23          2HG       GLU  23  -4.849  25.337   1.969
  662    H    LYS  24           H        LYS  24  -1.464  22.409  -0.280
  663    HA   LYS  24           HA       LYS  24   0.274  24.465  -1.355
  664   1HB   LYS  24          1HB       LYS  24   0.735  21.507  -0.829
  665   2HB   LYS  24          2HB       LYS  24   1.989  22.618  -1.388
  666   1HG   LYS  24          1HG       LYS  24   0.988  23.990   0.807
  667   2HG   LYS  24          2HG       LYS  24   0.800  22.308   1.322
  668   1HD   LYS  24          1HD       LYS  24   3.255  21.944   0.732
  669   2HD   LYS  24          2HD       LYS  24   3.346  23.656   0.313
  670   1HE   LYS  24          1HE       LYS  24   4.020  23.984   2.417
  671   2HE   LYS  24          2HE       LYS  24   2.307  23.876   2.824
  672   1HZ   LYS  24          1HZ       LYS  24   2.670  21.493   3.308
  673   2HZ   LYS  24          2HZ       LYS  24   4.257  21.627   2.918
  674   3HZ   LYS  24          3HZ       LYS  24   3.666  22.413   4.214
  675    H    ALA  25           H        ALA  25  -1.091  21.560  -2.876
  676    HA   ALA  25           HA       ALA  25   0.177  22.152  -5.454
  677   1HB   ALA  25          1HB       ALA  25   0.007  19.806  -4.473
  678   2HB   ALA  25          2HB       ALA  25  -1.747  19.883  -4.825
  679   3HB   ALA  25          3HB       ALA  25  -0.567  20.036  -6.125
  680    H    ARG  26           H        ARG  26  -1.677  24.124  -4.600
  681    HA   ARG  26           HA       ARG  26  -4.174  24.084  -5.871
  682   1HB   ARG  26          1HB       ARG  26  -4.200  26.407  -5.579
  683   2HB   ARG  26          2HB       ARG  26  -3.300  25.760  -4.240
  684   1HG   ARG  26          1HG       ARG  26  -2.049  27.090  -6.702
  685   2HG   ARG  26          2HG       ARG  26  -2.352  27.869  -5.151
  686   1HD   ARG  26          1HD       ARG  26  -0.812  26.238  -4.049
  687   2HD   ARG  26          2HD       ARG  26  -0.415  25.578  -5.653
  688    HE   ARG  26           HE       ARG  26   0.019  28.368  -5.751
  689   1HH1  ARG  26          1HH2      ARG  26   1.475  25.586  -4.159
  690   2HH1  ARG  26          2HH2      ARG  26   3.028  26.377  -4.037
  691   1HH2  ARG  26          1HH1      ARG  26   2.040  29.284  -5.569
  692   2HH2  ARG  26          2HH1      ARG  26   3.333  28.395  -4.818
  693    H    ASN  27           H        ASN  27  -1.179  23.982  -7.490
  694    HA   ASN  27           HA       ASN  27  -2.004  25.029 -10.073
  695   1HB   ASN  27          1HB       ASN  27   0.347  24.964  -9.154
  696   2HB   ASN  27          2HB       ASN  27   0.317  23.203  -9.263
  697   1HD2  ASN  27          2HD2      ASN  27   1.201  22.392 -11.148
  698   2HD2  ASN  27          1HD2      ASN  27   1.343  23.316 -12.631
  699    HA   PRO  28           HA       PRO  28  -4.476  21.545 -11.084
  700   1HB   PRO  28          1HB       PRO  28  -4.818  21.725 -13.786
  701   2HB   PRO  28          2HB       PRO  28  -5.490  22.900 -12.616
  702   1HG   PRO  28          1HG       PRO  28  -2.896  23.113 -14.179
  703   2HG   PRO  28          2HG       PRO  28  -4.205  24.335 -14.042
  704   1HD   PRO  28          1HD       PRO  28  -2.003  24.443 -12.487
  705   2HD   PRO  28          2HD       PRO  28  -3.610  24.842 -11.803
  706    H    GLU  29           H        GLU  29  -1.252  21.546 -12.402
  707    HA   GLU  29           HA       GLU  29  -1.207  19.145 -13.872
  708   1HB   GLU  29          1HB       GLU  29   0.621  20.955 -13.426
  709   2HB   GLU  29          2HB       GLU  29   1.017  20.024 -11.998
  710   1HG   GLU  29          1HG       GLU  29   2.527  19.351 -13.715
  711   2HG   GLU  29          2HG       GLU  29   1.415  18.011 -13.472
  712    H    LYS  30           H        LYS  30  -0.879  19.643 -10.442
  713    HA   LYS  30           HA       LYS  30  -0.940  16.764  -9.795
  714   1HB   LYS  30          1HB       LYS  30   0.514  18.465  -8.568
  715   2HB   LYS  30          2HB       LYS  30  -0.984  19.168  -7.964
  716   1HG   LYS  30          1HG       LYS  30  -0.191  17.731  -6.207
  717   2HG   LYS  30          2HG       LYS  30  -1.535  16.893  -6.930
  718   1HD   LYS  30          1HD       LYS  30  -0.138  15.122  -6.987
  719   2HD   LYS  30          2HD       LYS  30   0.560  15.851  -8.430
  720   1HE   LYS  30          1HE       LYS  30   1.493  16.229  -5.553
  721   2HE   LYS  30          2HE       LYS  30   2.261  15.178  -6.749
  722   1HZ   LYS  30          1HZ       LYS  30   2.846  17.145  -8.035
  723   2HZ   LYS  30          2HZ       LYS  30   2.077  18.133  -6.968
  724   3HZ   LYS  30          3HZ       LYS  30   3.390  17.321  -6.489
  725    H    LYS  31           H        LYS  31  -3.098  19.589  -9.511
  726    HA   LYS  31           HA       LYS  31  -5.146  18.314  -8.064
  727   1HB   LYS  31          1HB       LYS  31  -4.694  20.864  -8.987
  728   2HB   LYS  31          2HB       LYS  31  -6.132  20.392  -9.892
  729   1HG   LYS  31          1HG       LYS  31  -5.751  20.365  -6.854
  730   2HG   LYS  31          2HG       LYS  31  -6.672  21.547  -7.791
  731   1HD   LYS  31          1HD       LYS  31  -8.175  19.688  -8.554
  732   2HD   LYS  31          2HD       LYS  31  -7.324  18.600  -7.427
  733   1HE   LYS  31          1HE       LYS  31  -8.008  19.919  -5.516
  734   2HE   LYS  31          2HE       LYS  31  -8.743  21.143  -6.563
  735   1HZ   LYS  31          1HZ       LYS  31 -10.353  19.505  -7.294
  736   2HZ   LYS  31          2HZ       LYS  31  -9.663  18.306  -6.429
  737   3HZ   LYS  31          3HZ       LYS  31 -10.388  19.560  -5.664
  738    H    SER  32           H        SER  32  -4.299  17.411 -11.186
  739    HA   SER  32           HA       SER  32  -6.815  15.784 -11.298
  740   1HB   SER  32          1HB       SER  32  -5.047  16.667 -13.619
  741   2HB   SER  32          2HB       SER  32  -6.471  15.615 -13.749
  742    HG   SER  32           HG       SER  32  -6.948  17.824 -14.214
  743    H    VAL  33           H        VAL  33  -4.073  15.359  -9.999
  744    HA   VAL  33           HA       VAL  33  -3.787  12.490 -10.849
  745    HB   VAL  33           HB       VAL  33  -1.638  14.374  -9.797
  746   1HG1  VAL  33          1HG1      VAL  33  -1.281  12.135  -8.843
  747   2HG1  VAL  33          2HG1      VAL  33  -1.486  11.396 -10.448
  748   3HG1  VAL  33          3HG1      VAL  33  -0.097  12.444 -10.101
  749   1HG2  VAL  33          1HG2      VAL  33  -1.852  12.903 -12.461
  750   2HG2  VAL  33          2HG2      VAL  33  -2.137  14.639 -12.227
  751   3HG2  VAL  33          3HG2      VAL  33  -0.533  13.978 -11.938
  752    H    LEU  34           H        LEU  34  -3.566  14.819  -8.013
  753    HA   LEU  34           HA       LEU  34  -3.808  12.591  -6.169
  754   1HB   LEU  34          1HB       LEU  34  -3.268  14.047  -4.617
  755   2HB   LEU  34          2HB       LEU  34  -2.657  14.992  -5.942
  756    HG   LEU  34           HG       LEU  34  -5.364  15.248  -4.692
  757   1HD1  LEU  34          1HD1      LEU  34  -3.656  15.926  -3.028
  758   2HD1  LEU  34          2HD1      LEU  34  -2.876  16.969  -4.229
  759   3HD1  LEU  34          3HD1      LEU  34  -4.496  17.354  -3.606
  760   1HD2  LEU  34          1HD2      LEU  34  -3.919  17.272  -6.423
  761   2HD2  LEU  34          2HD2      LEU  34  -5.249  16.233  -6.982
  762   3HD2  LEU  34          3HD2      LEU  34  -5.544  17.449  -5.736
  763    H    GLN  35           H        GLN  35  -6.094  14.413  -8.060
  764    HA   GLN  35           HA       GLN  35  -8.400  14.057  -6.406
  765   1HB   GLN  35          1HB       GLN  35  -8.093  15.675  -8.302
  766   2HB   GLN  35          2HB       GLN  35  -8.155  14.332  -9.435
  767   1HG   GLN  35          1HG       GLN  35 -10.305  15.383  -9.422
  768   2HG   GLN  35          2HG       GLN  35 -10.486  13.815  -8.645
  769   1HE2  GLN  35          2HE2      GLN  35 -12.262  14.275  -7.291
  770   2HE2  GLN  35          1HE2      GLN  35 -12.220  15.535  -6.068
  771    H    LYS  36           H        LYS  36  -7.043  12.051  -9.073
  772    HA   LYS  36           HA       LYS  36  -9.154  10.058  -8.915
  773   1HB   LYS  36          1HB       LYS  36  -7.663   8.727 -10.429
  774   2HB   LYS  36          2HB       LYS  36  -8.039  10.344 -11.024
  775   1HG   LYS  36          1HG       LYS  36  -5.832  11.166 -10.376
  776   2HG   LYS  36          2HG       LYS  36  -5.448   9.631  -9.594
  777   1HD   LYS  36          1HD       LYS  36  -4.287   9.647 -11.643
  778   2HD   LYS  36          2HD       LYS  36  -5.632   8.519 -11.864
  779   1HE   LYS  36          1HE       LYS  36  -6.918  10.283 -13.051
  780   2HE   LYS  36          2HE       LYS  36  -5.619  11.446 -12.751
  781   1HZ   LYS  36          1HZ       LYS  36  -4.148  10.054 -14.110
  782   2HZ   LYS  36          2HZ       LYS  36  -5.352   8.987 -14.399
  783   3HZ   LYS  36          3HZ       LYS  36  -5.451  10.510 -14.978
  784    H    ILE  37           H        ILE  37  -6.001  10.316  -7.331
  785    HA   ILE  37           HA       ILE  37  -6.199   7.705  -5.987
  786    HB   ILE  37           HB       ILE  37  -4.735  10.286  -5.312
  787   1HG1  ILE  37          1HG1      ILE  37  -3.603   7.777  -6.525
  788   2HG1  ILE  37          2HG1      ILE  37  -3.946   9.298  -7.363
  789   1HG2  ILE  37          1HG2      ILE  37  -4.969   9.158  -3.223
  790   2HG2  ILE  37          2HG2      ILE  37  -4.772   7.566  -3.972
  791   3HG2  ILE  37          3HG2      ILE  37  -3.385   8.624  -3.779
  792   1HD1  ILE  37          1HD1      ILE  37  -2.294  10.429  -5.811
  793   2HD1  ILE  37          2HD1      ILE  37  -1.785   8.788  -5.321
  794   3HD1  ILE  37          3HD1      ILE  37  -1.629   9.295  -7.000
  795    H    LEU  38           H        LEU  38  -7.164  11.097  -5.003
  796    HA   LEU  38           HA       LEU  38  -8.256  10.420  -2.519
  797   1HB   LEU  38          1HB       LEU  38  -8.857  12.543  -4.573
  798   2HB   LEU  38          2HB       LEU  38  -9.976  12.354  -3.243
  799    HG   LEU  38           HG       LEU  38  -6.992  12.817  -2.829
  800   1HD1  LEU  38          1HD1      LEU  38  -8.038  14.732  -3.995
  801   2HD1  LEU  38          2HD1      LEU  38  -9.305  14.803  -2.748
  802   3HD1  LEU  38          3HD1      LEU  38  -7.608  15.142  -2.329
  803   1HD2  LEU  38          1HD2      LEU  38  -9.435  12.766  -1.010
  804   2HD2  LEU  38          2HD2      LEU  38  -7.893  11.883  -0.844
  805   3HD2  LEU  38          3HD2      LEU  38  -7.962  13.621  -0.549
  806    H    GLU  39           H        GLU  39  -9.950  10.120  -5.712
  807    HA   GLU  39           HA       GLU  39 -12.359   9.140  -4.460
  808   1HB   GLU  39          1HB       GLU  39 -11.263   8.941  -7.308
  809   2HB   GLU  39          2HB       GLU  39 -12.837   8.292  -6.836
  810   1HG   GLU  39          1HG       GLU  39 -13.584  10.531  -6.118
  811   2HG   GLU  39          2HG       GLU  39 -12.024  11.214  -6.576
  812    H    ASP  40           H        ASP  40  -9.471   7.419  -5.590
  813    HA   ASP  40           HA       ASP  40 -10.525   4.752  -5.207
  814   1HB   ASP  40          1HB       ASP  40  -7.861   6.146  -5.597
  815   2HB   ASP  40          2HB       ASP  40  -7.837   4.589  -4.941
  816    H    GLU  41           H        GLU  41  -8.946   7.136  -3.063
  817    HA   GLU  41           HA       GLU  41  -8.532   5.090  -0.973
  818   1HB   GLU  41          1HB       GLU  41  -8.325   8.105  -0.779
  819   2HB   GLU  41          2HB       GLU  41  -7.863   6.957   0.478
  820   1HG   GLU  41          1HG       GLU  41  -6.500   7.304  -2.209
  821   2HG   GLU  41          2HG       GLU  41  -5.934   7.909  -0.667
  822    H    GLU  42           H        GLU  42 -10.912   7.684  -1.586
  823    HA   GLU  42           HA       GLU  42 -12.500   7.310   0.748
  824   1HB   GLU  42          1HB       GLU  42 -12.725   9.141  -0.935
  825   2HB   GLU  42          2HB       GLU  42 -13.427   7.984  -2.076
  826   1HG   GLU  42          1HG       GLU  42 -15.308   7.582  -0.515
  827   2HG   GLU  42          2HG       GLU  42 -14.567   8.660   0.673
  828    H    LYS  43           H        LYS  43 -12.365   5.434  -2.271
  829    HA   LYS  43           HA       LYS  43 -14.552   3.660  -1.671
  830   1HB   LYS  43          1HB       LYS  43 -13.001   4.128  -3.894
  831   2HB   LYS  43          2HB       LYS  43 -12.258   2.648  -3.318
  832   1HG   LYS  43          1HG       LYS  43 -13.917   2.049  -4.895
  833   2HG   LYS  43          2HG       LYS  43 -14.582   1.606  -3.318
  834   1HD   LYS  43          1HD       LYS  43 -16.024   3.566  -3.296
  835   2HD   LYS  43          2HD       LYS  43 -15.250   4.235  -4.735
  836   1HE   LYS  43          1HE       LYS  43 -16.757   1.582  -4.695
  837   2HE   LYS  43          2HE       LYS  43 -17.524   3.131  -5.052
  838   1HZ   LYS  43          1HZ       LYS  43 -16.013   3.398  -6.935
  839   2HZ   LYS  43          2HZ       LYS  43 -15.303   1.954  -6.635
  840   3HZ   LYS  43          3HZ       LYS  43 -16.867   2.019  -7.090
  841    H    HIS  44           H        HIS  44 -10.974   3.339  -0.952
  842    HA   HIS  44           HA       HIS  44 -11.101   0.793   0.210
  843   1HB   HIS  44          1HB       HIS  44  -9.333   3.216   0.817
  844   2HB   HIS  44          2HB       HIS  44  -9.044   1.556   1.217
  845    HD2  HIS  44           2HD      HIS  44 -10.215   0.988  -2.055
  846    HE1  HIS  44           1HE      HIS  44  -6.224   2.169  -2.859
  847    HE2  HIS  44           2HE      HIS  44  -8.349   1.175  -3.848
  848    H    ILE  45           H        ILE  45 -11.566   4.049   1.628
  849    HA   ILE  45           HA       ILE  45 -11.814   3.223   4.343
  850    HB   ILE  45           HB       ILE  45 -12.412   5.661   2.727
  851   1HG1  ILE  45          1HG1      ILE  45 -11.146   6.746   4.555
  852   2HG1  ILE  45          2HG1      ILE  45 -11.084   5.220   5.432
  853   1HG2  ILE  45          1HG2      ILE  45 -14.513   5.578   3.942
  854   2HG2  ILE  45          2HG2      ILE  45 -13.655   5.294   5.477
  855   3HG2  ILE  45          3HG2      ILE  45 -13.483   6.838   4.612
  856   1HD1  ILE  45          1HD1      ILE  45  -9.663   4.255   3.619
  857   2HD1  ILE  45          2HD1      ILE  45  -9.703   5.844   2.806
  858   3HD1  ILE  45          3HD1      ILE  45  -8.949   5.678   4.385
  859    H    GLU  46           H        GLU  46 -14.384   3.398   1.810
  860    HA   GLU  46           HA       GLU  46 -16.539   2.632   3.537
  861   1HB   GLU  46          1HB       GLU  46 -16.008   2.338   0.557
  862   2HB   GLU  46          2HB       GLU  46 -17.479   1.750   1.299
  863   1HG   GLU  46          1HG       GLU  46 -16.576   4.642   1.523
  864   2HG   GLU  46          2HG       GLU  46 -17.587   4.032   0.212
  865    H    TRP  47           H        TRP  47 -14.186   0.635   1.706
  866    HA   TRP  47           HA       TRP  47 -15.436  -1.879   2.355
  867   1HB   TRP  47          1HB       TRP  47 -12.562  -1.293   1.585
  868   2HB   TRP  47          2HB       TRP  47 -13.407  -2.815   1.458
  869    HD1  TRP  47           1HD      TRP  47 -15.987  -0.960   0.021
  870    HE1  TRP  47           1HE      TRP  47 -15.713  -0.469  -2.483
  871    HE3  TRP  47           3HE      TRP  47 -11.054  -2.001  -0.430
  872    HZ2  TRP  47           2HZ      TRP  47 -13.576  -0.600  -4.472
  873    HZ3  TRP  47           3HZ      TRP  47  -9.862  -1.806  -2.604
  874    HH2  TRP  47           2HH      TRP  47 -11.129  -1.091  -4.645
  875    H    LEU  48           H        LEU  48 -12.760   0.002   3.779
  876    HA   LEU  48           HA       LEU  48 -11.989  -1.745   5.874
  877   1HB   LEU  48          1HB       LEU  48 -11.773   1.134   5.177
  878   2HB   LEU  48          2HB       LEU  48 -11.909   0.898   6.883
  879    HG   LEU  48           HG       LEU  48  -9.676   1.060   6.304
  880   1HD1  LEU  48          1HD1      LEU  48  -8.700  -0.885   7.335
  881   2HD1  LEU  48          2HD1      LEU  48 -10.285  -0.627   8.088
  882   3HD1  LEU  48          3HD1      LEU  48 -10.068  -1.907   6.880
  883   1HD2  LEU  48          1HD2      LEU  48  -9.997  -1.318   4.437
  884   2HD2  LEU  48          2HD2      LEU  48  -9.681   0.366   3.971
  885   3HD2  LEU  48          3HD2      LEU  48  -8.462  -0.543   4.873
  886    H    GLU  49           H        GLU  49 -14.410   0.869   5.932
  887    HA   GLU  49           HA       GLU  49 -15.547   0.251   8.458
  888   1HB   GLU  49          1HB       GLU  49 -16.063   2.198   6.697
  889   2HB   GLU  49          2HB       GLU  49 -17.380   1.137   6.227
  890   1HG   GLU  49          1HG       GLU  49 -18.057   0.993   8.674
  891   2HG   GLU  49          2HG       GLU  49 -16.825   2.203   9.038
  892    H    THR  50           H        THR  50 -16.554  -1.067   5.218
  893    HA   THR  50           HA       THR  50 -18.557  -2.790   6.168
  894    HB   THR  50           HB       THR  50 -16.648  -3.119   3.821
  895    HG1  THR  50           1HG      THR  50 -17.810  -1.223   3.677
  896   1HG2  THR  50          1HG2      THR  50 -17.778  -5.206   4.166
  897   2HG2  THR  50          2HG2      THR  50 -19.343  -4.368   4.386
  898   3HG2  THR  50          3HG2      THR  50 -18.525  -4.362   2.795
  899    H    ILE  51           H        ILE  51 -15.106  -3.227   6.281
  900    HA   ILE  51           HA       ILE  51 -15.270  -6.006   7.226
  901    HB   ILE  51           HB       ILE  51 -13.026  -4.093   6.572
  902   1HG1  ILE  51          1HG1      ILE  51 -14.159  -5.221   4.685
  903   2HG1  ILE  51          2HG1      ILE  51 -12.458  -5.628   4.813
  904   1HG2  ILE  51          1HG2      ILE  51 -12.057  -5.230   8.428
  905   2HG2  ILE  51          2HG2      ILE  51 -12.601  -6.815   7.840
  906   3HG2  ILE  51          3HG2      ILE  51 -11.357  -5.901   6.957
  907   1HD1  ILE  51          1HD1      ILE  51 -13.069  -7.834   5.811
  908   2HD1  ILE  51          2HD1      ILE  51 -14.789  -7.419   5.639
  909   3HD1  ILE  51          3HD1      ILE  51 -13.769  -7.592   4.207
  910    H    ASN  52           H        ASN  52 -15.254  -3.013   8.740
  911    HA   ASN  52           HA       ASN  52 -14.177  -3.979  11.301
  912   1HB   ASN  52          1HB       ASN  52 -13.679  -1.705  10.438
  913   2HB   ASN  52          2HB       ASN  52 -15.382  -1.275  10.618
  914   1HD2  ASN  52          2HD2      ASN  52 -14.216   0.446  12.004
  915   2HD2  ASN  52          1HD2      ASN  52 -13.967   0.011  13.690
  916    H    GLY  53           H        GLY  53 -15.662  -5.683  11.623
  917   1HA   GLY  53          1HA       GLY  53 -18.417  -5.739  11.930
  918   2HA   GLY  53          2HA       GLY  53 -17.301  -6.702  12.893
  Start of MODEL   17
    1   1H    MET   1          1H        MET   1  10.417  19.357  -5.879
    2   2H    MET   1          2H        MET   1   9.943  17.782  -5.883
    3   3H    MET   1          3H        MET   1   9.451  18.785  -7.065
    4    HA   MET   1           HA       MET   1   8.138  20.098  -5.603
    5   1HB   MET   1          1HB       MET   1   7.506  17.129  -5.357
    6   2HB   MET   1          2HB       MET   1   6.447  18.426  -4.818
    7   1HG   MET   1          1HG       MET   1   5.659  17.799  -6.942
    8   2HG   MET   1          2HG       MET   1   6.437  19.365  -7.126
    9   1HE   MET   1          1HE       MET   1   6.233  18.931  -9.769
   10   2HE   MET   1          2HE       MET   1   7.678  19.829  -9.250
   11   3HE   MET   1          3HE       MET   1   7.817  18.569 -10.493
   12    H    ASP   2           H        ASP   2  10.127  17.751  -3.730
   13    HA   ASP   2           HA       ASP   2  10.467  17.462  -1.552
   14   1HB   ASP   2          1HB       ASP   2  11.348  19.788  -1.867
   15   2HB   ASP   2          2HB       ASP   2   9.835  20.409  -1.212
   16    H    TYR   3           H        TYR   3   7.787  17.044  -2.577
   17    HA   TYR   3           HA       TYR   3   6.253  16.675  -0.101
   18   1HB   TYR   3          1HB       TYR   3   5.905  19.081  -1.221
   19   2HB   TYR   3          2HB       TYR   3   4.892  18.199  -2.341
   20    HD1  TYR   3           1HD      TYR   3   2.598  18.499  -1.762
   21    HD2  TYR   3           2HD      TYR   3   5.534  18.149   1.387
   22    HE1  TYR   3           1HE      TYR   3   0.826  18.764  -0.058
   23    HE2  TYR   3           2HE      TYR   3   3.743  18.339   3.089
   24    HH   TYR   3           HH       TYR   3   1.527  18.628   3.477
   25    H    LEU   4           H        LEU   4   7.449  14.813  -1.370
   26    HA   LEU   4           HA       LEU   4   5.228  13.188  -2.401
   27   1HB   LEU   4          1HB       LEU   4   6.461  12.209  -4.193
   28   2HB   LEU   4          2HB       LEU   4   6.385  13.946  -4.376
   29    HG   LEU   4           HG       LEU   4   8.792  13.585  -2.995
   30   1HD1  LEU   4          1HD1      LEU   4   8.689  11.130  -3.393
   31   2HD1  LEU   4          2HD1      LEU   4   8.565  11.429  -5.135
   32   3HD1  LEU   4          3HD1      LEU   4  10.041  11.885  -4.249
   33   1HD2  LEU   4          1HD2      LEU   4   8.300  13.880  -5.963
   34   2HD2  LEU   4          2HD2      LEU   4   8.490  15.169  -4.762
   35   3HD2  LEU   4          3HD2      LEU   4   9.871  14.133  -5.154
   36    H    ARG   5           H        ARG   5   8.683  12.900  -1.270
   37    HA   ARG   5           HA       ARG   5   8.474  10.265  -0.269
   38   1HB   ARG   5          1HB       ARG   5  10.555  11.841  -0.479
   39   2HB   ARG   5          2HB       ARG   5  10.092  12.441   1.113
   40   1HG   ARG   5          1HG       ARG   5  10.084   9.830   1.741
   41   2HG   ARG   5          2HG       ARG   5  11.037   9.694   0.267
   42   1HD   ARG   5          1HD       ARG   5  12.660   9.891   1.918
   43   2HD   ARG   5          2HD       ARG   5  12.550  11.551   1.309
   44    HE   ARG   5           HE       ARG   5  10.715  11.292   3.465
   45   1HH1  ARG   5          1HH2      ARG   5  14.199  11.243   3.099
   46   2HH1  ARG   5          2HH2      ARG   5  14.469  11.652   4.771
   47   1HH2  ARG   5          1HH1      ARG   5  11.134  11.803   5.588
   48   2HH2  ARG   5          2HH1      ARG   5  12.776  11.963   6.131
   49    H    GLU   6           H        GLU   6   7.714  13.316   1.308
   50    HA   GLU   6           HA       GLU   6   6.987  12.364   3.866
   51   1HB   GLU   6          1HB       GLU   6   7.269  14.822   2.641
   52   2HB   GLU   6          2HB       GLU   6   5.532  14.753   2.749
   53   1HG   GLU   6          1HG       GLU   6   6.810  13.929   5.298
   54   2HG   GLU   6          2HG       GLU   6   7.438  15.464   4.749
   55    H    LEU   7           H        LEU   7   5.239  12.134   0.884
   56    HA   LEU   7           HA       LEU   7   2.652  11.471   2.199
   57   1HB   LEU   7          1HB       LEU   7   3.289  11.434  -0.775
   58   2HB   LEU   7          2HB       LEU   7   1.719  11.506   0.007
   59    HG   LEU   7           HG       LEU   7   3.805  13.711  -0.221
   60   1HD1  LEU   7          1HD1      LEU   7   2.409  13.278  -2.208
   61   2HD1  LEU   7          2HD1      LEU   7   0.939  13.480  -1.227
   62   3HD1  LEU   7          3HD1      LEU   7   2.041  14.853  -1.481
   63   1HD2  LEU   7          1HD2      LEU   7   1.157  13.822   1.268
   64   2HD2  LEU   7          2HD2      LEU   7   2.778  13.956   1.991
   65   3HD2  LEU   7          3HD2      LEU   7   2.207  15.212   0.890
   66    H    TYR   8           H        TYR   8   5.009  10.078  -0.057
   67    HA   TYR   8           HA       TYR   8   4.204   7.452  -0.441
   68   1HB   TYR   8          1HB       TYR   8   6.379   9.057  -1.041
   69   2HB   TYR   8          2HB       TYR   8   7.133   8.067   0.139
   70    HD1  TYR   8           1HD      TYR   8   6.478   5.333  -0.383
   71    HD2  TYR   8           2HD      TYR   8   7.062   8.578  -3.159
   72    HE1  TYR   8           1HE      TYR   8   7.175   3.717  -2.145
   73    HE2  TYR   8           2HE      TYR   8   7.750   6.952  -4.909
   74    HH   TYR   8           HH       TYR   8   7.923   3.428  -4.268
   75    H    LYS   9           H        LYS   9   6.138   8.656   2.311
   76    HA   LYS   9           HA       LYS   9   6.616   6.059   3.345
   77   1HB   LYS   9          1HB       LYS   9   7.580   8.557   3.937
   78   2HB   LYS   9          2HB       LYS   9   6.420   8.438   5.240
   79   1HG   LYS   9          1HG       LYS   9   8.535   7.786   6.077
   80   2HG   LYS   9          2HG       LYS   9   7.585   6.296   5.969
   81   1HD   LYS   9          1HD       LYS   9   8.831   5.525   4.069
   82   2HD   LYS   9          2HD       LYS   9   9.406   7.149   3.686
   83   1HE   LYS   9          1HE       LYS   9  11.255   5.904   4.556
   84   2HE   LYS   9          2HE       LYS   9  10.825   7.183   5.692
   85   1HZ   LYS   9          1HZ       LYS   9   9.686   5.502   7.049
   86   2HZ   LYS   9          2HZ       LYS   9  10.072   4.319   5.981
   87   3HZ   LYS   9          3HZ       LYS   9  11.242   5.078   6.824
   88    H    LEU  10           H        LEU  10   4.082   8.276   4.532
   89    HA   LEU  10           HA       LEU  10   2.872   6.302   6.134
   90   1HB   LEU  10          1HB       LEU  10   1.739   8.882   4.996
   91   2HB   LEU  10          2HB       LEU  10   0.933   7.845   6.173
   92    HG   LEU  10           HG       LEU  10   3.365   8.100   7.400
   93   1HD1  LEU  10          1HD1      LEU  10   4.313   9.695   5.810
   94   2HD1  LEU  10          2HD1      LEU  10   2.917  10.758   6.009
   95   3HD1  LEU  10          3HD1      LEU  10   4.028  10.480   7.362
   96   1HD2  LEU  10          1HD2      LEU  10   1.043  10.049   7.648
   97   2HD2  LEU  10          2HD2      LEU  10   1.190   8.468   8.457
   98   3HD2  LEU  10          3HD2      LEU  10   2.309   9.775   8.865
   99    H    GLU  11           H        GLU  11   2.372   7.205   2.739
  100    HA   GLU  11           HA       GLU  11   0.275   5.353   2.132
  101   1HB   GLU  11          1HB       GLU  11   2.355   6.934   0.699
  102   2HB   GLU  11          2HB       GLU  11   1.829   5.612  -0.216
  103   1HG   GLU  11          1HG       GLU  11  -0.015   7.711   1.070
  104   2HG   GLU  11          2HG       GLU  11   0.614   7.827  -0.561
  105    H    GLN  12           H        GLN  12   3.887   4.719   2.391
  106    HA   GLN  12           HA       GLN  12   3.381   1.933   1.826
  107   1HB   GLN  12          1HB       GLN  12   5.797   3.567   2.578
  108   2HB   GLN  12          2HB       GLN  12   5.832   1.792   2.579
  109   1HG   GLN  12          1HG       GLN  12   4.909   1.804   0.266
  110   2HG   GLN  12          2HG       GLN  12   5.103   3.537   0.214
  111   1HE2  GLN  12          2HE2      GLN  12   6.568   0.875  -0.976
  112   2HE2  GLN  12          1HE2      GLN  12   8.254   1.343  -0.827
  113    H    GLN  13           H        GLN  13   3.443   3.801   4.757
  114    HA   GLN  13           HA       GLN  13   3.930   1.563   6.534
  115   1HB   GLN  13          1HB       GLN  13   2.416   4.199   6.937
  116   2HB   GLN  13          2HB       GLN  13   2.660   3.040   8.227
  117   1HG   GLN  13          1HG       GLN  13   5.219   3.697   6.936
  118   2HG   GLN  13          2HG       GLN  13   4.385   5.140   7.499
  119   1HE2  GLN  13          2HE2      GLN  13   4.404   5.601   9.733
  120   2HE2  GLN  13          1HE2      GLN  13   5.062   4.483  10.916
  121    H    ALA  14           H        ALA  14   0.908   2.776   5.037
  122    HA   ALA  14           HA       ALA  14  -0.734   0.730   6.348
  123   1HB   ALA  14          1HB       ALA  14  -1.717   2.791   5.363
  124   2HB   ALA  14          2HB       ALA  14  -1.127   2.318   3.752
  125   3HB   ALA  14          3HB       ALA  14  -2.358   1.336   4.575
  126    H    MET  15           H        MET  15   1.134   0.933   3.281
  127    HA   MET  15           HA       MET  15   0.306  -1.614   2.241
  128   1HB   MET  15          1HB       MET  15   1.415   0.181   0.926
  129   2HB   MET  15          2HB       MET  15   2.926  -0.133   1.781
  130   1HG   MET  15          1HG       MET  15   3.477  -1.834   0.479
  131   2HG   MET  15          2HG       MET  15   1.907  -2.609   0.643
  132   1HE   MET  15          1HE       MET  15   0.042  -2.553  -0.870
  133   2HE   MET  15          2HE       MET  15  -0.234  -0.833  -0.534
  134   3HE   MET  15          3HE       MET  15  -0.222  -1.428  -2.212
  135    H    LYS  16           H        LYS  16   3.160  -0.867   4.379
  136    HA   LYS  16           HA       LYS  16   4.039  -3.635   4.406
  137   1HB   LYS  16          1HB       LYS  16   4.603  -1.175   6.077
  138   2HB   LYS  16          2HB       LYS  16   5.148  -2.777   6.600
  139   1HG   LYS  16          1HG       LYS  16   6.194  -3.075   4.280
  140   2HG   LYS  16          2HG       LYS  16   5.922  -1.344   4.019
  141   1HD   LYS  16          1HD       LYS  16   7.390  -0.803   5.912
  142   2HD   LYS  16          2HD       LYS  16   7.500  -2.521   6.356
  143   1HE   LYS  16          1HE       LYS  16   8.509  -2.991   4.095
  144   2HE   LYS  16          2HE       LYS  16   8.548  -1.251   3.788
  145   1HZ   LYS  16          1HZ       LYS  16  10.014  -1.024   5.734
  146   2HZ   LYS  16          2HZ       LYS  16   9.963  -2.635   6.013
  147   3HZ   LYS  16          3HZ       LYS  16  10.671  -2.063   4.661
  148    H    LEU  17           H        LEU  17   1.871  -1.745   6.489
  149    HA   LEU  17           HA       LEU  17   1.334  -3.879   8.331
  150   1HB   LEU  17          1HB       LEU  17   0.259  -1.226   7.650
  151   2HB   LEU  17          2HB       LEU  17  -1.014  -2.288   8.039
  152    HG   LEU  17           HG       LEU  17   1.454  -1.795   9.774
  153   1HD1  LEU  17          1HD1      LEU  17  -0.096   0.137   9.507
  154   2HD1  LEU  17          2HD1      LEU  17  -1.409  -0.852  10.172
  155   3HD1  LEU  17          3HD1      LEU  17   0.014  -0.463  11.170
  156   1HD2  LEU  17          1HD2      LEU  17  -1.110  -3.319  10.445
  157   2HD2  LEU  17          2HD2      LEU  17   0.511  -4.022  10.297
  158   3HD2  LEU  17          3HD2      LEU  17   0.167  -2.886  11.597
  159    H    TYR  18           H        TYR  18  -0.324  -2.964   5.292
  160    HA   TYR  18           HA       TYR  18  -2.171  -5.060   5.134
  161   1HB   TYR  18          1HB       TYR  18  -0.833  -3.175   3.220
  162   2HB   TYR  18          2HB       TYR  18  -1.663  -4.513   2.532
  163    HD1  TYR  18           1HD      TYR  18  -4.060  -4.969   3.875
  164    HD2  TYR  18           2HD      TYR  18  -2.153  -1.200   3.090
  165    HE1  TYR  18           1HE      TYR  18  -6.240  -3.827   4.153
  166    HE2  TYR  18           2HE      TYR  18  -4.293  -0.017   3.467
  167    HH   TYR  18           HH       TYR  18  -6.531  -0.247   4.005
  168    H    ARG  19           H        ARG  19   1.238  -5.068   4.038
  169    HA   ARG  19           HA       ARG  19   1.305  -7.652   2.868
  170   1HB   ARG  19          1HB       ARG  19   3.024  -5.911   2.650
  171   2HB   ARG  19          2HB       ARG  19   3.462  -6.096   4.348
  172   1HG   ARG  19          1HG       ARG  19   4.311  -8.344   3.955
  173   2HG   ARG  19          2HG       ARG  19   3.767  -8.290   2.260
  174   1HD   ARG  19          1HD       ARG  19   5.276  -6.439   1.784
  175   2HD   ARG  19          2HD       ARG  19   5.729  -6.307   3.495
  176    HE   ARG  19           HE       ARG  19   6.369  -8.927   2.767
  177   1HH1  ARG  19          1HH2      ARG  19   7.422  -5.759   1.696
  178   2HH1  ARG  19          2HH2      ARG  19   9.028  -6.320   1.317
  179   1HH2  ARG  19          1HH1      ARG  19   8.445  -9.570   2.273
  180   2HH2  ARG  19          2HH1      ARG  19   9.584  -8.418   1.639
  181    H    GLU  20           H        GLU  20   1.367  -6.818   6.293
  182    HA   GLU  20           HA       GLU  20   1.922  -9.639   7.080
  183   1HB   GLU  20          1HB       GLU  20   2.813  -7.315   8.080
  184   2HB   GLU  20          2HB       GLU  20   1.344  -7.370   9.010
  185   1HG   GLU  20          1HG       GLU  20   3.423  -9.608   8.929
  186   2HG   GLU  20          2HG       GLU  20   3.420  -8.315  10.121
  187    H    ALA  21           H        ALA  21  -0.588  -7.180   7.473
  188    HA   ALA  21           HA       ALA  21  -2.635  -8.738   8.665
  189   1HB   ALA  21          1HB       ALA  21  -2.784  -6.312   8.287
  190   2HB   ALA  21          2HB       ALA  21  -2.880  -6.579   6.529
  191   3HB   ALA  21          3HB       ALA  21  -4.184  -7.150   7.582
  192    H    SER  22           H        SER  22  -1.539  -8.662   5.248
  193    HA   SER  22           HA       SER  22  -3.504 -10.381   4.147
  194   1HB   SER  22          1HB       SER  22  -1.795  -9.163   2.841
  195   2HB   SER  22          2HB       SER  22  -0.546 -10.254   3.468
  196    HG   SER  22           HG       SER  22  -2.775 -10.897   1.801
  197    H    GLU  23           H        GLU  23  -0.642 -11.325   6.150
  198    HA   GLU  23           HA       GLU  23  -1.014 -14.186   5.713
  199   1HB   GLU  23          1HB       GLU  23   1.065 -12.883   6.612
  200   2HB   GLU  23          2HB       GLU  23   0.237 -12.938   8.166
  201   1HG   GLU  23          1HG       GLU  23   0.049 -15.460   7.884
  202   2HG   GLU  23          2HG       GLU  23   1.058 -15.315   6.448
  203    H    LYS  24           H        LYS  24  -2.007 -11.930   8.289
  204    HA   LYS  24           HA       LYS  24  -3.516 -13.799   9.891
  205   1HB   LYS  24          1HB       LYS  24  -3.914 -10.810   9.502
  206   2HB   LYS  24          2HB       LYS  24  -4.620 -11.764  10.796
  207   1HG   LYS  24          1HG       LYS  24  -1.617 -11.329  10.442
  208   2HG   LYS  24          2HG       LYS  24  -2.683 -10.333  11.416
  209   1HD   LYS  24          1HD       LYS  24  -1.817 -11.687  13.026
  210   2HD   LYS  24          2HD       LYS  24  -3.322 -12.533  12.666
  211   1HE   LYS  24          1HE       LYS  24  -2.039 -14.114  11.200
  212   2HE   LYS  24          2HE       LYS  24  -0.559 -13.213  11.545
  213   1HZ   LYS  24          1HZ       LYS  24  -0.824 -13.808  13.895
  214   2HZ   LYS  24          2HZ       LYS  24  -2.188 -14.649  13.578
  215   3HZ   LYS  24          3HZ       LYS  24  -0.755 -15.156  12.983
  216    H    ALA  25           H        ALA  25  -4.438 -11.927   7.057
  217    HA   ALA  25           HA       ALA  25  -7.253 -12.665   7.204
  218   1HB   ALA  25          1HB       ALA  25  -6.490 -10.388   6.638
  219   2HB   ALA  25          2HB       ALA  25  -5.674 -11.019   5.185
  220   3HB   ALA  25          3HB       ALA  25  -7.437 -11.088   5.318
  221    H    ARG  26           H        ARG  26  -5.011 -14.696   6.361
  222    HA   ARG  26           HA       ARG  26  -5.267 -15.767   3.813
  223   1HB   ARG  26          1HB       ARG  26  -4.535 -17.848   4.834
  224   2HB   ARG  26          2HB       ARG  26  -3.724 -16.468   5.567
  225   1HG   ARG  26          1HG       ARG  26  -5.533 -16.561   7.421
  226   2HG   ARG  26          2HG       ARG  26  -6.017 -18.117   6.757
  227   1HD   ARG  26          1HD       ARG  26  -3.096 -17.711   7.289
  228   2HD   ARG  26          2HD       ARG  26  -4.169 -17.682   8.689
  229    HE   ARG  26           HE       ARG  26  -4.364 -19.974   6.790
  230   1HH1  ARG  26          1HH2      ARG  26  -3.394 -18.939  10.002
  231   2HH1  ARG  26          2HH2      ARG  26  -3.320 -20.573  10.599
  232   1HH2  ARG  26          1HH1      ARG  26  -4.248 -22.027   7.630
  233   2HH2  ARG  26          2HH1      ARG  26  -3.781 -22.263   9.288
  234    H    ASN  27           H        ASN  27  -7.973 -15.730   5.929
  235    HA   ASN  27           HA       ASN  27  -9.436 -17.889   4.655
  236   1HB   ASN  27          1HB       ASN  27  -9.975 -16.864   6.890
  237   2HB   ASN  27          2HB       ASN  27 -10.436 -15.373   6.067
  238   1HD2  ASN  27          2HD2      ASN  27 -12.674 -15.265   6.135
  239   2HD2  ASN  27          1HD2      ASN  27 -13.723 -16.633   5.799
  240    HA   PRO  28           HA       PRO  28  -9.412 -15.810   0.771
  241   1HB   PRO  28          1HB       PRO  28 -11.353 -17.139  -0.685
  242   2HB   PRO  28          2HB       PRO  28  -9.715 -17.759  -0.319
  243   1HG   PRO  28          1HG       PRO  28 -12.299 -18.333   1.145
  244   2HG   PRO  28          2HG       PRO  28 -11.029 -19.491   0.636
  245   1HD   PRO  28          1HD       PRO  28 -11.169 -18.551   3.170
  246   2HD   PRO  28          2HD       PRO  28  -9.580 -18.798   2.378
  247    H    GLU  29           H        GLU  29 -12.551 -15.987   2.388
  248    HA   GLU  29           HA       GLU  29 -14.029 -13.992   1.146
  249   1HB   GLU  29          1HB       GLU  29 -14.313 -15.527   3.350
  250   2HB   GLU  29          2HB       GLU  29 -13.815 -14.059   4.155
  251   1HG   GLU  29          1HG       GLU  29 -16.152 -13.964   4.183
  252   2HG   GLU  29          2HG       GLU  29 -15.705 -12.855   2.893
  253    H    LYS  30           H        LYS  30 -11.298 -13.576   3.248
  254    HA   LYS  30           HA       LYS  30 -11.457 -10.602   3.170
  255   1HB   LYS  30          1HB       LYS  30 -11.251 -12.095   5.372
  256   2HB   LYS  30          2HB       LYS  30  -9.561 -12.167   4.923
  257   1HG   LYS  30          1HG       LYS  30  -9.595 -10.310   6.340
  258   2HG   LYS  30          2HG       LYS  30  -9.707  -9.546   4.758
  259   1HD   LYS  30          1HD       LYS  30 -11.309  -8.455   6.144
  260   2HD   LYS  30          2HD       LYS  30 -12.260  -9.513   5.090
  261   1HE   LYS  30          1HE       LYS  30 -12.305 -11.232   6.932
  262   2HE   LYS  30          2HE       LYS  30 -11.382 -10.130   7.957
  263   1HZ   LYS  30          1HZ       LYS  30 -13.243  -8.564   7.834
  264   2HZ   LYS  30          2HZ       LYS  30 -14.099  -9.584   6.879
  265   3HZ   LYS  30          3HZ       LYS  30 -13.756  -9.996   8.419
  266    H    LYS  31           H        LYS  31  -9.166 -13.249   2.520
  267    HA   LYS  31           HA       LYS  31  -7.053 -11.635   1.555
  268   1HB   LYS  31          1HB       LYS  31  -6.949 -14.056   2.136
  269   2HB   LYS  31          2HB       LYS  31  -7.799 -14.438   0.652
  270   1HG   LYS  31          1HG       LYS  31  -5.332 -12.771   0.318
  271   2HG   LYS  31          2HG       LYS  31  -5.071 -14.378   0.995
  272   1HD   LYS  31          1HD       LYS  31  -6.246 -15.429  -0.878
  273   2HD   LYS  31          2HD       LYS  31  -6.565 -13.842  -1.607
  274   1HE   LYS  31          1HE       LYS  31  -4.166 -13.422  -1.865
  275   2HE   LYS  31          2HE       LYS  31  -3.772 -14.905  -0.987
  276   1HZ   LYS  31          1HZ       LYS  31  -4.790 -16.183  -2.783
  277   2HZ   LYS  31          2HZ       LYS  31  -5.187 -14.823  -3.599
  278   3HZ   LYS  31          3HZ       LYS  31  -3.619 -15.228  -3.390
  279    H    SER  32           H        SER  32 -10.032 -12.364  -0.034
  280    HA   SER  32           HA       SER  32  -9.105 -11.063  -2.549
  281   1HB   SER  32          1HB       SER  32 -11.818 -12.325  -1.997
  282   2HB   SER  32          2HB       SER  32 -11.118 -11.900  -3.567
  283    HG   SER  32           HG       SER  32 -10.447 -13.995  -1.797
  284    H    VAL  33           H        VAL  33 -10.086  -9.842   0.238
  285    HA   VAL  33           HA       VAL  33 -11.742  -7.640  -0.966
  286    HB   VAL  33           HB       VAL  33 -11.796  -8.949   1.745
  287   1HG1  VAL  33          1HG1      VAL  33 -11.627  -6.592   2.348
  288   2HG1  VAL  33          2HG1      VAL  33 -12.877  -6.169   1.151
  289   3HG1  VAL  33          3HG1      VAL  33 -13.274  -7.170   2.568
  290   1HG2  VAL  33          1HG2      VAL  33 -13.975  -8.025  -0.181
  291   2HG2  VAL  33          2HG2      VAL  33 -13.346  -9.683  -0.074
  292   3HG2  VAL  33          3HG2      VAL  33 -14.205  -8.977   1.302
  293    H    LEU  34           H        LEU  34  -9.014  -8.264   1.436
  294    HA   LEU  34           HA       LEU  34  -8.276  -5.447   1.243
  295   1HB   LEU  34          1HB       LEU  34  -6.711  -5.853   2.785
  296   2HB   LEU  34          2HB       LEU  34  -7.775  -7.197   3.177
  297    HG   LEU  34           HG       LEU  34  -5.352  -7.242   1.455
  298   1HD1  LEU  34          1HD1      LEU  34  -4.972  -6.877   3.965
  299   2HD1  LEU  34          2HD1      LEU  34  -5.670  -8.469   4.237
  300   3HD1  LEU  34          3HD1      LEU  34  -4.164  -8.299   3.301
  301   1HD2  LEU  34          1HD2      LEU  34  -6.892  -9.611   2.556
  302   2HD2  LEU  34          2HD2      LEU  34  -6.847  -9.122   0.847
  303   3HD2  LEU  34          3HD2      LEU  34  -5.379  -9.711   1.630
  304    H    GLN  35           H        GLN  35  -7.963  -8.067  -0.974
  305    HA   GLN  35           HA       GLN  35  -5.561  -7.238  -2.225
  306   1HB   GLN  35          1HB       GLN  35  -7.393  -9.344  -2.534
  307   2HB   GLN  35          2HB       GLN  35  -7.483  -8.481  -4.063
  308   1HG   GLN  35          1HG       GLN  35  -4.957  -8.544  -4.176
  309   2HG   GLN  35          2HG       GLN  35  -4.951  -9.524  -2.708
  310   1HE2  GLN  35          2HE2      GLN  35  -3.690 -10.564  -4.896
  311   2HE2  GLN  35          1HE2      GLN  35  -4.669 -11.837  -5.612
  312    H    LYS  36           H        LYS  36  -8.942  -6.156  -2.809
  313    HA   LYS  36           HA       LYS  36  -8.282  -4.605  -5.183
  314   1HB   LYS  36          1HB       LYS  36 -10.601  -4.576  -3.192
  315   2HB   LYS  36          2HB       LYS  36 -10.410  -3.269  -4.361
  316   1HG   LYS  36          1HG       LYS  36 -10.430  -4.889  -6.228
  317   2HG   LYS  36          2HG       LYS  36 -10.737  -6.205  -5.073
  318   1HD   LYS  36          1HD       LYS  36 -12.872  -5.199  -4.419
  319   2HD   LYS  36          2HD       LYS  36 -12.500  -3.723  -5.311
  320   1HE   LYS  36          1HE       LYS  36 -14.086  -4.926  -6.606
  321   2HE   LYS  36          2HE       LYS  36 -12.539  -4.974  -7.452
  322   1HZ   LYS  36          1HZ       LYS  36 -12.230  -7.245  -6.605
  323   2HZ   LYS  36          2HZ       LYS  36 -13.656  -7.184  -5.802
  324   3HZ   LYS  36          3HZ       LYS  36 -13.631  -7.146  -7.431
  325    H    ILE  37           H        ILE  37  -8.267  -3.801  -1.724
  326    HA   ILE  37           HA       ILE  37  -7.405  -1.025  -2.129
  327    HB   ILE  37           HB       ILE  37  -7.024  -3.017   0.161
  328   1HG1  ILE  37          1HG1      ILE  37  -9.056  -0.813  -0.086
  329   2HG1  ILE  37          2HG1      ILE  37  -9.332  -2.557  -0.172
  330   1HG2  ILE  37          1HG2      ILE  37  -5.249  -1.415   0.387
  331   2HG2  ILE  37          2HG2      ILE  37  -6.322  -0.072  -0.033
  332   3HG2  ILE  37          3HG2      ILE  37  -6.484  -0.890   1.518
  333   1HD1  ILE  37          1HD1      ILE  37  -8.508  -2.739   2.205
  334   2HD1  ILE  37          2HD1      ILE  37  -8.585  -0.956   2.277
  335   3HD1  ILE  37          3HD1      ILE  37 -10.047  -1.891   1.968
  336    H    LEU  38           H        LEU  38  -5.517  -4.093  -1.461
  337    HA   LEU  38           HA       LEU  38  -2.987  -2.967  -1.757
  338   1HB   LEU  38          1HB       LEU  38  -4.085  -5.696  -2.434
  339   2HB   LEU  38          2HB       LEU  38  -2.407  -5.331  -2.749
  340    HG   LEU  38           HG       LEU  38  -3.654  -5.012   0.018
  341   1HD1  LEU  38          1HD1      LEU  38  -3.775  -7.369  -0.700
  342   2HD1  LEU  38          2HD1      LEU  38  -2.047  -7.336  -1.125
  343   3HD1  LEU  38          3HD1      LEU  38  -2.565  -7.146   0.568
  344   1HD2  LEU  38          1HD2      LEU  38  -0.828  -4.925  -1.108
  345   2HD2  LEU  38          2HD2      LEU  38  -1.663  -3.738  -0.071
  346   3HD2  LEU  38          3HD2      LEU  38  -1.128  -5.292   0.588
  347    H    GLU  39           H        GLU  39  -5.081  -4.007  -4.547
  348    HA   GLU  39           HA       GLU  39  -3.036  -3.364  -6.483
  349   1HB   GLU  39          1HB       GLU  39  -6.061  -3.683  -6.675
  350   2HB   GLU  39          2HB       GLU  39  -5.053  -3.275  -8.065
  351   1HG   GLU  39          1HG       GLU  39  -3.699  -5.331  -7.692
  352   2HG   GLU  39          2HG       GLU  39  -4.778  -5.793  -6.376
  353    H    ASP  40           H        ASP  40  -5.797  -1.411  -5.285
  354    HA   ASP  40           HA       ASP  40  -5.352   0.988  -6.799
  355   1HB   ASP  40          1HB       ASP  40  -6.605   0.093  -4.160
  356   2HB   ASP  40          2HB       ASP  40  -6.465   1.738  -4.437
  357    H    GLU  41           H        GLU  41  -3.927  -0.300  -3.849
  358    HA   GLU  41           HA       GLU  41  -2.857   2.287  -3.031
  359   1HB   GLU  41          1HB       GLU  41  -3.961   0.436  -1.632
  360   2HB   GLU  41          2HB       GLU  41  -2.441  -0.456  -1.764
  361   1HG   GLU  41          1HG       GLU  41  -2.642   0.616   0.328
  362   2HG   GLU  41          2HG       GLU  41  -1.408   1.527  -0.587
  363    H    GLU  42           H        GLU  42  -1.549  -0.734  -4.379
  364    HA   GLU  42           HA       GLU  42   1.205   0.162  -4.557
  365   1HB   GLU  42          1HB       GLU  42   0.408  -2.205  -4.753
  366   2HB   GLU  42          2HB       GLU  42  -0.342  -1.798  -6.304
  367   1HG   GLU  42          1HG       GLU  42   1.889  -1.226  -7.227
  368   2HG   GLU  42          2HG       GLU  42   2.629  -1.540  -5.655
  369    H    LYS  43           H        LYS  43  -1.726   0.688  -6.523
  370    HA   LYS  43           HA       LYS  43  -0.479   1.876  -8.798
  371   1HB   LYS  43          1HB       LYS  43  -3.160   1.382  -7.856
  372   2HB   LYS  43          2HB       LYS  43  -3.088   3.060  -8.216
  373   1HG   LYS  43          1HG       LYS  43  -3.731   2.025 -10.254
  374   2HG   LYS  43          2HG       LYS  43  -2.001   2.315 -10.491
  375   1HD   LYS  43          1HD       LYS  43  -1.633  -0.086  -9.595
  376   2HD   LYS  43          2HD       LYS  43  -3.390  -0.282  -9.683
  377   1HE   LYS  43          1HE       LYS  43  -3.285   0.266 -12.129
  378   2HE   LYS  43          2HE       LYS  43  -1.525   0.375 -12.001
  379   1HZ   LYS  43          1HZ       LYS  43  -1.525  -1.971 -11.270
  380   2HZ   LYS  43          2HZ       LYS  43  -3.143  -2.060 -11.468
  381   3HZ   LYS  43          3HZ       LYS  43  -2.176  -1.825 -12.758
  382    H    HIS  44           H        HIS  44  -1.536   3.436  -5.676
  383    HA   HIS  44           HA       HIS  44  -0.856   6.055  -6.384
  384   1HB   HIS  44          1HB       HIS  44  -0.808   4.556  -3.719
  385   2HB   HIS  44          2HB       HIS  44  -0.815   6.279  -3.967
  386    HD2  HIS  44           2HD      HIS  44  -3.133   5.495  -6.481
  387    HE1  HIS  44           1HE      HIS  44  -5.689   5.267  -3.125
  388    HE2  HIS  44           2HE      HIS  44  -5.570   5.277  -5.642
  389    H    ILE  45           H        ILE  45   1.158   3.447  -4.968
  390    HA   ILE  45           HA       ILE  45   3.553   5.003  -4.637
  391    HB   ILE  45           HB       ILE  45   2.771   2.118  -4.596
  392   1HG1  ILE  45          1HG1      ILE  45   4.248   2.151  -2.572
  393   2HG1  ILE  45          2HG1      ILE  45   4.618   3.843  -2.901
  394   1HG2  ILE  45          1HG2      ILE  45   4.620   1.840  -6.137
  395   2HG2  ILE  45          2HG2      ILE  45   5.669   2.857  -5.118
  396   3HG2  ILE  45          3HG2      ILE  45   5.092   1.280  -4.539
  397   1HD1  ILE  45          1HD1      ILE  45   2.235   4.432  -2.535
  398   2HD1  ILE  45          2HD1      ILE  45   1.864   2.710  -2.267
  399   3HD1  ILE  45          3HD1      ILE  45   2.918   3.578  -1.141
  400    H    GLU  46           H        GLU  46   2.417   3.113  -7.518
  401    HA   GLU  46           HA       GLU  46   4.726   3.573  -9.109
  402   1HB   GLU  46          1HB       GLU  46   1.795   3.085  -9.700
  403   2HB   GLU  46          2HB       GLU  46   2.897   3.461 -11.003
  404   1HG   GLU  46          1HG       GLU  46   3.376   1.177  -9.056
  405   2HG   GLU  46          2HG       GLU  46   2.469   1.006 -10.557
  406    H    TRP  47           H        TRP  47   1.863   5.674  -8.635
  407    HA   TRP  47           HA       TRP  47   2.775   7.670 -10.507
  408   1HB   TRP  47          1HB       TRP  47   0.797   7.954  -8.210
  409   2HB   TRP  47          2HB       TRP  47   0.889   8.921  -9.659
  410    HD1  TRP  47           1HD      TRP  47   1.020   5.952 -11.418
  411    HE1  TRP  47           1HE      TRP  47  -1.214   4.744 -11.797
  412    HE3  TRP  47           3HE      TRP  47  -1.818   8.394  -7.951
  413    HZ2  TRP  47           2HZ      TRP  47  -3.920   4.886 -10.784
  414    HZ3  TRP  47           3HZ      TRP  47  -4.241   7.882  -7.690
  415    HH2  TRP  47           2HH      TRP  47  -5.293   6.110  -9.093
  416    H    LEU  48           H        LEU  48   2.913   7.344  -6.968
  417    HA   LEU  48           HA       LEU  48   4.113   9.814  -6.293
  418   1HB   LEU  48          1HB       LEU  48   4.026   7.023  -5.147
  419   2HB   LEU  48          2HB       LEU  48   5.022   8.189  -4.355
  420    HG   LEU  48           HG       LEU  48   2.100   8.719  -4.945
  421   1HD1  LEU  48          1HD1      LEU  48   2.270   6.730  -3.505
  422   2HD1  LEU  48          2HD1      LEU  48   3.370   7.591  -2.418
  423   3HD1  LEU  48          3HD1      LEU  48   1.673   8.112  -2.582
  424   1HD2  LEU  48          1HD2      LEU  48   4.044   9.959  -2.935
  425   2HD2  LEU  48          2HD2      LEU  48   3.445  10.741  -4.414
  426   3HD2  LEU  48          3HD2      LEU  48   2.324  10.368  -3.101
  427    H    GLU  49           H        GLU  49   5.715   6.777  -7.256
  428    HA   GLU  49           HA       GLU  49   8.404   7.896  -7.176
  429   1HB   GLU  49          1HB       GLU  49   7.232   5.351  -7.584
  430   2HB   GLU  49          2HB       GLU  49   8.030   5.684  -9.095
  431   1HG   GLU  49          1HG       GLU  49   9.348   5.818  -6.348
  432   2HG   GLU  49          2HG       GLU  49   9.452   4.454  -7.454
  433    H    THR  50           H        THR  50   5.874   8.045  -9.531
  434    HA   THR  50           HA       THR  50   7.584   8.795 -11.801
  435    HB   THR  50           HB       THR  50   4.576   8.746 -11.358
  436    HG1  THR  50           1HG      THR  50   5.374   6.742 -11.615
  437   1HG2  THR  50          1HG2      THR  50   4.948  10.479 -12.945
  438   2HG2  THR  50          2HG2      THR  50   6.125   9.470 -13.839
  439   3HG2  THR  50          3HG2      THR  50   4.391   9.024 -13.791
  440    H    ILE  51           H        ILE  51   5.719  10.346  -9.305
  441    HA   ILE  51           HA       ILE  51   6.154  13.069 -10.203
  442    HB   ILE  51           HB       ILE  51   5.044  11.792  -7.688
  443   1HG1  ILE  51          1HG1      ILE  51   3.600  13.526  -9.739
  444   2HG1  ILE  51          2HG1      ILE  51   3.785  11.800  -9.973
  445   1HG2  ILE  51          1HG2      ILE  51   5.953  13.910  -6.904
  446   2HG2  ILE  51          2HG2      ILE  51   5.184  14.782  -8.250
  447   3HG2  ILE  51          3HG2      ILE  51   4.205  14.029  -6.972
  448   1HD1  ILE  51          1HD1      ILE  51   2.651  11.406  -7.751
  449   2HD1  ILE  51          2HD1      ILE  51   2.255  13.141  -7.725
  450   3HD1  ILE  51          3HD1      ILE  51   1.645  12.104  -9.027
  451    H    ASN  52           H        ASN  52   8.099  10.876  -8.583
  452    HA   ASN  52           HA       ASN  52   9.769  12.560  -6.993
  453   1HB   ASN  52          1HB       ASN  52   9.670  10.007  -7.052
  454   2HB   ASN  52          2HB       ASN  52  10.676  10.094  -8.502
  455   1HD2  ASN  52          2HD2      ASN  52  11.887   8.655  -6.841
  456   2HD2  ASN  52          1HD2      ASN  52  13.071   9.517  -5.858
  457    H    GLY  53           H        GLY  53  11.673  13.664  -7.400
  458   1HA   GLY  53          1HA       GLY  53  12.500  14.276 -10.201
  459   2HA   GLY  53          2HA       GLY  53  11.816  15.572  -9.222
  460   1H    MET   1          1H        MET   1  -1.795  -7.971  18.392
  461   2H    MET   1          2H        MET   1  -2.277  -8.476  16.913
  462   3H    MET   1          3H        MET   1  -1.812  -9.572  18.036
  463    HA   MET   1           HA       MET   1  -4.200  -9.558  17.812
  464   1HB   MET   1          1HB       MET   1  -2.824  -9.729  20.127
  465   2HB   MET   1          2HB       MET   1  -3.788  -8.310  20.519
  466   1HG   MET   1          1HG       MET   1  -5.845  -9.529  20.124
  467   2HG   MET   1          2HG       MET   1  -4.977 -10.893  19.421
  468   1HE   MET   1          1HE       MET   1  -3.744 -12.755  20.682
  469   2HE   MET   1          2HE       MET   1  -2.577 -11.593  21.354
  470   3HE   MET   1          3HE       MET   1  -3.395 -12.745  22.423
  471    H    ASP   2           H        ASP   2  -5.972  -8.410  17.294
  472    HA   ASP   2           HA       ASP   2  -7.119  -6.793  16.278
  473   1HB   ASP   2          1HB       ASP   2  -5.933  -4.861  18.292
  474   2HB   ASP   2          2HB       ASP   2  -7.184  -4.482  17.122
  475    H    TYR   3           H        TYR   3  -6.763  -6.331  14.270
  476    HA   TYR   3           HA       TYR   3  -4.322  -4.846  13.382
  477   1HB   TYR   3          1HB       TYR   3  -3.743  -6.577  11.850
  478   2HB   TYR   3          2HB       TYR   3  -3.912  -7.330  13.416
  479    HD1  TYR   3           1HD      TYR   3  -5.006  -7.319   9.964
  480    HD2  TYR   3           2HD      TYR   3  -6.030  -8.725  13.908
  481    HE1  TYR   3           1HE      TYR   3  -6.600  -8.935   8.963
  482    HE2  TYR   3           2HE      TYR   3  -7.637 -10.347  12.902
  483    HH   TYR   3           HH       TYR   3  -8.169 -10.555   9.364
  484    H    LEU   4           H        LEU   4  -7.131  -3.984  13.523
  485    HA   LEU   4           HA       LEU   4  -7.651  -3.546  10.635
  486   1HB   LEU   4          1HB       LEU   4 -10.013  -3.808  10.933
  487   2HB   LEU   4          2HB       LEU   4  -9.150  -5.228  11.484
  488    HG   LEU   4           HG       LEU   4  -9.343  -3.871  13.845
  489   1HD1  LEU   4          1HD1      LEU   4 -10.764  -2.054  12.823
  490   2HD1  LEU   4          2HD1      LEU   4 -11.955  -3.286  12.385
  491   3HD1  LEU   4          3HD1      LEU   4 -11.597  -2.957  14.094
  492   1HD2  LEU   4          1HD2      LEU   4 -11.483  -5.696  12.686
  493   2HD2  LEU   4          2HD2      LEU   4  -9.984  -6.215  13.489
  494   3HD2  LEU   4          3HD2      LEU   4 -11.222  -5.350  14.411
  495    H    ARG   5           H        ARG   5  -8.311  -2.067  13.850
  496    HA   ARG   5           HA       ARG   5  -8.818   0.589  12.878
  497   1HB   ARG   5          1HB       ARG   5  -9.290  -0.060  15.176
  498   2HB   ARG   5          2HB       ARG   5  -7.595  -0.467  15.464
  499   1HG   ARG   5          1HG       ARG   5  -6.953   1.899  15.202
  500   2HG   ARG   5          2HG       ARG   5  -8.636   2.346  14.883
  501   1HD   ARG   5          1HD       ARG   5  -9.289   1.995  17.095
  502   2HD   ARG   5          2HD       ARG   5  -8.018   0.824  17.420
  503    HE   ARG   5           HE       ARG   5  -7.829   3.743  17.637
  504   1HH1  ARG   5          1HH2      ARG   5  -5.940   0.790  17.482
  505   2HH1  ARG   5          2HH2      ARG   5  -4.521   1.553  18.137
  506   1HH2  ARG   5          1HH1      ARG   5  -5.970   4.648  18.481
  507   2HH2  ARG   5          2HH1      ARG   5  -4.545   3.672  18.687
  508    H    GLU   6           H        GLU   6  -5.798  -1.098  13.632
  509    HA   GLU   6           HA       GLU   6  -4.036   1.064  13.204
  510   1HB   GLU   6          1HB       GLU   6  -3.747  -1.447  14.149
  511   2HB   GLU   6          2HB       GLU   6  -3.136  -1.736  12.522
  512   1HG   GLU   6          1HG       GLU   6  -1.541   0.188  12.833
  513   2HG   GLU   6          2HG       GLU   6  -2.181   0.449  14.449
  514    H    LEU   7           H        LEU   7  -5.470  -1.154  10.846
  515    HA   LEU   7           HA       LEU   7  -3.920  -0.268   8.549
  516   1HB   LEU   7          1HB       LEU   7  -6.745  -1.438   8.532
  517   2HB   LEU   7          2HB       LEU   7  -5.607  -1.365   7.193
  518    HG   LEU   7           HG       LEU   7  -5.403  -3.024   9.699
  519   1HD1  LEU   7          1HD1      LEU   7  -7.049  -3.823   8.015
  520   2HD1  LEU   7          2HD1      LEU   7  -5.773  -3.821   6.774
  521   3HD1  LEU   7          3HD1      LEU   7  -5.680  -4.934   8.158
  522   1HD2  LEU   7          1HD2      LEU   7  -3.484  -2.939   7.349
  523   2HD2  LEU   7          2HD2      LEU   7  -3.171  -2.390   9.021
  524   3HD2  LEU   7          3HD2      LEU   7  -3.436  -4.097   8.703
  525    H    TYR   8           H        TYR   8  -7.277   0.365   9.534
  526    HA   TYR   8           HA       TYR   8  -8.041   2.302   7.644
  527   1HB   TYR   8          1HB       TYR   8  -9.136   0.961   9.792
  528   2HB   TYR   8          2HB       TYR   8  -8.910   2.476  10.572
  529    HD1  TYR   8           1HD      TYR   8 -11.406   0.642   9.570
  530    HD2  TYR   8           2HD      TYR   8  -9.757   4.499   8.554
  531    HE1  TYR   8           1HE      TYR   8 -13.668   1.447   8.915
  532    HE2  TYR   8           2HE      TYR   8 -12.007   5.277   7.863
  533    HH   TYR   8           HH       TYR   8 -14.233   4.766   7.696
  534    H    LYS   9           H        LYS   9  -6.554   2.877  10.870
  535    HA   LYS   9           HA       LYS   9  -6.660   5.709  10.553
  536   1HB   LYS   9          1HB       LYS   9  -6.272   4.232  12.731
  537   2HB   LYS   9          2HB       LYS   9  -4.569   4.374  12.309
  538   1HG   LYS   9          1HG       LYS   9  -4.959   6.142  13.823
  539   2HG   LYS   9          2HG       LYS   9  -4.986   6.944  12.250
  540   1HD   LYS   9          1HD       LYS   9  -7.537   6.736  12.299
  541   2HD   LYS   9          2HD       LYS   9  -7.382   6.085  13.940
  542   1HE   LYS   9          1HE       LYS   9  -6.194   8.202  14.607
  543   2HE   LYS   9          2HE       LYS   9  -6.471   8.833  12.980
  544   1HZ   LYS   9          1HZ       LYS   9  -8.879   8.609  13.394
  545   2HZ   LYS   9          2HZ       LYS   9  -8.599   8.077  14.913
  546   3HZ   LYS   9          3HZ       LYS   9  -8.194   9.598  14.497
  547    H    LEU  10           H        LEU  10  -3.924   3.554   9.778
  548    HA   LEU  10           HA       LEU  10  -2.365   5.736   8.832
  549   1HB   LEU  10          1HB       LEU  10  -2.103   2.753   8.763
  550   2HB   LEU  10          2HB       LEU  10  -1.077   3.702   7.687
  551    HG   LEU  10           HG       LEU  10  -1.281   4.390  10.646
  552   1HD1  LEU  10          1HD1      LEU  10  -0.568   2.106  10.612
  553   2HD1  LEU  10          2HD1      LEU  10   0.633   2.430   9.337
  554   3HD1  LEU  10          3HD1      LEU  10   0.833   3.120  10.966
  555   1HD2  LEU  10          1HD2      LEU  10   0.881   4.884   8.546
  556   2HD2  LEU  10          2HD2      LEU  10  -0.248   6.102   9.167
  557   3HD2  LEU  10          3HD2      LEU  10   0.948   5.386  10.249
  558    H    GLU  11           H        GLU  11  -4.595   3.495   7.231
  559    HA   GLU  11           HA       GLU  11  -4.495   4.536   4.584
  560   1HB   GLU  11          1HB       GLU  11  -6.365   3.038   6.352
  561   2HB   GLU  11          2HB       GLU  11  -7.227   3.856   5.161
  562   1HG   GLU  11          1HG       GLU  11  -4.866   1.950   4.680
  563   2HG   GLU  11          2HG       GLU  11  -6.557   1.487   4.642
  564    H    GLN  12           H        GLN  12  -6.262   5.873   7.480
  565    HA   GLN  12           HA       GLN  12  -7.096   8.131   5.927
  566   1HB   GLN  12          1HB       GLN  12  -7.325   7.336   8.821
  567   2HB   GLN  12          2HB       GLN  12  -7.809   8.945   8.251
  568   1HG   GLN  12          1HG       GLN  12  -9.221   7.918   6.513
  569   2HG   GLN  12          2HG       GLN  12  -8.867   6.322   7.147
  570   1HE2  GLN  12          2HE2      GLN  12 -11.387   8.337   7.089
  571   2HE2  GLN  12          1HE2      GLN  12 -11.989   8.160   8.730
  572    H    GLN  13           H        GLN  13  -4.202   7.555   7.747
  573    HA   GLN  13           HA       GLN  13  -3.534  10.361   8.120
  574   1HB   GLN  13          1HB       GLN  13  -1.909   7.794   8.075
  575   2HB   GLN  13          2HB       GLN  13  -1.099   9.347   8.091
  576   1HG   GLN  13          1HG       GLN  13  -3.150   8.545  10.188
  577   2HG   GLN  13          2HG       GLN  13  -1.417   8.288  10.357
  578   1HE2  GLN  13          2HE2      GLN  13  -2.533   9.768  12.331
  579   2HE2  GLN  13          1HE2      GLN  13  -2.125  11.464  12.112
  580    H    ALA  14           H        ALA  14  -2.988   8.088   5.386
  581    HA   ALA  14           HA       ALA  14  -1.554  10.058   3.778
  582   1HB   ALA  14          1HB       ALA  14  -1.461   7.614   3.339
  583   2HB   ALA  14          2HB       ALA  14  -3.205   7.602   2.983
  584   3HB   ALA  14          3HB       ALA  14  -2.085   8.501   1.934
  585    H    MET  15           H        MET  15  -4.953   9.265   4.283
  586    HA   MET  15           HA       MET  15  -6.109  10.974   2.241
  587   1HB   MET  15          1HB       MET  15  -7.248   9.033   3.288
  588   2HB   MET  15          2HB       MET  15  -7.184   9.848   4.843
  589   1HG   MET  15          1HG       MET  15  -9.376   9.887   4.117
  590   2HG   MET  15          2HG       MET  15  -8.774  11.530   4.116
  591   1HE   MET  15          1HE       MET  15  -8.788  13.014   2.452
  592   2HE   MET  15          2HE       MET  15  -7.615  12.316   1.315
  593   3HE   MET  15          3HE       MET  15  -9.221  12.828   0.742
  594    H    LYS  16           H        LYS  16  -5.536  11.543   5.799
  595    HA   LYS  16           HA       LYS  16  -6.417  14.287   5.720
  596   1HB   LYS  16          1HB       LYS  16  -4.946  12.507   7.608
  597   2HB   LYS  16          2HB       LYS  16  -4.535  14.218   7.720
  598   1HG   LYS  16          1HG       LYS  16  -6.957  14.805   7.885
  599   2HG   LYS  16          2HG       LYS  16  -7.361  13.077   7.911
  600   1HD   LYS  16          1HD       LYS  16  -6.127  12.784  10.001
  601   2HD   LYS  16          2HD       LYS  16  -5.527  14.459   9.919
  602   1HE   LYS  16          1HE       LYS  16  -7.872  15.294  10.036
  603   2HE   LYS  16          2HE       LYS  16  -8.454  13.632  10.191
  604   1HZ   LYS  16          1HZ       LYS  16  -7.193  13.465  12.276
  605   2HZ   LYS  16          2HZ       LYS  16  -6.645  14.998  12.121
  606   3HZ   LYS  16          3HZ       LYS  16  -8.233  14.719  12.358
  607    H    LEU  17           H        LEU  17  -3.219  12.801   5.135
  608    HA   LEU  17           HA       LEU  17  -1.857  15.264   4.611
  609   1HB   LEU  17          1HB       LEU  17  -1.436  12.361   4.183
  610   2HB   LEU  17          2HB       LEU  17  -0.723  13.307   2.930
  611    HG   LEU  17           HG       LEU  17  -0.279  13.848   5.905
  612   1HD1  LEU  17          1HD1      LEU  17   0.540  11.613   5.286
  613   2HD1  LEU  17          2HD1      LEU  17   1.485  12.316   3.952
  614   3HD1  LEU  17          3HD1      LEU  17   1.876  12.721   5.639
  615   1HD2  LEU  17          1HD2      LEU  17   1.269  14.771   3.437
  616   2HD2  LEU  17          2HD2      LEU  17   0.241  15.801   4.453
  617   3HD2  LEU  17          3HD2      LEU  17   1.714  15.096   5.124
  618    H    TYR  18           H        TYR  18  -3.684  13.086   2.397
  619    HA   TYR  18           HA       TYR  18  -3.359  14.622   0.074
  620   1HB   TYR  18          1HB       TYR  18  -5.203  12.458   1.025
  621   2HB   TYR  18          2HB       TYR  18  -5.634  13.259  -0.428
  622    HD1  TYR  18           1HD      TYR  18  -3.254  13.697  -1.944
  623    HD2  TYR  18           2HD      TYR  18  -4.293  10.323   0.503
  624    HE1  TYR  18           1HE      TYR  18  -1.563  12.321  -3.143
  625    HE2  TYR  18           2HE      TYR  18  -2.568   8.955  -0.643
  626    HH   TYR  18           HH       TYR  18  -0.854   8.943  -2.178
  627    H    ARG  19           H        ARG  19  -5.872  15.025   2.575
  628    HA   ARG  19           HA       ARG  19  -7.469  17.058   1.346
  629   1HB   ARG  19          1HB       ARG  19  -6.539  16.621   4.212
  630   2HB   ARG  19          2HB       ARG  19  -7.574  17.959   3.800
  631   1HG   ARG  19          1HG       ARG  19  -8.415  15.128   3.110
  632   2HG   ARG  19          2HG       ARG  19  -8.583  15.772   4.748
  633   1HD   ARG  19          1HD       ARG  19  -9.808  17.762   3.731
  634   2HD   ARG  19          2HD       ARG  19  -9.899  16.833   2.222
  635    HE   ARG  19           HE       ARG  19 -10.889  15.061   4.058
  636   1HH1  ARG  19          1HH2      ARG  19 -11.811  18.383   3.414
  637   2HH1  ARG  19          2HH2      ARG  19 -13.398  18.169   4.100
  638   1HH2  ARG  19          1HH1      ARG  19 -12.925  14.868   4.930
  639   2HH2  ARG  19          2HH1      ARG  19 -14.007  16.228   4.920
  640    H    GLU  20           H        GLU  20  -4.406  17.423   3.113
  641    HA   GLU  20           HA       GLU  20  -4.451  20.334   2.695
  642   1HB   GLU  20          1HB       GLU  20  -3.667  18.748   4.740
  643   2HB   GLU  20          2HB       GLU  20  -2.114  18.901   3.955
  644   1HG   GLU  20          1HG       GLU  20  -2.138  21.314   4.139
  645   2HG   GLU  20          2HG       GLU  20  -3.834  21.329   4.619
  646    H    ALA  21           H        ALA  21  -2.578  17.587   1.625
  647    HA   ALA  21           HA       ALA  21  -0.568  18.819   0.104
  648   1HB   ALA  21          1HB       ALA  21  -0.669  16.393   0.516
  649   2HB   ALA  21          2HB       ALA  21  -2.113  16.272  -0.523
  650   3HB   ALA  21          3HB       ALA  21  -0.551  16.711  -1.224
  651    H    SER  22           H        SER  22  -3.972  18.392  -0.756
  652    HA   SER  22           HA       SER  22  -3.884  19.401  -3.423
  653   1HB   SER  22          1HB       SER  22  -5.800  18.272  -2.221
  654   2HB   SER  22          2HB       SER  22  -6.056  19.764  -1.308
  655    HG   SER  22           HG       SER  22  -7.397  19.516  -3.165
  656    H    GLU  23           H        GLU  23  -3.948  21.143  -0.299
  657    HA   GLU  23           HA       GLU  23  -4.106  23.817  -1.497
  658   1HB   GLU  23          1HB       GLU  23  -4.945  22.931   0.788
  659   2HB   GLU  23          2HB       GLU  23  -3.310  23.124   1.342
  660   1HG   GLU  23          1HG       GLU  23  -4.828  25.397  -0.008
  661   2HG   GLU  23          2HG       GLU  23  -5.089  25.014   1.686
  662    H    LYS  24           H        LYS  24  -1.590  21.772  -0.063
  663    HA   LYS  24           HA       LYS  24   0.599  23.596  -0.453
  664   1HB   LYS  24          1HB       LYS  24   0.239  20.868   0.479
  665   2HB   LYS  24          2HB       LYS  24   1.608  20.915  -0.620
  666   1HG   LYS  24          1HG       LYS  24   1.252  22.878   1.680
  667   2HG   LYS  24          2HG       LYS  24   2.056  21.330   1.884
  668   1HD   LYS  24          1HD       LYS  24   2.972  23.319  -0.231
  669   2HD   LYS  24          2HD       LYS  24   3.520  23.443   1.432
  670   1HE   LYS  24          1HE       LYS  24   3.813  20.862  -0.162
  671   2HE   LYS  24          2HE       LYS  24   5.002  22.164  -0.260
  672   1HZ   LYS  24          1HZ       LYS  24   5.354  21.985   2.126
  673   2HZ   LYS  24          2HZ       LYS  24   4.241  20.796   2.264
  674   3HZ   LYS  24          3HZ       LYS  24   5.620  20.538   1.428
  675    H    ALA  25           H        ALA  25  -0.793  21.214  -2.723
  676    HA   ALA  25           HA       ALA  25   1.120  21.832  -4.848
  677   1HB   ALA  25          1HB       ALA  25  -0.074  19.691  -4.799
  678   2HB   ALA  25          2HB       ALA  25  -1.638  20.527  -4.915
  679   3HB   ALA  25          3HB       ALA  25  -0.481  20.615  -6.258
  680    H    ARG  26           H        ARG  26  -2.312  22.672  -4.361
  681    HA   ARG  26           HA       ARG  26  -3.714  24.089  -5.397
  682   1HB   ARG  26          1HB       ARG  26  -1.997  25.493  -3.821
  683   2HB   ARG  26          2HB       ARG  26  -1.691  26.306  -5.334
  684   1HG   ARG  26          1HG       ARG  26  -3.365  27.561  -4.241
  685   2HG   ARG  26          2HG       ARG  26  -4.250  26.671  -5.486
  686   1HD   ARG  26          1HD       ARG  26  -4.946  24.990  -3.765
  687   2HD   ARG  26          2HD       ARG  26  -3.956  25.823  -2.569
  688    HE   ARG  26           HE       ARG  26  -5.551  27.459  -2.303
  689   1HH1  ARG  26          1HH2      ARG  26  -6.505  25.623  -5.137
  690   2HH1  ARG  26          2HH2      ARG  26  -8.084  26.357  -5.182
  691   1HH2  ARG  26          1HH1      ARG  26  -7.571  28.341  -2.425
  692   2HH2  ARG  26          2HH1      ARG  26  -8.665  27.854  -3.686
  693    H    ASN  27           H        ASN  27  -1.729  22.743  -7.279
  694    HA   ASN  27           HA       ASN  27  -1.906  24.594  -9.617
  695   1HB   ASN  27          1HB       ASN  27   0.345  24.045  -8.560
  696   2HB   ASN  27          2HB       ASN  27   0.115  22.376  -9.068
  697   1HD2  ASN  27          2HD2      ASN  27   1.158  21.938 -11.015
  698   2HD2  ASN  27          1HD2      ASN  27   1.450  23.150 -12.249
  699    HA   PRO  28           HA       PRO  28  -4.820  21.817 -11.201
  700   1HB   PRO  28          1HB       PRO  28  -4.799  22.252 -13.923
  701   2HB   PRO  28          2HB       PRO  28  -5.466  23.378 -12.702
  702   1HG   PRO  28          1HG       PRO  28  -2.722  23.430 -13.983
  703   2HG   PRO  28          2HG       PRO  28  -3.869  24.790 -13.762
  704   1HD   PRO  28          1HD       PRO  28  -1.819  24.390 -12.061
  705   2HD   PRO  28          2HD       PRO  28  -3.416  24.907 -11.437
  706    H    GLU  29           H        GLU  29  -1.592  21.459 -12.617
  707    HA   GLU  29           HA       GLU  29  -1.963  18.953 -13.926
  708   1HB   GLU  29          1HB       GLU  29   0.007  20.639 -13.958
  709   2HB   GLU  29          2HB       GLU  29   0.584  19.829 -12.511
  710   1HG   GLU  29          1HG       GLU  29   0.679  17.674 -13.737
  711   2HG   GLU  29          2HG       GLU  29   0.024  18.457 -15.178
  712    H    LYS  30           H        LYS  30  -1.020  19.713 -10.655
  713    HA   LYS  30           HA       LYS  30  -0.789  16.958  -9.755
  714   1HB   LYS  30          1HB       LYS  30   0.027  19.499  -8.728
  715   2HB   LYS  30          2HB       LYS  30  -1.087  18.831  -7.538
  716   1HG   LYS  30          1HG       LYS  30   1.329  17.376  -8.686
  717   2HG   LYS  30          2HG       LYS  30   1.308  18.243  -7.147
  718   1HD   LYS  30          1HD       LYS  30  -0.314  16.679  -6.197
  719   2HD   LYS  30          2HD       LYS  30  -0.543  15.896  -7.763
  720   1HE   LYS  30          1HE       LYS  30   0.859  14.443  -6.601
  721   2HE   LYS  30          2HE       LYS  30   1.882  15.266  -7.782
  722   1HZ   LYS  30          1HZ       LYS  30   2.682  16.708  -5.974
  723   2HZ   LYS  30          2HZ       LYS  30   1.709  15.959  -4.887
  724   3HZ   LYS  30          3HZ       LYS  30   2.940  15.146  -5.578
  725    H    LYS  31           H        LYS  31  -3.195  19.516  -9.438
  726    HA   LYS  31           HA       LYS  31  -5.166  18.140  -7.918
  727   1HB   LYS  31          1HB       LYS  31  -4.921  20.644  -8.552
  728   2HB   LYS  31          2HB       LYS  31  -5.563  20.194 -10.125
  729   1HG   LYS  31          1HG       LYS  31  -7.261  21.253  -8.938
  730   2HG   LYS  31          2HG       LYS  31  -7.730  19.567  -9.042
  731   1HD   LYS  31          1HD       LYS  31  -7.153  19.203  -6.695
  732   2HD   LYS  31          2HD       LYS  31  -6.387  20.807  -6.594
  733   1HE   LYS  31          1HE       LYS  31  -8.559  21.882  -7.145
  734   2HE   LYS  31          2HE       LYS  31  -9.340  20.299  -7.198
  735   1HZ   LYS  31          1HZ       LYS  31  -8.880  20.027  -4.860
  736   2HZ   LYS  31          2HZ       LYS  31  -7.998  21.402  -4.784
  737   3HZ   LYS  31          3HZ       LYS  31  -9.612  21.472  -5.046
  738    H    SER  32           H        SER  32  -4.113  17.283 -10.997
  739    HA   SER  32           HA       SER  32  -6.492  15.503 -11.327
  740   1HB   SER  32          1HB       SER  32  -4.645  16.500 -13.542
  741   2HB   SER  32          2HB       SER  32  -6.117  15.533 -13.732
  742    HG   SER  32           HG       SER  32  -5.854  18.243 -12.930
  743    H    VAL  33           H        VAL  33  -3.634  15.329 -10.035
  744    HA   VAL  33           HA       VAL  33  -3.015  12.557 -11.010
  745    HB   VAL  33           HB       VAL  33  -1.195  14.814 -10.145
  746   1HG1  VAL  33          1HG1      VAL  33  -0.372  12.924  -8.847
  747   2HG1  VAL  33          2HG1      VAL  33  -0.443  11.871 -10.282
  748   3HG1  VAL  33          3HG1      VAL  33   0.703  13.230 -10.209
  749   1HG2  VAL  33          1HG2      VAL  33  -1.102  12.888 -12.509
  750   2HG2  VAL  33          2HG2      VAL  33  -1.754  14.536 -12.573
  751   3HG2  VAL  33          3HG2      VAL  33  -0.039  14.286 -12.233
  752    H    LEU  34           H        LEU  34  -3.145  14.739  -8.042
  753    HA   LEU  34           HA       LEU  34  -3.096  12.344  -6.354
  754   1HB   LEU  34          1HB       LEU  34  -2.728  13.678  -4.664
  755   2HB   LEU  34          2HB       LEU  34  -2.136  14.773  -5.893
  756    HG   LEU  34           HG       LEU  34  -4.883  14.760  -4.690
  757   1HD1  LEU  34          1HD1      LEU  34  -2.966  15.424  -3.092
  758   2HD1  LEU  34          2HD1      LEU  34  -2.625  16.774  -4.161
  759   3HD1  LEU  34          3HD1      LEU  34  -4.186  16.680  -3.315
  760   1HD2  LEU  34          1HD2      LEU  34  -3.590  16.990  -6.288
  761   2HD2  LEU  34          2HD2      LEU  34  -4.885  15.920  -6.879
  762   3HD2  LEU  34          3HD2      LEU  34  -5.196  17.034  -5.541
  763    H    GLN  35           H        GLN  35  -5.432  14.034  -8.226
  764    HA   GLN  35           HA       GLN  35  -7.747  13.462  -6.673
  765   1HB   GLN  35          1HB       GLN  35  -7.093  14.944  -8.893
  766   2HB   GLN  35          2HB       GLN  35  -8.023  13.682  -9.650
  767   1HG   GLN  35          1HG       GLN  35  -9.027  15.273  -7.235
  768   2HG   GLN  35          2HG       GLN  35  -9.190  15.863  -8.878
  769   1HE2  GLN  35          2HE2      GLN  35 -11.525  15.742  -7.711
  770   2HE2  GLN  35          1HE2      GLN  35 -12.428  14.325  -8.229
  771    H    LYS  36           H        LYS  36  -6.102  11.655  -9.305
  772    HA   LYS  36           HA       LYS  36  -8.059   9.513  -9.463
  773   1HB   LYS  36          1HB       LYS  36  -5.185   9.890 -10.408
  774   2HB   LYS  36          2HB       LYS  36  -5.964   8.308 -10.523
  775   1HG   LYS  36          1HG       LYS  36  -7.748   9.160 -11.894
  776   2HG   LYS  36          2HG       LYS  36  -7.185  10.831 -11.714
  777   1HD   LYS  36          1HD       LYS  36  -5.178  10.404 -12.949
  778   2HD   LYS  36          2HD       LYS  36  -5.435   8.657 -12.954
  779   1HE   LYS  36          1HE       LYS  36  -7.385  10.606 -14.255
  780   2HE   LYS  36          2HE       LYS  36  -5.976   9.975 -15.111
  781   1HZ   LYS  36          1HZ       LYS  36  -6.818   7.728 -14.768
  782   2HZ   LYS  36          2HZ       LYS  36  -8.128   8.278 -13.961
  783   3HZ   LYS  36          3HZ       LYS  36  -7.937   8.619 -15.544
  784    H    ILE  37           H        ILE  37  -5.071   9.877  -7.553
  785    HA   ILE  37           HA       ILE  37  -5.351   7.291  -6.171
  786    HB   ILE  37           HB       ILE  37  -4.059   9.966  -5.439
  787   1HG1  ILE  37          1HG1      ILE  37  -2.750   7.405  -6.340
  788   2HG1  ILE  37          2HG1      ILE  37  -2.973   8.885  -7.287
  789   1HG2  ILE  37          1HG2      ILE  37  -4.583   8.964  -3.324
  790   2HG2  ILE  37          2HG2      ILE  37  -4.131   7.350  -3.900
  791   3HG2  ILE  37          3HG2      ILE  37  -2.897   8.566  -3.597
  792   1HD1  ILE  37          1HD1      ILE  37  -1.533  10.097  -5.605
  793   2HD1  ILE  37          2HD1      ILE  37  -1.119   8.496  -4.933
  794   3HD1  ILE  37          3HD1      ILE  37  -0.721   8.880  -6.607
  795    H    LEU  38           H        LEU  38  -6.472  10.667  -5.292
  796    HA   LEU  38           HA       LEU  38  -7.885   9.913  -3.017
  797   1HB   LEU  38          1HB       LEU  38  -8.258  12.084  -5.069
  798   2HB   LEU  38          2HB       LEU  38  -9.484  11.880  -3.840
  799    HG   LEU  38           HG       LEU  38  -6.533  12.253  -3.154
  800   1HD1  LEU  38          1HD1      LEU  38  -7.393  14.235  -4.369
  801   2HD1  LEU  38          2HD1      LEU  38  -8.769  14.325  -3.243
  802   3HD1  LEU  38          3HD1      LEU  38  -7.108  14.587  -2.660
  803   1HD2  LEU  38          1HD2      LEU  38  -9.150  12.274  -1.598
  804   2HD2  LEU  38          2HD2      LEU  38  -7.696  11.297  -1.296
  805   3HD2  LEU  38          3HD2      LEU  38  -7.686  13.039  -0.986
  806    H    GLU  39           H        GLU  39  -9.217   9.704  -6.390
  807    HA   GLU  39           HA       GLU  39 -11.776   8.764  -5.445
  808   1HB   GLU  39          1HB       GLU  39 -11.231   9.860  -7.669
  809   2HB   GLU  39          2HB       GLU  39 -10.558   8.310  -8.195
  810   1HG   GLU  39          1HG       GLU  39 -12.758   7.233  -7.857
  811   2HG   GLU  39          2HG       GLU  39 -13.405   8.725  -7.168
  812    H    ASP  40           H        ASP  40  -8.805   6.978  -6.188
  813    HA   ASP  40           HA       ASP  40  -9.921   4.280  -5.914
  814   1HB   ASP  40          1HB       ASP  40  -7.223   5.710  -6.003
  815   2HB   ASP  40          2HB       ASP  40  -7.237   4.186  -5.334
  816    H    GLU  41           H        GLU  41  -8.607   6.735  -3.806
  817    HA   GLU  41           HA       GLU  41  -7.959   4.843  -1.677
  818   1HB   GLU  41          1HB       GLU  41  -6.499   6.708  -2.567
  819   2HB   GLU  41          2HB       GLU  41  -7.623   7.870  -1.841
  820   1HG   GLU  41          1HG       GLU  41  -5.787   7.684  -0.438
  821   2HG   GLU  41          2HG       GLU  41  -7.070   6.733   0.358
  822    H    GLU  42           H        GLU  42 -10.186   7.591  -2.115
  823    HA   GLU  42           HA       GLU  42 -11.585   7.355   0.392
  824   1HB   GLU  42          1HB       GLU  42 -11.605   9.169  -1.542
  825   2HB   GLU  42          2HB       GLU  42 -12.880   8.193  -2.234
  826   1HG   GLU  42          1HG       GLU  42 -12.840   9.301   0.630
  827   2HG   GLU  42          2HG       GLU  42 -13.497  10.190  -0.732
  828    H    LYS  43           H        LYS  43 -11.609   5.475  -2.600
  829    HA   LYS  43           HA       LYS  43 -14.040   4.025  -2.072
  830   1HB   LYS  43          1HB       LYS  43 -12.378   4.240  -4.243
  831   2HB   LYS  43          2HB       LYS  43 -11.852   2.689  -3.656
  832   1HG   LYS  43          1HG       LYS  43 -13.597   2.263  -5.227
  833   2HG   LYS  43          2HG       LYS  43 -14.315   1.993  -3.632
  834   1HD   LYS  43          1HD       LYS  43 -15.246   4.356  -3.741
  835   2HD   LYS  43          2HD       LYS  43 -14.645   4.467  -5.397
  836   1HE   LYS  43          1HE       LYS  43 -16.138   2.758  -6.157
  837   2HE   LYS  43          2HE       LYS  43 -16.446   2.191  -4.507
  838   1HZ   LYS  43          1HZ       LYS  43 -17.579   4.247  -4.020
  839   2HZ   LYS  43          2HZ       LYS  43 -17.334   4.823  -5.541
  840   3HZ   LYS  43          3HZ       LYS  43 -18.302   3.522  -5.302
  841    H    HIS  44           H        HIS  44 -10.611   3.308  -1.115
  842    HA   HIS  44           HA       HIS  44 -11.104   0.836   0.102
  843   1HB   HIS  44          1HB       HIS  44  -9.190   3.097   0.862
  844   2HB   HIS  44          2HB       HIS  44  -9.101   1.424   1.307
  845    HD2  HIS  44           2HD      HIS  44 -10.000   0.795  -1.992
  846    HE1  HIS  44           1HE      HIS  44  -5.901   1.712  -2.556
  847    HE2  HIS  44           2HE      HIS  44  -8.010   0.823  -3.653
  848    H    ILE  45           H        ILE  45 -11.311   4.167   1.442
  849    HA   ILE  45           HA       ILE  45 -12.155   3.463   4.050
  850    HB   ILE  45           HB       ILE  45 -13.050   5.860   2.401
  851   1HG1  ILE  45          1HG1      ILE  45 -10.604   5.818   2.351
  852   2HG1  ILE  45          2HG1      ILE  45 -11.170   7.126   3.362
  853   1HG2  ILE  45          1HG2      ILE  45 -14.358   5.733   4.350
  854   2HG2  ILE  45          2HG2      ILE  45 -12.947   5.369   5.371
  855   3HG2  ILE  45          3HG2      ILE  45 -13.141   6.985   4.630
  856   1HD1  ILE  45          1HD1      ILE  45 -10.673   5.772   5.391
  857   2HD1  ILE  45          2HD1      ILE  45 -10.089   4.452   4.349
  858   3HD1  ILE  45          3HD1      ILE  45  -9.246   6.013   4.366
  859    H    GLU  46           H        GLU  46 -14.333   3.924   1.134
  860    HA   GLU  46           HA       GLU  46 -16.752   3.561   2.546
  861   1HB   GLU  46          1HB       GLU  46 -15.948   2.825  -0.305
  862   2HB   GLU  46          2HB       GLU  46 -17.556   2.588   0.348
  863   1HG   GLU  46          1HG       GLU  46 -17.532   5.076   0.972
  864   2HG   GLU  46          2HG       GLU  46 -16.134   5.204  -0.108
  865    H    TRP  47           H        TRP  47 -14.545   1.083   1.198
  866    HA   TRP  47           HA       TRP  47 -16.284  -1.109   1.881
  867   1HB   TRP  47          1HB       TRP  47 -13.265  -1.138   1.403
  868   2HB   TRP  47          2HB       TRP  47 -14.389  -2.455   1.177
  869    HD1  TRP  47           1HD      TRP  47 -16.337  -0.235  -0.587
  870    HE1  TRP  47           1HE      TRP  47 -15.726   0.033  -3.066
  871    HE3  TRP  47           3HE      TRP  47 -11.547  -1.956  -0.410
  872    HZ2  TRP  47           2HZ      TRP  47 -13.394  -0.369  -4.744
  873    HZ3  TRP  47           3HZ      TRP  47 -10.106  -1.951  -2.431
  874    HH2  TRP  47           2HH      TRP  47 -11.023  -1.143  -4.608
  875    H    LEU  48           H        LEU  48 -13.364   0.277   3.360
  876    HA   LEU  48           HA       LEU  48 -13.044  -1.392   5.604
  877   1HB   LEU  48          1HB       LEU  48 -12.513   1.515   4.936
  878   2HB   LEU  48          2HB       LEU  48 -12.170   0.981   6.539
  879    HG   LEU  48           HG       LEU  48 -11.006  -0.346   4.074
  880   1HD1  LEU  48          1HD1      LEU  48 -10.249   1.994   4.232
  881   2HD1  LEU  48          2HD1      LEU  48  -9.782   1.748   5.927
  882   3HD1  LEU  48          3HD1      LEU  48  -8.928   0.886   4.620
  883   1HD2  LEU  48          1HD2      LEU  48 -10.214  -0.486   7.020
  884   2HD2  LEU  48          2HD2      LEU  48 -10.959  -1.797   6.080
  885   3HD2  LEU  48          3HD2      LEU  48  -9.332  -1.244   5.675
  886    H    GLU  49           H        GLU  49 -15.232   1.381   5.212
  887    HA   GLU  49           HA       GLU  49 -16.317   1.212   7.899
  888   1HB   GLU  49          1HB       GLU  49 -16.343   3.110   5.998
  889   2HB   GLU  49          2HB       GLU  49 -17.870   2.396   5.574
  890   1HG   GLU  49          1HG       GLU  49 -17.118   3.389   8.367
  891   2HG   GLU  49          2HG       GLU  49 -17.931   4.377   7.161
  892    H    THR  50           H        THR  50 -17.537  -0.033   4.718
  893    HA   THR  50           HA       THR  50 -19.880  -1.286   5.716
  894    HB   THR  50           HB       THR  50 -18.010  -1.791   3.382
  895    HG1  THR  50           1HG      THR  50 -20.662  -0.787   3.567
  896   1HG2  THR  50          1HG2      THR  50 -19.034  -3.925   3.689
  897   2HG2  THR  50          2HG2      THR  50 -20.641  -3.182   3.929
  898   3HG2  THR  50          3HG2      THR  50 -19.827  -3.102   2.337
  899    H    ILE  51           H        ILE  51 -16.559  -2.231   5.943
  900    HA   ILE  51           HA       ILE  51 -17.112  -4.941   6.942
  901    HB   ILE  51           HB       ILE  51 -14.707  -3.300   6.143
  902   1HG1  ILE  51          1HG1      ILE  51 -15.704  -6.005   5.127
  903   2HG1  ILE  51          2HG1      ILE  51 -16.276  -4.483   4.473
  904   1HG2  ILE  51          1HG2      ILE  51 -13.813  -4.514   8.000
  905   2HG2  ILE  51          2HG2      ILE  51 -14.540  -6.034   7.425
  906   3HG2  ILE  51          3HG2      ILE  51 -13.218  -5.245   6.523
  907   1HD1  ILE  51          1HD1      ILE  51 -13.899  -3.891   3.864
  908   2HD1  ILE  51          2HD1      ILE  51 -13.451  -5.553   4.292
  909   3HD1  ILE  51          3HD1      ILE  51 -14.617  -5.248   2.994
  910    H    ASN  52           H        ASN  52 -17.135  -1.995   8.391
  911    HA   ASN  52           HA       ASN  52 -16.219  -3.037  11.046
  912   1HB   ASN  52          1HB       ASN  52 -14.434  -1.709   9.966
  913   2HB   ASN  52          2HB       ASN  52 -15.528  -0.324   9.863
  914   1HD2  ASN  52          2HD2      ASN  52 -14.453  -2.682  12.419
  915   2HD2  ASN  52          1HD2      ASN  52 -14.182  -1.420  13.607
  916    H    GLY  53           H        GLY  53 -18.629  -3.425  10.923
  917   1HA   GLY  53          1HA       GLY  53 -19.936  -1.522  12.718
  918   2HA   GLY  53          2HA       GLY  53 -20.725  -1.691  11.148
  Start of MODEL   18
    1   1H    MET   1          1H        MET   1   7.794  21.133   1.144
    2   2H    MET   1          2H        MET   1   9.327  20.564   1.240
    3   3H    MET   1          3H        MET   1   9.005  22.129   1.593
    4    HA   MET   1           HA       MET   1   8.359  22.605  -0.658
    5   1HB   MET   1          1HB       MET   1  11.128  21.378  -0.371
    6   2HB   MET   1          2HB       MET   1  10.563  22.196  -1.833
    7   1HG   MET   1          1HG       MET   1  10.099  24.244  -0.525
    8   2HG   MET   1          2HG       MET   1  10.741  23.460   0.925
    9   1HE   MET   1          1HE       MET   1  11.684  26.302  -0.221
   10   2HE   MET   1          2HE       MET   1  12.321  25.571   1.271
   11   3HE   MET   1          3HE       MET   1  13.439  26.178   0.030
   12    H    ASP   2           H        ASP   2  10.091  19.441  -1.035
   13    HA   ASP   2           HA       ASP   2   8.995  18.928  -3.535
   14   1HB   ASP   2          1HB       ASP   2   9.986  16.920  -1.472
   15   2HB   ASP   2          2HB       ASP   2   9.806  16.617  -3.198
   16    H    TYR   3           H        TYR   3   7.732  17.788  -0.416
   17    HA   TYR   3           HA       TYR   3   5.883  16.670   0.194
   18   1HB   TYR   3          1HB       TYR   3   5.366  19.168  -0.592
   19   2HB   TYR   3          2HB       TYR   3   4.295  18.384  -1.723
   20    HD1  TYR   3           1HD      TYR   3   3.634  20.397   0.448
   21    HD2  TYR   3           2HD      TYR   3   3.510  16.078   0.457
   22    HE1  TYR   3           1HE      TYR   3   1.940  20.443   2.258
   23    HE2  TYR   3           2HE      TYR   3   1.834  16.141   2.279
   24    HH   TYR   3           HH       TYR   3   0.690  19.203   3.732
   25    H    LEU   4           H        LEU   4   7.053  14.995  -1.401
   26    HA   LEU   4           HA       LEU   4   4.820  13.480  -2.589
   27   1HB   LEU   4          1HB       LEU   4   6.113  12.888  -4.587
   28   2HB   LEU   4          2HB       LEU   4   5.687  14.586  -4.467
   29    HG   LEU   4           HG       LEU   4   8.151  14.743  -3.383
   30   1HD1  LEU   4          1HD1      LEU   4   9.750  13.335  -4.467
   31   2HD1  LEU   4          2HD1      LEU   4   8.546  12.220  -3.799
   32   3HD1  LEU   4          3HD1      LEU   4   8.508  12.619  -5.515
   33   1HD2  LEU   4          1HD2      LEU   4   7.680  14.614  -6.390
   34   2HD2  LEU   4          2HD2      LEU   4   7.333  16.014  -5.367
   35   3HD2  LEU   4          3HD2      LEU   4   9.001  15.455  -5.556
   36    H    ARG   5           H        ARG   5   8.262  13.274  -1.598
   37    HA   ARG   5           HA       ARG   5   8.321  10.447  -1.164
   38   1HB   ARG   5          1HB       ARG   5  10.232  12.208  -1.272
   39   2HB   ARG   5          2HB       ARG   5   9.880  12.529   0.429
   40   1HG   ARG   5          1HG       ARG   5  10.317  10.060   0.887
   41   2HG   ARG   5          2HG       ARG   5  10.755   9.890  -0.827
   42   1HD   ARG   5          1HD       ARG   5  12.458  11.778  -0.429
   43   2HD   ARG   5          2HD       ARG   5  12.118  11.587   1.299
   44    HE   ARG   5           HE       ARG   5  12.875   9.125  -0.143
   45   1HH1  ARG   5          1HH2      ARG   5  14.148  11.769   1.781
   46   2HH1  ARG   5          2HH2      ARG   5  15.647  10.935   2.089
   47   1HH2  ARG   5          1HH1      ARG   5  14.824   8.146   0.258
   48   2HH2  ARG   5          2HH1      ARG   5  16.014   8.946   1.242
   49    H    GLU   6           H        GLU   6   7.389  13.122   0.910
   50    HA   GLU   6           HA       GLU   6   6.842  11.762   3.324
   51   1HB   GLU   6          1HB       GLU   6   6.942  14.317   2.752
   52   2HB   GLU   6          2HB       GLU   6   5.275  14.140   2.238
   53   1HG   GLU   6          1HG       GLU   6   5.158  14.917   4.458
   54   2HG   GLU   6          2HG       GLU   6   4.786  13.205   4.598
   55    H    LEU   7           H        LEU   7   4.783  12.237   0.465
   56    HA   LEU   7           HA       LEU   7   2.358  11.161   1.633
   57   1HB   LEU   7          1HB       LEU   7   3.138  11.319  -1.314
   58   2HB   LEU   7          2HB       LEU   7   1.521  11.101  -0.662
   59    HG   LEU   7           HG       LEU   7   3.254  13.598  -0.422
   60   1HD1  LEU   7          1HD1      LEU   7   2.270  13.193  -2.662
   61   2HD1  LEU   7          2HD1      LEU   7   0.657  13.085  -1.921
   62   3HD1  LEU   7          3HD1      LEU   7   1.565  14.611  -1.869
   63   1HD2  LEU   7          1HD2      LEU   7   0.437  13.056   0.598
   64   2HD2  LEU   7          2HD2      LEU   7   1.882  13.420   1.581
   65   3HD2  LEU   7          3HD2      LEU   7   1.207  14.654   0.510
   66    H    TYR   8           H        TYR   8   4.673   9.809  -0.684
   67    HA   TYR   8           HA       TYR   8   3.789   7.167  -1.039
   68   1HB   TYR   8          1HB       TYR   8   5.793   8.750  -1.924
   69   2HB   TYR   8          2HB       TYR   8   6.723   8.026  -0.676
   70    HD1  TYR   8           1HD      TYR   8   6.889   8.148  -3.842
   71    HD2  TYR   8           2HD      TYR   8   6.011   5.075  -0.939
   72    HE1  TYR   8           1HE      TYR   8   7.843   6.419  -5.349
   73    HE2  TYR   8           2HE      TYR   8   6.929   3.368  -2.483
   74    HH   TYR   8           HH       TYR   8   7.960   2.957  -4.480
   75    H    LYS   9           H        LYS   9   6.104   8.259   1.431
   76    HA   LYS   9           HA       LYS   9   6.447   5.689   2.518
   77   1HB   LYS   9          1HB       LYS   9   7.828   7.844   2.764
   78   2HB   LYS   9          2HB       LYS   9   6.753   8.294   4.095
   79   1HG   LYS   9          1HG       LYS   9   7.485   6.402   5.416
   80   2HG   LYS   9          2HG       LYS   9   8.184   5.604   3.995
   81   1HD   LYS   9          1HD       LYS   9  10.015   6.460   5.171
   82   2HD   LYS   9          2HD       LYS   9   9.803   7.513   3.764
   83   1HE   LYS   9          1HE       LYS   9   8.698   9.213   5.166
   84   2HE   LYS   9          2HE       LYS   9   8.775   8.143   6.573
   85   1HZ   LYS   9          1HZ       LYS   9  11.199   8.262   6.468
   86   2HZ   LYS   9          2HZ       LYS   9  11.151   9.226   5.149
   87   3HZ   LYS   9          3HZ       LYS   9  10.587   9.770   6.582
   88    H    LEU  10           H        LEU  10   4.273   8.158   3.945
   89    HA   LEU  10           HA       LEU  10   3.066   6.315   5.690
   90   1HB   LEU  10          1HB       LEU  10   2.144   8.992   4.593
   91   2HB   LEU  10          2HB       LEU  10   1.194   8.037   5.733
   92    HG   LEU  10           HG       LEU  10   3.689   7.941   6.913
   93   1HD1  LEU  10          1HD1      LEU  10   4.778   9.518   5.515
   94   2HD1  LEU  10          2HD1      LEU  10   3.483  10.703   5.729
   95   3HD1  LEU  10          3HD1      LEU  10   4.520  10.254   7.096
   96   1HD2  LEU  10          1HD2      LEU  10   1.532  10.041   7.399
   97   2HD2  LEU  10          2HD2      LEU  10   1.539   8.385   8.049
   98   3HD2  LEU  10          3HD2      LEU  10   2.780   9.536   8.562
   99    H    GLU  11           H        GLU  11   2.264   7.057   2.309
  100    HA   GLU  11           HA       GLU  11   0.036   5.274   2.028
  101   1HB   GLU  11          1HB       GLU  11   2.043   6.644   0.332
  102   2HB   GLU  11          2HB       GLU  11   1.542   5.228  -0.417
  103   1HG   GLU  11          1HG       GLU  11  -0.358   7.371   0.685
  104   2HG   GLU  11          2HG       GLU  11   0.317   7.396  -0.930
  105    H    GLN  12           H        GLN  12   3.605   4.523   2.013
  106    HA   GLN  12           HA       GLN  12   3.035   1.741   1.724
  107   1HB   GLN  12          1HB       GLN  12   5.518   3.355   2.264
  108   2HB   GLN  12          2HB       GLN  12   5.522   1.585   2.358
  109   1HG   GLN  12          1HG       GLN  12   4.537   1.471   0.087
  110   2HG   GLN  12          2HG       GLN  12   4.693   3.207  -0.065
  111   1HE2  GLN  12          2HE2      GLN  12   6.163   0.527  -1.190
  112   2HE2  GLN  12          1HE2      GLN  12   7.842   1.035  -1.129
  113    H    GLN  13           H        GLN  13   3.167   3.741   4.558
  114    HA   GLN  13           HA       GLN  13   3.733   1.578   6.431
  115   1HB   GLN  13          1HB       GLN  13   2.278   4.249   6.751
  116   2HB   GLN  13          2HB       GLN  13   2.533   3.132   8.083
  117   1HG   GLN  13          1HG       GLN  13   4.913   4.110   6.484
  118   2HG   GLN  13          2HG       GLN  13   4.195   5.114   7.738
  119   1HE2  GLN  13          2HE2      GLN  13   6.425   2.535   7.181
  120   2HE2  GLN  13          1HE2      GLN  13   6.637   2.118   8.877
  121    H    ALA  14           H        ALA  14   0.682   2.687   4.923
  122    HA   ALA  14           HA       ALA  14  -0.930   0.697   6.370
  123   1HB   ALA  14          1HB       ALA  14  -1.944   2.716   5.347
  124   2HB   ALA  14          2HB       ALA  14  -1.386   2.203   3.737
  125   3HB   ALA  14          3HB       ALA  14  -2.593   1.236   4.611
  126    H    MET  15           H        MET  15   0.853   0.770   3.266
  127    HA   MET  15           HA       MET  15   0.086  -1.834   2.320
  128   1HB   MET  15          1HB       MET  15   1.229  -0.149   0.907
  129   2HB   MET  15          2HB       MET  15   2.659  -0.263   1.921
  130   1HG   MET  15          1HG       MET  15   3.008  -1.408  -0.156
  131   2HG   MET  15          2HG       MET  15   3.185  -2.462   1.233
  132   1HE   MET  15          1HE       MET  15  -0.383  -1.427  -0.256
  133   2HE   MET  15          2HE       MET  15   0.806  -1.250  -1.571
  134   3HE   MET  15          3HE       MET  15  -0.431  -2.528  -1.649
  135    H    LYS  16           H        LYS  16   2.841  -0.902   4.458
  136    HA   LYS  16           HA       LYS  16   3.868  -3.585   4.647
  137   1HB   LYS  16          1HB       LYS  16   4.714  -1.062   5.363
  138   2HB   LYS  16          2HB       LYS  16   4.310  -1.747   6.940
  139   1HG   LYS  16          1HG       LYS  16   5.810  -3.683   6.474
  140   2HG   LYS  16          2HG       LYS  16   6.104  -3.073   4.834
  141   1HD   LYS  16          1HD       LYS  16   7.126  -1.014   5.797
  142   2HD   LYS  16          2HD       LYS  16   6.924  -1.708   7.425
  143   1HE   LYS  16          1HE       LYS  16   8.330  -3.654   6.750
  144   2HE   LYS  16          2HE       LYS  16   8.515  -2.962   5.134
  145   1HZ   LYS  16          1HZ       LYS  16   9.655  -1.059   6.153
  146   2HZ   LYS  16          2HZ       LYS  16   9.495  -1.708   7.646
  147   3HZ   LYS  16          3HZ       LYS  16  10.426  -2.445   6.528
  148    H    LEU  17           H        LEU  17   1.616  -1.715   6.642
  149    HA   LEU  17           HA       LEU  17   1.034  -3.764   8.557
  150   1HB   LEU  17          1HB       LEU  17  -0.111  -1.194   7.619
  151   2HB   LEU  17          2HB       LEU  17  -1.341  -2.278   8.132
  152    HG   LEU  17           HG       LEU  17   1.112  -1.501   9.785
  153   1HD1  LEU  17          1HD1      LEU  17  -0.461   0.362   9.390
  154   2HD1  LEU  17          2HD1      LEU  17  -1.793  -0.618  10.042
  155   3HD1  LEU  17          3HD1      LEU  17  -0.436  -0.140  11.089
  156   1HD2  LEU  17          1HD2      LEU  17  -1.390  -3.051  10.603
  157   2HD2  LEU  17          2HD2      LEU  17   0.260  -3.693  10.541
  158   3HD2  LEU  17          3HD2      LEU  17  -0.148  -2.446  11.716
  159    H    TYR  18           H        TYR  18  -0.628  -3.012   5.444
  160    HA   TYR  18           HA       TYR  18  -2.285  -5.208   5.283
  161   1HB   TYR  18          1HB       TYR  18  -0.954  -3.397   3.308
  162   2HB   TYR  18          2HB       TYR  18  -1.748  -4.795   2.693
  163    HD1  TYR  18           1HD      TYR  18  -4.144  -5.189   4.100
  164    HD2  TYR  18           2HD      TYR  18  -2.306  -1.472   2.981
  165    HE1  TYR  18           1HE      TYR  18  -6.349  -4.067   4.279
  166    HE2  TYR  18           2HE      TYR  18  -4.486  -0.313   3.240
  167    HH   TYR  18           HH       TYR  18  -6.696  -0.524   3.808
  168    H    ARG  19           H        ARG  19   1.178  -5.188   4.372
  169    HA   ARG  19           HA       ARG  19   1.311  -7.786   3.264
  170   1HB   ARG  19          1HB       ARG  19   3.071  -5.849   3.392
  171   2HB   ARG  19          2HB       ARG  19   3.572  -6.606   4.910
  172   1HG   ARG  19          1HG       ARG  19   3.971  -8.749   3.642
  173   2HG   ARG  19          2HG       ARG  19   3.477  -7.917   2.154
  174   1HD   ARG  19          1HD       ARG  19   5.344  -6.252   2.570
  175   2HD   ARG  19          2HD       ARG  19   5.875  -7.280   3.917
  176    HE   ARG  19           HE       ARG  19   5.587  -8.763   1.432
  177   1HH1  ARG  19          1HH2      ARG  19   7.872  -6.700   3.112
  178   2HH1  ARG  19          2HH2      ARG  19   9.224  -7.305   2.192
  179   1HH2  ARG  19          1HH1      ARG  19   7.353  -9.467   0.288
  180   2HH2  ARG  19          2HH1      ARG  19   8.929  -8.823   0.637
  181    H    GLU  20           H        GLU  20   1.140  -6.893   6.643
  182    HA   GLU  20           HA       GLU  20   1.612  -9.703   7.547
  183   1HB   GLU  20          1HB       GLU  20   2.495  -7.352   8.553
  184   2HB   GLU  20          2HB       GLU  20   0.986  -7.444   9.434
  185   1HG   GLU  20          1HG       GLU  20   1.588  -9.693  10.290
  186   2HG   GLU  20          2HG       GLU  20   3.090  -9.656   9.366
  187    H    ALA  21           H        ALA  21  -0.846  -7.179   7.604
  188    HA   ALA  21           HA       ALA  21  -3.005  -8.553   8.794
  189   1HB   ALA  21          1HB       ALA  21  -3.035  -6.167   8.030
  190   2HB   ALA  21          2HB       ALA  21  -3.135  -6.756   6.350
  191   3HB   ALA  21          3HB       ALA  21  -4.449  -7.092   7.469
  192    H    SER  22           H        SER  22  -1.779  -8.839   5.429
  193    HA   SER  22           HA       SER  22  -3.626 -10.685   4.398
  194   1HB   SER  22          1HB       SER  22  -1.763  -9.499   3.177
  195   2HB   SER  22          2HB       SER  22  -0.634 -10.675   3.871
  196    HG   SER  22           HG       SER  22  -2.757 -11.075   2.029
  197    H    GLU  23           H        GLU  23  -0.899 -11.374   6.635
  198    HA   GLU  23           HA       GLU  23  -1.169 -14.278   6.449
  199   1HB   GLU  23          1HB       GLU  23   0.874 -12.890   7.196
  200   2HB   GLU  23          2HB       GLU  23   0.048 -12.721   8.740
  201   1HG   GLU  23          1HG       GLU  23  -0.070 -15.191   8.964
  202   2HG   GLU  23          2HG       GLU  23   0.736 -15.372   7.405
  203    H    LYS  24           H        LYS  24  -2.219 -11.774   8.745
  204    HA   LYS  24           HA       LYS  24  -3.845 -13.469  10.447
  205   1HB   LYS  24          1HB       LYS  24  -3.930 -10.479   9.865
  206   2HB   LYS  24          2HB       LYS  24  -4.929 -11.252  11.086
  207   1HG   LYS  24          1HG       LYS  24  -1.881 -11.367  11.113
  208   2HG   LYS  24          2HG       LYS  24  -2.836 -10.130  11.933
  209   1HD   LYS  24          1HD       LYS  24  -3.968 -11.843  13.296
  210   2HD   LYS  24          2HD       LYS  24  -3.039 -13.126  12.491
  211   1HE   LYS  24          1HE       LYS  24  -0.933 -12.165  13.313
  212   2HE   LYS  24          2HE       LYS  24  -1.807 -10.822  14.061
  213   1HZ   LYS  24          1HZ       LYS  24  -2.895 -12.413  15.535
  214   2HZ   LYS  24          2HZ       LYS  24  -2.138 -13.678  14.823
  215   3HZ   LYS  24          3HZ       LYS  24  -1.280 -12.579  15.669
  216    H    ALA  25           H        ALA  25  -4.432 -12.218   7.316
  217    HA   ALA  25           HA       ALA  25  -7.307 -12.961   7.341
  218   1HB   ALA  25          1HB       ALA  25  -6.691 -10.598   6.843
  219   2HB   ALA  25          2HB       ALA  25  -5.725 -11.158   5.460
  220   3HB   ALA  25          3HB       ALA  25  -7.474 -11.387   5.474
  221    H    ARG  26           H        ARG  26  -5.104 -14.951   6.994
  222    HA   ARG  26           HA       ARG  26  -4.561 -15.789   4.430
  223   1HB   ARG  26          1HB       ARG  26  -4.178 -17.987   5.402
  224   2HB   ARG  26          2HB       ARG  26  -3.626 -16.719   6.483
  225   1HG   ARG  26          1HG       ARG  26  -6.274 -17.154   7.343
  226   2HG   ARG  26          2HG       ARG  26  -5.737 -18.766   6.865
  227   1HD   ARG  26          1HD       ARG  26  -3.746 -18.478   8.354
  228   2HD   ARG  26          2HD       ARG  26  -4.349 -16.875   8.808
  229    HE   ARG  26           HE       ARG  26  -6.357 -18.914   9.235
  230   1HH1  ARG  26          1HH2      ARG  26  -3.510 -17.567  10.763
  231   2HH1  ARG  26          2HH2      ARG  26  -4.052 -18.001  12.363
  232   1HH2  ARG  26          1HH1      ARG  26  -6.991 -19.437  11.292
  233   2HH2  ARG  26          2HH1      ARG  26  -5.978 -19.035  12.646
  234    H    ASN  27           H        ASN  27  -7.774 -16.037   5.870
  235    HA   ASN  27           HA       ASN  27  -8.921 -18.047   4.279
  236   1HB   ASN  27          1HB       ASN  27  -9.980 -15.536   5.691
  237   2HB   ASN  27          2HB       ASN  27 -10.951 -16.873   5.141
  238   1HD2  ASN  27          2HD2      ASN  27 -11.078 -18.788   6.432
  239   2HD2  ASN  27          1HD2      ASN  27 -10.284 -18.861   7.996
  240    HA   PRO  28           HA       PRO  28  -9.110 -15.672   0.421
  241   1HB   PRO  28          1HB       PRO  28 -11.026 -17.079  -0.975
  242   2HB   PRO  28          2HB       PRO  28  -9.340 -17.627  -0.738
  243   1HG   PRO  28          1HG       PRO  28 -11.792 -18.404   0.863
  244   2HG   PRO  28          2HG       PRO  28 -10.528 -19.477   0.180
  245   1HD   PRO  28          1HD       PRO  28 -10.486 -18.700   2.780
  246   2HD   PRO  28          2HD       PRO  28  -8.967 -18.845   1.844
  247    H    GLU  29           H        GLU  29 -11.879 -16.176   2.463
  248    HA   GLU  29           HA       GLU  29 -13.778 -14.322   1.524
  249   1HB   GLU  29          1HB       GLU  29 -13.449 -16.018   3.674
  250   2HB   GLU  29          2HB       GLU  29 -13.213 -14.491   4.467
  251   1HG   GLU  29          1HG       GLU  29 -15.525 -14.986   4.691
  252   2HG   GLU  29          2HG       GLU  29 -15.420 -13.687   3.509
  253    H    LYS  30           H        LYS  30 -10.717 -13.730   2.958
  254    HA   LYS  30           HA       LYS  30 -11.169 -10.793   2.848
  255   1HB   LYS  30          1HB       LYS  30  -9.551 -12.350   4.894
  256   2HB   LYS  30          2HB       LYS  30  -9.477 -10.589   4.725
  257   1HG   LYS  30          1HG       LYS  30 -12.049 -12.099   5.318
  258   2HG   LYS  30          2HG       LYS  30 -10.982 -11.473   6.564
  259   1HD   LYS  30          1HD       LYS  30 -11.456  -9.263   6.147
  260   2HD   LYS  30          2HD       LYS  30 -11.907  -9.502   4.462
  261   1HE   LYS  30          1HE       LYS  30 -13.565 -10.747   6.672
  262   2HE   LYS  30          2HE       LYS  30 -13.758  -9.036   6.291
  263   1HZ   LYS  30          1HZ       LYS  30 -14.396  -9.582   4.065
  264   2HZ   LYS  30          2HZ       LYS  30 -13.992 -11.149   4.203
  265   3HZ   LYS  30          3HZ       LYS  30 -15.283 -10.554   5.029
  266    H    LYS  31           H        LYS  31  -8.765 -13.361   2.350
  267    HA   LYS  31           HA       LYS  31  -6.812 -11.678   1.140
  268   1HB   LYS  31          1HB       LYS  31  -6.678 -14.112   2.090
  269   2HB   LYS  31          2HB       LYS  31  -7.070 -14.613   0.451
  270   1HG   LYS  31          1HG       LYS  31  -5.055 -13.644  -0.420
  271   2HG   LYS  31          2HG       LYS  31  -4.805 -12.654   1.029
  272   1HD   LYS  31          1HD       LYS  31  -4.378 -14.652   2.377
  273   2HD   LYS  31          2HD       LYS  31  -4.610 -15.699   0.971
  274   1HE   LYS  31          1HE       LYS  31  -2.501 -13.493   1.162
  275   2HE   LYS  31          2HE       LYS  31  -2.201 -15.165   1.631
  276   1HZ   LYS  31          1HZ       LYS  31  -2.695 -15.849  -0.647
  277   2HZ   LYS  31          2HZ       LYS  31  -2.978 -14.304  -1.104
  278   3HZ   LYS  31          3HZ       LYS  31  -1.482 -14.760  -0.641
  279    H    SER  32           H        SER  32  -9.809 -12.171  -0.091
  280    HA   SER  32           HA       SER  32  -8.861 -11.129  -2.718
  281   1HB   SER  32          1HB       SER  32  -9.975 -13.499  -2.647
  282   2HB   SER  32          2HB       SER  32 -11.484 -12.616  -2.386
  283    HG   SER  32           HG       SER  32  -9.686 -12.498  -4.607
  284    H    VAL  33           H        VAL  33  -9.759  -9.916  -0.026
  285    HA   VAL  33           HA       VAL  33 -11.554  -7.815  -1.205
  286    HB   VAL  33           HB       VAL  33 -11.467  -8.791   1.673
  287   1HG1  VAL  33          1HG1      VAL  33 -11.809  -6.358   1.656
  288   2HG1  VAL  33          2HG1      VAL  33 -13.062  -6.520   0.404
  289   3HG1  VAL  33          3HG1      VAL  33 -13.322  -7.175   2.034
  290   1HG2  VAL  33          1HG2      VAL  33 -13.670  -8.881  -0.435
  291   2HG2  VAL  33          2HG2      VAL  33 -12.774 -10.279   0.203
  292   3HG2  VAL  33          3HG2      VAL  33 -13.847  -9.364   1.266
  293    H    LEU  34           H        LEU  34  -8.896  -8.389   1.292
  294    HA   LEU  34           HA       LEU  34  -8.150  -5.584   1.177
  295   1HB   LEU  34          1HB       LEU  34  -6.773  -6.043   2.835
  296   2HB   LEU  34          2HB       LEU  34  -7.812  -7.436   3.071
  297    HG   LEU  34           HG       LEU  34  -5.246  -7.360   1.531
  298   1HD1  LEU  34          1HD1      LEU  34  -5.060  -7.047   4.087
  299   2HD1  LEU  34          2HD1      LEU  34  -5.685  -8.675   4.259
  300   3HD1  LEU  34          3HD1      LEU  34  -4.134  -8.402   3.426
  301   1HD2  LEU  34          1HD2      LEU  34  -6.694  -9.830   2.527
  302   2HD2  LEU  34          2HD2      LEU  34  -6.660  -9.297   0.836
  303   3HD2  LEU  34          3HD2      LEU  34  -5.164  -9.798   1.626
  304    H    GLN  35           H        GLN  35  -7.666  -8.329  -0.856
  305    HA   GLN  35           HA       GLN  35  -5.289  -7.605  -2.178
  306   1HB   GLN  35          1HB       GLN  35  -6.716  -9.779  -2.203
  307   2HB   GLN  35          2HB       GLN  35  -7.684  -8.983  -3.437
  308   1HG   GLN  35          1HG       GLN  35  -6.197 -10.299  -4.643
  309   2HG   GLN  35          2HG       GLN  35  -5.445  -8.714  -4.753
  310   1HE2  GLN  35          2HE2      GLN  35  -4.278 -11.529  -4.933
  311   2HE2  GLN  35          1HE2      GLN  35  -3.005 -11.523  -3.718
  312    H    LYS  36           H        LYS  36  -8.593  -6.331  -2.512
  313    HA   LYS  36           HA       LYS  36  -8.115  -5.133  -5.136
  314   1HB   LYS  36          1HB       LYS  36 -10.361  -5.903  -3.743
  315   2HB   LYS  36          2HB       LYS  36 -10.356  -4.203  -3.326
  316   1HG   LYS  36          1HG       LYS  36 -10.528  -5.460  -6.098
  317   2HG   LYS  36          2HG       LYS  36 -11.798  -4.650  -5.198
  318   1HD   LYS  36          1HD       LYS  36 -11.299  -2.914  -6.519
  319   2HD   LYS  36          2HD       LYS  36 -10.045  -2.589  -5.318
  320   1HE   LYS  36          1HE       LYS  36  -8.375  -3.752  -6.717
  321   2HE   LYS  36          2HE       LYS  36  -9.643  -4.264  -7.840
  322   1HZ   LYS  36          1HZ       LYS  36 -10.028  -1.873  -8.318
  323   2HZ   LYS  36          2HZ       LYS  36  -8.742  -1.458  -7.385
  324   3HZ   LYS  36          3HZ       LYS  36  -8.525  -2.352  -8.732
  325    H    ILE  37           H        ILE  37  -8.158  -4.016  -1.785
  326    HA   ILE  37           HA       ILE  37  -7.320  -1.266  -2.269
  327    HB   ILE  37           HB       ILE  37  -6.961  -3.189   0.059
  328   1HG1  ILE  37          1HG1      ILE  37  -8.971  -0.994  -0.303
  329   2HG1  ILE  37          2HG1      ILE  37  -9.236  -2.745  -0.335
  330   1HG2  ILE  37          1HG2      ILE  37  -5.184  -1.585   0.302
  331   2HG2  ILE  37          2HG2      ILE  37  -6.244  -0.250  -0.183
  332   3HG2  ILE  37          3HG2      ILE  37  -6.445  -1.033   1.387
  333   1HD1  ILE  37          1HD1      ILE  37  -8.487  -2.840   2.069
  334   2HD1  ILE  37          2HD1      ILE  37  -8.561  -1.056   2.076
  335   3HD1  ILE  37          3HD1      ILE  37 -10.017  -1.996   1.764
  336    H    LEU  38           H        LEU  38  -5.425  -4.308  -1.577
  337    HA   LEU  38           HA       LEU  38  -2.880  -3.159  -1.829
  338   1HB   LEU  38          1HB       LEU  38  -3.957  -5.914  -2.468
  339   2HB   LEU  38          2HB       LEU  38  -2.270  -5.543  -2.728
  340    HG   LEU  38           HG       LEU  38  -3.632  -5.200  -0.015
  341   1HD1  LEU  38          1HD1      LEU  38  -3.646  -7.572  -0.668
  342   2HD1  LEU  38          2HD1      LEU  38  -1.916  -7.489  -1.066
  343   3HD1  LEU  38          3HD1      LEU  38  -2.469  -7.284   0.613
  344   1HD2  LEU  38          1HD2      LEU  38  -0.763  -5.079  -1.008
  345   2HD2  LEU  38          2HD2      LEU  38  -1.675  -3.862  -0.077
  346   3HD2  LEU  38          3HD2      LEU  38  -1.153  -5.365   0.686
  347    H    GLU  39           H        GLU  39  -4.963  -4.299  -4.566
  348    HA   GLU  39           HA       GLU  39  -2.982  -3.636  -6.539
  349   1HB   GLU  39          1HB       GLU  39  -4.989  -5.164  -6.849
  350   2HB   GLU  39          2HB       GLU  39  -6.025  -3.730  -6.831
  351   1HG   GLU  39          1HG       GLU  39  -4.725  -2.868  -8.831
  352   2HG   GLU  39          2HG       GLU  39  -3.868  -4.413  -8.876
  353    H    ASP  40           H        ASP  40  -5.684  -1.710  -5.214
  354    HA   ASP  40           HA       ASP  40  -5.324   0.637  -6.789
  355   1HB   ASP  40          1HB       ASP  40  -6.526  -0.177  -4.125
  356   2HB   ASP  40          2HB       ASP  40  -6.331   1.482  -4.449
  357    H    GLU  41           H        GLU  41  -3.687  -0.513  -3.809
  358    HA   GLU  41           HA       GLU  41  -2.415   2.118  -3.364
  359   1HB   GLU  41          1HB       GLU  41  -1.768  -0.565  -2.121
  360   2HB   GLU  41          2HB       GLU  41  -1.057   0.971  -1.639
  361   1HG   GLU  41          1HG       GLU  41  -3.882   0.009  -1.178
  362   2HG   GLU  41          2HG       GLU  41  -2.632   0.282  -0.002
  363    H    GLU  42           H        GLU  42  -1.440  -1.001  -4.798
  364    HA   GLU  42           HA       GLU  42   1.266  -0.229  -5.367
  365   1HB   GLU  42          1HB       GLU  42   0.332  -2.547  -5.489
  366   2HB   GLU  42          2HB       GLU  42  -0.521  -2.098  -6.974
  367   1HG   GLU  42          1HG       GLU  42   1.627  -1.627  -8.086
  368   2HG   GLU  42          2HG       GLU  42   2.499  -1.901  -6.576
  369    H    LYS  43           H        LYS  43  -1.799   0.406  -7.081
  370    HA   LYS  43           HA       LYS  43  -0.583   1.777  -9.317
  371   1HB   LYS  43          1HB       LYS  43  -3.158   0.921  -8.730
  372   2HB   LYS  43          2HB       LYS  43  -3.312   2.652  -8.490
  373   1HG   LYS  43          1HG       LYS  43  -3.878   2.246 -10.743
  374   2HG   LYS  43          2HG       LYS  43  -2.242   2.917 -10.815
  375   1HD   LYS  43          1HD       LYS  43  -1.316   0.605 -11.023
  376   2HD   LYS  43          2HD       LYS  43  -2.946  -0.061 -10.949
  377   1HE   LYS  43          1HE       LYS  43  -1.949   1.877 -13.090
  378   2HE   LYS  43          2HE       LYS  43  -1.929   0.121 -13.253
  379   1HZ   LYS  43          1HZ       LYS  43  -4.351   0.118 -13.014
  380   2HZ   LYS  43          2HZ       LYS  43  -4.388   1.751 -12.897
  381   3HZ   LYS  43          3HZ       LYS  43  -3.904   1.039 -14.282
  382    H    HIS  44           H        HIS  44  -1.797   3.072  -6.109
  383    HA   HIS  44           HA       HIS  44  -1.230   5.762  -6.642
  384   1HB   HIS  44          1HB       HIS  44  -1.133   4.109  -4.070
  385   2HB   HIS  44          2HB       HIS  44  -1.164   5.835  -4.217
  386    HD2  HIS  44           2HD      HIS  44  -3.515   5.103  -6.746
  387    HE1  HIS  44           1HE      HIS  44  -5.984   4.844  -3.317
  388    HE2  HIS  44           2HE      HIS  44  -5.942   4.894  -5.845
  389    H    ILE  45           H        ILE  45   0.841   3.202  -5.201
  390    HA   ILE  45           HA       ILE  45   3.185   4.829  -4.890
  391    HB   ILE  45           HB       ILE  45   2.509   1.909  -4.835
  392   1HG1  ILE  45          1HG1      ILE  45   3.927   2.012  -2.773
  393   2HG1  ILE  45          2HG1      ILE  45   4.271   3.707  -3.113
  394   1HG2  ILE  45          1HG2      ILE  45   4.408   1.719  -6.326
  395   2HG2  ILE  45          2HG2      ILE  45   5.378   2.796  -5.288
  396   3HG2  ILE  45          3HG2      ILE  45   4.871   1.193  -4.712
  397   1HD1  ILE  45          1HD1      ILE  45   1.890   4.270  -2.771
  398   2HD1  ILE  45          2HD1      ILE  45   1.524   2.544  -2.503
  399   3HD1  ILE  45          3HD1      ILE  45   2.567   3.416  -1.372
  400    H    GLU  46           H        GLU  46   2.119   2.833  -7.719
  401    HA   GLU  46           HA       GLU  46   4.370   3.323  -9.334
  402   1HB   GLU  46          1HB       GLU  46   2.562   1.724  -9.881
  403   2HB   GLU  46          2HB       GLU  46   1.453   3.056 -10.143
  404   1HG   GLU  46          1HG       GLU  46   2.138   2.219 -12.257
  405   2HG   GLU  46          2HG       GLU  46   2.764   3.846 -12.061
  406    H    TRP  47           H        TRP  47   1.499   5.443  -8.910
  407    HA   TRP  47           HA       TRP  47   2.451   7.458 -10.751
  408   1HB   TRP  47          1HB       TRP  47   0.443   7.698  -8.491
  409   2HB   TRP  47          2HB       TRP  47   0.587   8.722  -9.896
  410    HD1  TRP  47           1HD      TRP  47   0.684   5.940 -11.882
  411    HE1  TRP  47           1HE      TRP  47  -1.556   4.780 -12.354
  412    HE3  TRP  47           3HE      TRP  47  -2.049   7.987  -8.131
  413    HZ2  TRP  47           2HZ      TRP  47  -4.276   4.861 -11.280
  414    HZ3  TRP  47           3HZ      TRP  47  -4.470   7.490  -7.848
  415    HH2  TRP  47           2HH      TRP  47  -5.590   5.898  -9.422
  416    H    LEU  48           H        LEU  48   2.563   7.089  -7.207
  417    HA   LEU  48           HA       LEU  48   3.749   9.601  -6.554
  418   1HB   LEU  48          1HB       LEU  48   3.589   6.849  -5.310
  419   2HB   LEU  48          2HB       LEU  48   4.495   8.070  -4.490
  420    HG   LEU  48           HG       LEU  48   1.605   8.528  -5.341
  421   1HD1  LEU  48          1HD1      LEU  48   1.814   6.539  -3.815
  422   2HD1  LEU  48          2HD1      LEU  48   2.571   7.607  -2.621
  423   3HD1  LEU  48          3HD1      LEU  48   0.901   7.886  -3.143
  424   1HD2  LEU  48          1HD2      LEU  48   3.386   9.856  -3.247
  425   2HD2  LEU  48          2HD2      LEU  48   2.853  10.583  -4.776
  426   3HD2  LEU  48          3HD2      LEU  48   1.666  10.219  -3.516
  427    H    GLU  49           H        GLU  49   5.288   6.477  -7.327
  428    HA   GLU  49           HA       GLU  49   8.024   7.398  -7.271
  429   1HB   GLU  49          1HB       GLU  49   6.820   5.008  -7.513
  430   2HB   GLU  49          2HB       GLU  49   7.061   5.277  -9.211
  431   1HG   GLU  49          1HG       GLU  49   9.277   5.391  -7.109
  432   2HG   GLU  49          2HG       GLU  49   8.837   3.931  -7.982
  433    H    THR  50           H        THR  50   5.447   7.649  -9.612
  434    HA   THR  50           HA       THR  50   7.220   8.266 -11.882
  435    HB   THR  50           HB       THR  50   4.217   8.420 -11.501
  436    HG1  THR  50           1HG      THR  50   4.948   6.383 -11.758
  437   1HG2  THR  50          1HG2      THR  50   4.709  10.141 -13.064
  438   2HG2  THR  50          2HG2      THR  50   5.841   9.070 -13.948
  439   3HG2  THR  50          3HG2      THR  50   4.082   8.723 -13.925
  440    H    ILE  51           H        ILE  51   5.415  10.076  -9.520
  441    HA   ILE  51           HA       ILE  51   6.240  12.700 -10.467
  442    HB   ILE  51           HB       ILE  51   4.569  11.533  -8.287
  443   1HG1  ILE  51          1HG1      ILE  51   3.081  13.454  -8.876
  444   2HG1  ILE  51          2HG1      ILE  51   4.309  14.057  -9.993
  445   1HG2  ILE  51          1HG2      ILE  51   6.024  12.881  -6.888
  446   2HG2  ILE  51          2HG2      ILE  51   5.680  14.320  -7.895
  447   3HG2  ILE  51          3HG2      ILE  51   4.386  13.527  -6.957
  448   1HD1  ILE  51          1HD1      ILE  51   4.034  12.018 -11.374
  449   2HD1  ILE  51          2HD1      ILE  51   2.825  11.413 -10.207
  450   3HD1  ILE  51          3HD1      ILE  51   2.504  12.882 -11.149
  451    H    ASN  52           H        ASN  52   7.847  10.317  -8.795
  452    HA   ASN  52           HA       ASN  52   9.763  12.176  -7.476
  453   1HB   ASN  52          1HB       ASN  52   8.515  10.381  -6.164
  454   2HB   ASN  52          2HB       ASN  52   9.454   9.186  -7.054
  455   1HD2  ASN  52          2HD2      ASN  52  10.063   8.590  -4.772
  456   2HD2  ASN  52          1HD2      ASN  52  11.411   9.462  -4.061
  457    H    GLY  53           H        GLY  53   9.921  11.844 -10.340
  458   1HA   GLY  53          1HA       GLY  53  12.725  11.679 -10.655
  459   2HA   GLY  53          2HA       GLY  53  12.066  10.130 -11.179
  460   1H    MET   1          1H        MET   1  -6.196 -10.601  15.388
  461   2H    MET   1          2H        MET   1  -7.377 -10.399  14.263
  462   3H    MET   1          3H        MET   1  -7.354 -11.736  15.194
  463    HA   MET   1           HA       MET   1  -9.073 -10.271  15.903
  464   1HB   MET   1          1HB       MET   1  -8.630 -10.187  18.260
  465   2HB   MET   1          2HB       MET   1  -8.128 -11.722  17.570
  466   1HG   MET   1          1HG       MET   1  -5.752 -10.938  17.604
  467   2HG   MET   1          2HG       MET   1  -6.278  -9.446  18.386
  468   1HE   MET   1          1HE       MET   1  -7.052  -9.211  20.840
  469   2HE   MET   1          2HE       MET   1  -8.422 -10.315  20.569
  470   3HE   MET   1          3HE       MET   1  -7.335 -10.573  21.946
  471    H    ASP   2           H        ASP   2  -5.900  -8.503  16.132
  472    HA   ASP   2           HA       ASP   2  -7.422  -6.047  16.788
  473   1HB   ASP   2          1HB       ASP   2  -5.573  -5.536  18.231
  474   2HB   ASP   2          2HB       ASP   2  -6.178  -7.137  18.602
  475    H    TYR   3           H        TYR   3  -7.047  -6.491  14.054
  476    HA   TYR   3           HA       TYR   3  -4.969  -4.499  13.308
  477   1HB   TYR   3          1HB       TYR   3  -4.008  -5.899  11.692
  478   2HB   TYR   3          2HB       TYR   3  -4.126  -6.873  13.137
  479    HD1  TYR   3           1HD      TYR   3  -6.305  -8.453  13.272
  480    HD2  TYR   3           2HD      TYR   3  -4.711  -6.767   9.654
  481    HE1  TYR   3           1HE      TYR   3  -7.611 -10.107  11.919
  482    HE2  TYR   3           2HE      TYR   3  -5.979  -8.423   8.310
  483    HH   TYR   3           HH       TYR   3  -8.166 -10.828   9.839
  484    H    LEU   4           H        LEU   4  -7.393  -3.535  13.490
  485    HA   LEU   4           HA       LEU   4  -8.038  -2.987  10.658
  486   1HB   LEU   4          1HB       LEU   4 -10.426  -3.134  10.971
  487   2HB   LEU   4          2HB       LEU   4  -9.599  -4.653  11.228
  488    HG   LEU   4           HG       LEU   4  -9.708  -3.618  13.815
  489   1HD1  LEU   4          1HD1      LEU   4 -11.264  -1.813  13.024
  490   2HD1  LEU   4          2HD1      LEU   4 -12.375  -3.076  12.467
  491   3HD1  LEU   4          3HD1      LEU   4 -12.011  -2.913  14.196
  492   1HD2  LEU   4          1HD2      LEU   4 -11.706  -5.470  12.461
  493   2HD2  LEU   4          2HD2      LEU   4 -10.150  -5.945  13.179
  494   3HD2  LEU   4          3HD2      LEU   4 -11.440  -5.316  14.214
  495    H    ARG   5           H        ARG   5  -8.895  -1.759  13.945
  496    HA   ARG   5           HA       ARG   5  -9.168   1.028  13.281
  497   1HB   ARG   5          1HB       ARG   5  -8.242  -0.494  15.751
  498   2HB   ARG   5          2HB       ARG   5  -8.212   1.270  15.688
  499   1HG   ARG   5          1HG       ARG   5 -10.591   1.380  15.202
  500   2HG   ARG   5          2HG       ARG   5 -10.719  -0.390  15.192
  501   1HD   ARG   5          1HD       ARG   5 -10.205  -0.545  17.522
  502   2HD   ARG   5          2HD       ARG   5  -9.646   1.127  17.598
  503    HE   ARG   5           HE       ARG   5 -11.994   1.848  17.131
  504   1HH1  ARG   5          1HH2      ARG   5 -11.552  -1.256  18.712
  505   2HH1  ARG   5          2HH2      ARG   5 -13.101  -1.157  19.505
  506   1HH2  ARG   5          1HH1      ARG   5 -13.927   1.900  18.174
  507   2HH2  ARG   5          2HH1      ARG   5 -14.403   0.584  19.204
  508    H    GLU   6           H        GLU   6  -6.238  -0.934  13.752
  509    HA   GLU   6           HA       GLU   6  -4.434   1.294  13.765
  510   1HB   GLU   6          1HB       GLU   6  -4.018  -1.110  14.622
  511   2HB   GLU   6          2HB       GLU   6  -3.840  -1.594  12.944
  512   1HG   GLU   6          1HG       GLU   6  -1.645  -1.290  13.712
  513   2HG   GLU   6          2HG       GLU   6  -1.951   0.159  12.770
  514    H    LEU   7           H        LEU   7  -5.467  -0.926  11.173
  515    HA   LEU   7           HA       LEU   7  -3.766   0.037   9.085
  516   1HB   LEU   7          1HB       LEU   7  -6.584  -1.092   8.743
  517   2HB   LEU   7          2HB       LEU   7  -5.305  -1.030   7.539
  518    HG   LEU   7           HG       LEU   7  -5.468  -2.779  10.004
  519   1HD1  LEU   7          1HD1      LEU   7  -6.778  -3.482   8.016
  520   2HD1  LEU   7          2HD1      LEU   7  -5.307  -3.411   7.018
  521   3HD1  LEU   7          3HD1      LEU   7  -5.443  -4.600   8.331
  522   1HD2  LEU   7          1HD2      LEU   7  -3.173  -2.605   8.031
  523   2HD2  LEU   7          2HD2      LEU   7  -3.129  -2.119   9.750
  524   3HD2  LEU   7          3HD2      LEU   7  -3.368  -3.817   9.326
  525    H    TYR   8           H        TYR   8  -7.106   0.817   9.866
  526    HA   TYR   8           HA       TYR   8  -7.824   2.659   7.904
  527   1HB   TYR   8          1HB       TYR   8  -8.898   1.486  10.192
  528   2HB   TYR   8          2HB       TYR   8  -8.635   3.018  10.868
  529    HD1  TYR   8           1HD      TYR   8 -11.060   1.027   9.561
  530    HD2  TYR   8           2HD      TYR   8  -9.559   5.043   9.089
  531    HE1  TYR   8           1HE      TYR   8 -13.313   1.791   8.815
  532    HE2  TYR   8           2HE      TYR   8 -11.810   5.797   8.347
  533    HH   TYR   8           HH       TYR   8 -13.991   5.212   8.010
  534    H    LYS   9           H        LYS   9  -6.176   3.371  10.975
  535    HA   LYS   9           HA       LYS   9  -6.241   6.210  10.593
  536   1HB   LYS   9          1HB       LYS   9  -4.959   4.324  12.526
  537   2HB   LYS   9          2HB       LYS   9  -3.935   5.701  12.174
  538   1HG   LYS   9          1HG       LYS   9  -5.164   6.465  13.999
  539   2HG   LYS   9          2HG       LYS   9  -5.952   7.211  12.624
  540   1HD   LYS   9          1HD       LYS   9  -7.869   6.446  13.531
  541   2HD   LYS   9          2HD       LYS   9  -7.442   4.880  12.856
  542   1HE   LYS   9          1HE       LYS   9  -6.856   5.901  15.681
  543   2HE   LYS   9          2HE       LYS   9  -8.096   4.729  15.229
  544   1HZ   LYS   9          1HZ       LYS   9  -6.298   3.251  14.465
  545   2HZ   LYS   9          2HZ       LYS   9  -5.164   4.306  15.017
  546   3HZ   LYS   9          3HZ       LYS   9  -6.172   3.579  16.072
  547    H    LEU  10           H        LEU  10  -3.374   4.147  10.032
  548    HA   LEU  10           HA       LEU  10  -2.007   6.174   8.689
  549   1HB   LEU  10          1HB       LEU  10  -1.690   3.155   8.524
  550   2HB   LEU  10          2HB       LEU  10  -0.589   4.334   7.808
  551    HG   LEU  10           HG       LEU  10  -0.667   5.387  10.283
  552   1HD1  LEU  10          1HD1      LEU  10  -2.108   3.869  11.419
  553   2HD1  LEU  10          2HD1      LEU  10  -1.240   2.463  10.789
  554   3HD1  LEU  10          3HD1      LEU  10  -0.477   3.539  11.976
  555   1HD2  LEU  10          1HD2      LEU  10   1.053   3.012   9.467
  556   2HD2  LEU  10          2HD2      LEU  10   1.360   4.735   9.122
  557   3HD2  LEU  10          3HD2      LEU  10   1.422   4.149  10.783
  558    H    GLU  11           H        GLU  11  -4.367   3.835   7.388
  559    HA   GLU  11           HA       GLU  11  -4.252   4.654   4.666
  560   1HB   GLU  11          1HB       GLU  11  -6.084   3.235   6.517
  561   2HB   GLU  11          2HB       GLU  11  -6.983   3.984   5.306
  562   1HG   GLU  11          1HG       GLU  11  -4.556   2.157   4.845
  563   2HG   GLU  11          2HG       GLU  11  -6.210   1.607   4.865
  564    H    GLN  12           H        GLN  12  -5.997   6.322   7.435
  565    HA   GLN  12           HA       GLN  12  -6.837   8.356   5.533
  566   1HB   GLN  12          1HB       GLN  12  -7.143   7.965   8.507
  567   2HB   GLN  12          2HB       GLN  12  -7.640   9.454   7.677
  568   1HG   GLN  12          1HG       GLN  12  -8.961   8.103   6.063
  569   2HG   GLN  12          2HG       GLN  12  -8.592   6.659   6.992
  570   1HE2  GLN  12          2HE2      GLN  12  -9.000   7.396   9.649
  571   2HE2  GLN  12          1HE2      GLN  12 -10.642   7.986   9.853
  572    H    GLN  13           H        GLN  13  -4.038   7.980   7.549
  573    HA   GLN  13           HA       GLN  13  -3.331  10.781   7.630
  574   1HB   GLN  13          1HB       GLN  13  -1.634   8.253   7.741
  575   2HB   GLN  13          2HB       GLN  13  -0.929   9.857   7.872
  576   1HG   GLN  13          1HG       GLN  13  -3.119   8.920   9.774
  577   2HG   GLN  13          2HG       GLN  13  -1.411   8.605  10.044
  578   1HE2  GLN  13          2HE2      GLN  13  -1.491   9.863  12.033
  579   2HE2  GLN  13          1HE2      GLN  13  -1.530  11.618  11.939
  580    H    ALA  14           H        ALA  14  -2.910   8.348   5.041
  581    HA   ALA  14           HA       ALA  14  -1.363  10.197   3.346
  582   1HB   ALA  14          1HB       ALA  14  -1.247   7.743   3.039
  583   2HB   ALA  14          2HB       ALA  14  -2.997   7.675   2.720
  584   3HB   ALA  14          3HB       ALA  14  -1.918   8.527   1.595
  585    H    MET  15           H        MET  15  -4.819   9.252   3.600
  586    HA   MET  15           HA       MET  15  -5.881  11.053   1.603
  587   1HB   MET  15          1HB       MET  15  -7.103  10.091   4.246
  588   2HB   MET  15          2HB       MET  15  -7.955  11.066   3.082
  589   1HG   MET  15          1HG       MET  15  -6.912   8.983   1.539
  590   2HG   MET  15          2HG       MET  15  -7.405   8.196   3.041
  591   1HE   MET  15          1HE       MET  15  -8.870  11.363   1.086
  592   2HE   MET  15          2HE       MET  15  -8.333  10.166  -0.107
  593   3HE   MET  15          3HE       MET  15 -10.062  10.540   0.063
  594    H    LYS  16           H        LYS  16  -5.080  11.762   5.028
  595    HA   LYS  16           HA       LYS  16  -6.060  14.477   4.767
  596   1HB   LYS  16          1HB       LYS  16  -4.493  12.922   6.824
  597   2HB   LYS  16          2HB       LYS  16  -4.792  14.665   7.011
  598   1HG   LYS  16          1HG       LYS  16  -7.198  14.368   6.924
  599   2HG   LYS  16          2HG       LYS  16  -7.044  12.655   6.503
  600   1HD   LYS  16          1HD       LYS  16  -6.048  12.162   8.670
  601   2HD   LYS  16          2HD       LYS  16  -6.130  13.891   9.121
  602   1HE   LYS  16          1HE       LYS  16  -8.579  13.861   8.865
  603   2HE   LYS  16          2HE       LYS  16  -8.533  12.175   8.338
  604   1HZ   LYS  16          1HZ       LYS  16  -7.705  11.567  10.551
  605   2HZ   LYS  16          2HZ       LYS  16  -7.715  13.128  11.038
  606   3HZ   LYS  16          3HZ       LYS  16  -9.118  12.368  10.701
  607    H    LEU  17           H        LEU  17  -2.899  12.969   4.462
  608    HA   LEU  17           HA       LEU  17  -1.443  15.398   3.951
  609   1HB   LEU  17          1HB       LEU  17  -1.121  12.462   3.573
  610   2HB   LEU  17          2HB       LEU  17  -0.265  13.381   2.402
  611    HG   LEU  17           HG       LEU  17  -0.102  13.933   5.407
  612   1HD1  LEU  17          1HD1      LEU  17   0.665  11.645   4.915
  613   2HD1  LEU  17          2HD1      LEU  17   1.805  12.282   3.705
  614   3HD1  LEU  17          3HD1      LEU  17   1.987  12.707   5.427
  615   1HD2  LEU  17          1HD2      LEU  17   1.818  14.697   3.162
  616   2HD2  LEU  17          2HD2      LEU  17   0.687  15.815   3.949
  617   3HD2  LEU  17          3HD2      LEU  17   1.996  15.087   4.882
  618    H    TYR  18           H        TYR  18  -3.254  13.197   1.723
  619    HA   TYR  18           HA       TYR  18  -3.095  14.770  -0.575
  620   1HB   TYR  18          1HB       TYR  18  -5.015  12.716   0.512
  621   2HB   TYR  18          2HB       TYR  18  -5.404  13.452  -0.980
  622    HD1  TYR  18           1HD      TYR  18  -2.902  13.674  -2.432
  623    HD2  TYR  18           2HD      TYR  18  -4.265  10.509   0.133
  624    HE1  TYR  18           1HE      TYR  18  -1.161  12.159  -3.379
  625    HE2  TYR  18           2HE      TYR  18  -2.525   9.001  -0.798
  626    HH   TYR  18           HH       TYR  18  -0.770   8.813  -2.246
  627    H    ARG  19           H        ARG  19  -5.589  15.089   2.007
  628    HA   ARG  19           HA       ARG  19  -7.056  17.212   0.781
  629   1HB   ARG  19          1HB       ARG  19  -6.648  16.407   3.682
  630   2HB   ARG  19          2HB       ARG  19  -7.620  17.803   3.237
  631   1HG   ARG  19          1HG       ARG  19  -9.115  16.414   1.871
  632   2HG   ARG  19          2HG       ARG  19  -8.141  14.986   2.210
  633   1HD   ARG  19          1HD       ARG  19 -10.091  14.953   3.624
  634   2HD   ARG  19          2HD       ARG  19  -8.655  15.202   4.632
  635    HE   ARG  19           HE       ARG  19  -9.739  17.753   3.945
  636   1HH1  ARG  19          1HH2      ARG  19 -10.711  15.025   5.917
  637   2HH1  ARG  19          2HH2      ARG  19 -11.620  16.030   7.014
  638   1HH2  ARG  19          1HH1      ARG  19 -10.903  18.973   5.392
  639   2HH2  ARG  19          2HH1      ARG  19 -11.722  18.202   6.716
  640    H    GLU  20           H        GLU  20  -3.972  17.443   2.460
  641    HA   GLU  20           HA       GLU  20  -4.170  20.426   2.489
  642   1HB   GLU  20          1HB       GLU  20  -3.378  18.726   4.410
  643   2HB   GLU  20          2HB       GLU  20  -1.826  18.925   3.630
  644   1HG   GLU  20          1HG       GLU  20  -1.993  21.391   3.852
  645   2HG   GLU  20          2HG       GLU  20  -3.593  21.233   4.573
  646    H    ALA  21           H        ALA  21  -2.104  17.841   1.293
  647    HA   ALA  21           HA       ALA  21  -0.270  19.284  -0.299
  648   1HB   ALA  21          1HB       ALA  21  -0.216  16.831   0.057
  649   2HB   ALA  21          2HB       ALA  21  -1.659  16.650  -0.959
  650   3HB   ALA  21          3HB       ALA  21  -0.140  17.249  -1.664
  651    H    SER  22           H        SER  22  -3.694  18.415  -1.056
  652    HA   SER  22           HA       SER  22  -3.736  19.576  -3.664
  653   1HB   SER  22          1HB       SER  22  -5.422  17.998  -2.725
  654   2HB   SER  22          2HB       SER  22  -6.029  19.296  -1.682
  655    HG   SER  22           HG       SER  22  -6.470  20.489  -3.623
  656    H    GLU  23           H        GLU  23  -3.841  21.185  -0.519
  657    HA   GLU  23           HA       GLU  23  -4.952  23.720  -1.507
  658   1HB   GLU  23          1HB       GLU  23  -4.948  22.747   0.911
  659   2HB   GLU  23          2HB       GLU  23  -3.294  23.325   0.984
  660   1HG   GLU  23          1HG       GLU  23  -4.643  25.015   1.953
  661   2HG   GLU  23          2HG       GLU  23  -4.095  25.633   0.402
  662    H    LYS  24           H        LYS  24  -1.733  22.397  -0.743
  663    HA   LYS  24           HA       LYS  24  -0.240  24.777  -1.602
  664   1HB   LYS  24          1HB       LYS  24   0.511  21.959  -0.736
  665   2HB   LYS  24          2HB       LYS  24   1.684  22.957  -1.592
  666   1HG   LYS  24          1HG       LYS  24   2.141  23.361   0.666
  667   2HG   LYS  24          2HG       LYS  24   1.321  24.792   0.072
  668   1HD   LYS  24          1HD       LYS  24  -0.846  23.512   1.122
  669   2HD   LYS  24          2HD       LYS  24   0.404  22.687   2.033
  670   1HE   LYS  24          1HE       LYS  24  -0.262  24.508   3.382
  671   2HE   LYS  24          2HE       LYS  24   1.293  24.992   2.697
  672   1HZ   LYS  24          1HZ       LYS  24   0.052  26.312   1.041
  673   2HZ   LYS  24          2HZ       LYS  24  -1.379  25.842   1.682
  674   3HZ   LYS  24          3HZ       LYS  24  -0.362  26.777   2.546
  675    H    ALA  25           H        ALA  25  -0.784  21.591  -3.088
  676    HA   ALA  25           HA       ALA  25   0.212  22.428  -5.705
  677   1HB   ALA  25          1HB       ALA  25   0.503  20.096  -4.817
  678   2HB   ALA  25          2HB       ALA  25  -1.269  19.881  -4.918
  679   3HB   ALA  25          3HB       ALA  25  -0.330  20.193  -6.375
  680    H    ARG  26           H        ARG  26  -1.716  24.246  -4.997
  681    HA   ARG  26           HA       ARG  26  -4.344  23.668  -5.972
  682   1HB   ARG  26          1HB       ARG  26  -4.615  26.126  -6.039
  683   2HB   ARG  26          2HB       ARG  26  -4.048  25.483  -4.519
  684   1HG   ARG  26          1HG       ARG  26  -2.998  27.624  -5.105
  685   2HG   ARG  26          2HG       ARG  26  -1.814  26.348  -4.849
  686   1HD   ARG  26          1HD       ARG  26  -1.332  26.180  -7.190
  687   2HD   ARG  26          2HD       ARG  26  -2.789  27.075  -7.623
  688    HE   ARG  26           HE       ARG  26  -1.736  29.092  -7.186
  689   1HH1  ARG  26          1HH2      ARG  26   0.462  26.582  -6.068
  690   2HH1  ARG  26          2HH2      ARG  26   1.832  27.651  -6.142
  691   1HH2  ARG  26          1HH1      ARG  26   0.048  30.381  -7.213
  692   2HH2  ARG  26          2HH1      ARG  26   1.596  29.747  -6.738
  693    H    ASN  27           H        ASN  27  -1.508  23.833  -7.757
  694    HA   ASN  27           HA       ASN  27  -2.412  24.816 -10.286
  695   1HB   ASN  27          1HB       ASN  27  -0.039  24.607  -9.577
  696   2HB   ASN  27          2HB       ASN  27  -0.194  22.851  -9.532
  697   1HD2  ASN  27          2HD2      ASN  27   0.828  25.419 -11.465
  698   2HD2  ASN  27          1HD2      ASN  27   0.774  24.566 -13.001
  699    HA   PRO  28           HA       PRO  28  -5.187  21.511 -11.181
  700   1HB   PRO  28          1HB       PRO  28  -5.604  21.774 -13.881
  701   2HB   PRO  28          2HB       PRO  28  -6.190  22.953 -12.668
  702   1HG   PRO  28          1HG       PRO  28  -3.628  23.084 -14.296
  703   2HG   PRO  28          2HG       PRO  28  -4.877  24.359 -14.103
  704   1HD   PRO  28          1HD       PRO  28  -2.639  24.353 -12.594
  705   2HD   PRO  28          2HD       PRO  28  -4.218  24.782 -11.862
  706    H    GLU  29           H        GLU  29  -2.014  21.427 -12.574
  707    HA   GLU  29           HA       GLU  29  -2.213  18.912 -13.996
  708   1HB   GLU  29          1HB       GLU  29  -0.387  20.593 -14.285
  709   2HB   GLU  29          2HB       GLU  29   0.233  20.167 -12.691
  710   1HG   GLU  29          1HG       GLU  29   0.576  17.821 -13.457
  711   2HG   GLU  29          2HG       GLU  29  -0.060  18.253 -15.046
  712    H    LYS  30           H        LYS  30  -0.674  19.573 -10.902
  713    HA   LYS  30           HA       LYS  30  -0.698  16.835  -9.989
  714   1HB   LYS  30          1HB       LYS  30   0.895  18.576  -9.172
  715   2HB   LYS  30          2HB       LYS  30  -0.434  19.412  -8.401
  716   1HG   LYS  30          1HG       LYS  30   0.793  18.166  -6.705
  717   2HG   LYS  30          2HG       LYS  30  -0.800  17.476  -6.883
  718   1HD   LYS  30          1HD       LYS  30   0.450  15.584  -6.736
  719   2HD   LYS  30          2HD       LYS  30   0.434  15.724  -8.482
  720   1HE   LYS  30          1HE       LYS  30   2.655  16.660  -6.594
  721   2HE   LYS  30          2HE       LYS  30   2.652  15.145  -7.489
  722   1HZ   LYS  30          1HZ       LYS  30   3.974  16.782  -8.649
  723   2HZ   LYS  30          2HZ       LYS  30   2.662  16.463  -9.568
  724   3HZ   LYS  30          3HZ       LYS  30   2.757  17.854  -8.704
  725    H    LYS  31           H        LYS  31  -2.983  19.524  -9.475
  726    HA   LYS  31           HA       LYS  31  -4.716  18.101  -7.688
  727   1HB   LYS  31          1HB       LYS  31  -4.481  20.598  -8.053
  728   2HB   LYS  31          2HB       LYS  31  -5.564  20.404  -9.436
  729   1HG   LYS  31          1HG       LYS  31  -7.366  19.691  -8.020
  730   2HG   LYS  31          2HG       LYS  31  -6.279  19.426  -6.643
  731   1HD   LYS  31          1HD       LYS  31  -5.821  21.819  -6.481
  732   2HD   LYS  31          2HD       LYS  31  -6.840  22.161  -7.886
  733   1HE   LYS  31          1HE       LYS  31  -7.838  20.819  -5.331
  734   2HE   LYS  31          2HE       LYS  31  -7.864  22.568  -5.577
  735   1HZ   LYS  31          1HZ       LYS  31  -9.309  22.220  -7.504
  736   2HZ   LYS  31          2HZ       LYS  31  -9.303  20.598  -7.274
  737   3HZ   LYS  31          3HZ       LYS  31  -9.988  21.581  -6.168
  738    H    SER  32           H        SER  32  -4.172  17.325 -10.872
  739    HA   SER  32           HA       SER  32  -6.663  15.683 -10.870
  740   1HB   SER  32          1HB       SER  32  -6.415  17.559 -12.652
  741   2HB   SER  32          2HB       SER  32  -5.201  16.506 -13.398
  742    HG   SER  32           HG       SER  32  -7.338  16.185 -14.231
  743    H    VAL  33           H        VAL  33  -3.719  15.341  -9.938
  744    HA   VAL  33           HA       VAL  33  -3.448  12.521 -10.948
  745    HB   VAL  33           HB       VAL  33  -1.303  14.470 -10.031
  746   1HG1  VAL  33          1HG1      VAL  33  -0.748  12.301  -9.035
  747   2HG1  VAL  33          2HG1      VAL  33  -1.041  11.484 -10.589
  748   3HG1  VAL  33          3HG1      VAL  33   0.314  12.619 -10.402
  749   1HG2  VAL  33          1HG2      VAL  33  -1.645  12.894 -12.621
  750   2HG2  VAL  33          2HG2      VAL  33  -1.976  14.625 -12.426
  751   3HG2  VAL  33          3HG2      VAL  33  -0.326  14.024 -12.240
  752    H    LEU  34           H        LEU  34  -2.960  14.670  -7.998
  753    HA   LEU  34           HA       LEU  34  -3.044  12.353  -6.267
  754   1HB   LEU  34          1HB       LEU  34  -2.274  13.718  -4.735
  755   2HB   LEU  34          2HB       LEU  34  -1.847  14.749  -6.077
  756    HG   LEU  34           HG       LEU  34  -4.368  14.935  -4.463
  757   1HD1  LEU  34          1HD1      LEU  34  -2.176  15.497  -3.185
  758   2HD1  LEU  34          2HD1      LEU  34  -1.964  16.828  -4.312
  759   3HD1  LEU  34          3HD1      LEU  34  -3.379  16.791  -3.236
  760   1HD2  LEU  34          1HD2      LEU  34  -3.201  17.069  -6.254
  761   2HD2  LEU  34          2HD2      LEU  34  -4.589  16.042  -6.671
  762   3HD2  LEU  34          3HD2      LEU  34  -4.703  17.171  -5.316
  763    H    GLN  35           H        GLN  35  -5.472  14.282  -7.807
  764    HA   GLN  35           HA       GLN  35  -7.577  13.770  -5.909
  765   1HB   GLN  35          1HB       GLN  35  -7.613  15.665  -7.355
  766   2HB   GLN  35          2HB       GLN  35  -7.557  14.681  -8.811
  767   1HG   GLN  35          1HG       GLN  35  -9.858  14.411  -6.833
  768   2HG   GLN  35          2HG       GLN  35  -9.801  15.761  -7.957
  769   1HE2  GLN  35          2HE2      GLN  35 -11.995  14.477  -8.402
  770   2HE2  GLN  35          1HE2      GLN  35 -11.860  13.361  -9.753
  771    H    LYS  36           H        LYS  36  -6.367  11.992  -8.775
  772    HA   LYS  36           HA       LYS  36  -8.580  10.087  -8.727
  773   1HB   LYS  36          1HB       LYS  36  -5.806   9.803 -10.006
  774   2HB   LYS  36          2HB       LYS  36  -7.208   8.767 -10.294
  775   1HG   LYS  36          1HG       LYS  36  -8.444  10.878 -11.107
  776   2HG   LYS  36          2HG       LYS  36  -6.881  11.701 -11.040
  777   1HD   LYS  36          1HD       LYS  36  -7.159  11.029 -13.292
  778   2HD   LYS  36          2HD       LYS  36  -5.977   9.900 -12.609
  779   1HE   LYS  36          1HE       LYS  36  -7.813   8.230 -12.263
  780   2HE   LYS  36          2HE       LYS  36  -8.977   9.384 -12.921
  781   1HZ   LYS  36          1HZ       LYS  36  -7.758   9.295 -15.036
  782   2HZ   LYS  36          2HZ       LYS  36  -6.700   8.208 -14.426
  783   3HZ   LYS  36          3HZ       LYS  36  -8.270   7.806 -14.612
  784    H    ILE  37           H        ILE  37  -5.355  10.146  -7.281
  785    HA   ILE  37           HA       ILE  37  -5.610   7.577  -5.898
  786    HB   ILE  37           HB       ILE  37  -4.165  10.171  -5.184
  787   1HG1  ILE  37          1HG1      ILE  37  -3.004   7.652  -6.337
  788   2HG1  ILE  37          2HG1      ILE  37  -3.280   9.197  -7.166
  789   1HG2  ILE  37          1HG2      ILE  37  -4.480   9.115  -3.087
  790   2HG2  ILE  37          2HG2      ILE  37  -4.293   7.499  -3.775
  791   3HG2  ILE  37          3HG2      ILE  37  -2.888   8.529  -3.562
  792   1HD1  ILE  37          1HD1      ILE  37  -1.682  10.272  -5.515
  793   2HD1  ILE  37          2HD1      ILE  37  -1.231   8.616  -5.022
  794   3HD1  ILE  37          3HD1      ILE  37  -0.975   9.141  -6.685
  795    H    LEU  38           H        LEU  38  -6.398  10.986  -4.695
  796    HA   LEU  38           HA       LEU  38  -7.472   9.885  -2.377
  797   1HB   LEU  38          1HB       LEU  38  -7.949  11.908  -1.604
  798   2HB   LEU  38          2HB       LEU  38  -6.756  12.256  -2.830
  799    HG   LEU  38           HG       LEU  38  -8.889  12.555  -4.345
  800   1HD1  LEU  38          1HD1      LEU  38 -10.609  11.973  -2.642
  801   2HD1  LEU  38          2HD1      LEU  38  -9.990  13.247  -1.581
  802   3HD1  LEU  38          3HD1      LEU  38 -10.764  13.659  -3.126
  803   1HD2  LEU  38          1HD2      LEU  38  -7.210  14.333  -3.772
  804   2HD2  LEU  38          2HD2      LEU  38  -8.858  14.983  -3.831
  805   3HD2  LEU  38          3HD2      LEU  38  -8.085  14.648  -2.265
  806    H    GLU  39           H        GLU  39  -9.204  10.162  -5.466
  807    HA   GLU  39           HA       GLU  39 -11.750   9.445  -4.286
  808   1HB   GLU  39          1HB       GLU  39 -11.444  10.602  -6.480
  809   2HB   GLU  39          2HB       GLU  39 -10.768   9.111  -7.155
  810   1HG   GLU  39          1HG       GLU  39 -12.905   7.946  -6.771
  811   2HG   GLU  39          2HG       GLU  39 -13.557   9.359  -5.939
  812    H    ASP  40           H        ASP  40  -9.130   7.447  -5.722
  813    HA   ASP  40           HA       ASP  40 -10.342   4.841  -5.349
  814   1HB   ASP  40          1HB       ASP  40  -7.595   6.108  -5.697
  815   2HB   ASP  40          2HB       ASP  40  -7.619   4.573  -5.042
  816    H    GLU  41           H        GLU  41  -8.518   7.051  -3.322
  817    HA   GLU  41           HA       GLU  41  -7.928   5.125  -1.270
  818   1HB   GLU  41          1HB       GLU  41  -6.633   7.221  -2.095
  819   2HB   GLU  41          2HB       GLU  41  -7.738   8.153  -1.077
  820   1HG   GLU  41          1HG       GLU  41  -5.656   7.810  -0.004
  821   2HG   GLU  41          2HG       GLU  41  -6.892   6.820   0.835
  822    H    GLU  42           H        GLU  42 -10.341   7.748  -1.515
  823    HA   GLU  42           HA       GLU  42 -11.592   7.324   1.039
  824   1HB   GLU  42          1HB       GLU  42 -11.875   9.268  -0.512
  825   2HB   GLU  42          2HB       GLU  42 -12.847   8.274  -1.578
  826   1HG   GLU  42          1HG       GLU  42 -13.491   8.763   1.370
  827   2HG   GLU  42          2HG       GLU  42 -13.998   9.866   0.101
  828    H    LYS  43           H        LYS  43 -11.869   5.652  -2.074
  829    HA   LYS  43           HA       LYS  43 -14.119   4.006  -1.482
  830   1HB   LYS  43          1HB       LYS  43 -12.502   4.419  -3.680
  831   2HB   LYS  43          2HB       LYS  43 -11.935   2.850  -3.179
  832   1HG   LYS  43          1HG       LYS  43 -13.631   2.472  -4.765
  833   2HG   LYS  43          2HG       LYS  43 -14.378   2.078  -3.211
  834   1HD   LYS  43          1HD       LYS  43 -15.525   4.251  -3.167
  835   2HD   LYS  43          2HD       LYS  43 -14.694   4.774  -4.632
  836   1HE   LYS  43          1HE       LYS  43 -16.570   2.369  -4.487
  837   2HE   LYS  43          2HE       LYS  43 -17.095   4.000  -4.911
  838   1HZ   LYS  43          1HZ       LYS  43 -15.572   3.947  -6.808
  839   2HZ   LYS  43          2HZ       LYS  43 -15.098   2.423  -6.446
  840   3HZ   LYS  43          3HZ       LYS  43 -16.636   2.717  -6.900
  841    H    HIS  44           H        HIS  44 -10.612   3.480  -0.646
  842    HA   HIS  44           HA       HIS  44 -10.932   0.896   0.426
  843   1HB   HIS  44          1HB       HIS  44  -9.045   3.180   1.174
  844   2HB   HIS  44          2HB       HIS  44  -8.874   1.494   1.528
  845    HD2  HIS  44           2HD      HIS  44  -9.957   1.093  -1.795
  846    HE1  HIS  44           1HE      HIS  44  -5.888   2.119  -2.421
  847    HE2  HIS  44           2HE      HIS  44  -8.032   1.292  -3.527
  848    H    ILE  45           H        ILE  45 -11.246   4.149   1.911
  849    HA   ILE  45           HA       ILE  45 -11.694   3.221   4.602
  850    HB   ILE  45           HB       ILE  45 -12.021   5.790   3.073
  851   1HG1  ILE  45          1HG1      ILE  45 -10.809   6.687   5.057
  852   2HG1  ILE  45          2HG1      ILE  45 -10.808   5.080   5.782
  853   1HG2  ILE  45          1HG2      ILE  45 -14.175   5.787   4.175
  854   2HG2  ILE  45          2HG2      ILE  45 -13.419   5.342   5.727
  855   3HG2  ILE  45          3HG2      ILE  45 -13.102   6.925   4.983
  856   1HD1  ILE  45          1HD1      ILE  45  -9.367   4.252   3.946
  857   2HD1  ILE  45          2HD1      ILE  45  -9.458   5.849   3.158
  858   3HD1  ILE  45          3HD1      ILE  45  -8.649   5.671   4.721
  859    H    GLU  46           H        GLU  46 -13.987   3.814   1.889
  860    HA   GLU  46           HA       GLU  46 -16.360   3.114   3.276
  861   1HB   GLU  46          1HB       GLU  46 -15.471   3.240   0.454
  862   2HB   GLU  46          2HB       GLU  46 -16.714   2.029   0.727
  863   1HG   GLU  46          1HG       GLU  46 -16.946   4.927   1.609
  864   2HG   GLU  46          2HG       GLU  46 -17.516   4.314   0.057
  865    H    TRP  47           H        TRP  47 -14.028   0.889   1.681
  866    HA   TRP  47           HA       TRP  47 -15.536  -1.482   2.330
  867   1HB   TRP  47          1HB       TRP  47 -12.587  -1.216   1.666
  868   2HB   TRP  47          2HB       TRP  47 -13.599  -2.627   1.488
  869    HD1  TRP  47           1HD      TRP  47 -15.915  -0.611  -0.082
  870    HE1  TRP  47           1HE      TRP  47 -15.463  -0.097  -2.557
  871    HE3  TRP  47           3HE      TRP  47 -10.989  -1.947  -0.312
  872    HZ2  TRP  47           2HZ      TRP  47 -13.194  -0.127  -4.370
  873    HZ3  TRP  47           3HZ      TRP  47  -9.669  -1.660  -2.373
  874    HH2  TRP  47           2HH      TRP  47 -10.764  -0.695  -4.420
  875    H    LEU  48           H        LEU  48 -12.733   0.126   3.821
  876    HA   LEU  48           HA       LEU  48 -12.149  -1.703   5.912
  877   1HB   LEU  48          1HB       LEU  48 -11.857   1.272   5.434
  878   2HB   LEU  48          2HB       LEU  48 -11.410   0.660   6.984
  879    HG   LEU  48           HG       LEU  48 -10.264  -0.509   4.429
  880   1HD1  LEU  48          1HD1      LEU  48  -9.733   1.902   4.521
  881   2HD1  LEU  48          2HD1      LEU  48  -9.103   1.709   6.171
  882   3HD1  LEU  48          3HD1      LEU  48  -8.304   0.906   4.793
  883   1HD2  LEU  48          1HD2      LEU  48  -9.261  -0.494   7.318
  884   2HD2  LEU  48          2HD2      LEU  48  -9.981  -1.888   6.485
  885   3HD2  LEU  48          3HD2      LEU  48  -8.434  -1.234   5.933
  886    H    GLU  49           H        GLU  49 -14.426   1.053   5.893
  887    HA   GLU  49           HA       GLU  49 -15.490   0.591   8.526
  888   1HB   GLU  49          1HB       GLU  49 -15.880   2.446   6.490
  889   2HB   GLU  49          2HB       GLU  49 -17.404   1.612   6.476
  890   1HG   GLU  49          1HG       GLU  49 -16.128   2.808   8.980
  891   2HG   GLU  49          2HG       GLU  49 -17.255   3.677   7.946
  892    H    THR  50           H        THR  50 -16.142  -0.990   5.423
  893    HA   THR  50           HA       THR  50 -18.614  -2.258   6.379
  894    HB   THR  50           HB       THR  50 -16.908  -2.519   3.890
  895    HG1  THR  50           1HG      THR  50 -19.602  -1.740   4.344
  896   1HG2  THR  50          1HG2      THR  50 -17.755  -4.733   4.205
  897   2HG2  THR  50          2HG2      THR  50 -19.382  -4.106   4.585
  898   3HG2  THR  50          3HG2      THR  50 -18.691  -3.917   2.943
  899    H    ILE  51           H        ILE  51 -15.222  -3.038   6.332
  900    HA   ILE  51           HA       ILE  51 -15.653  -5.749   7.363
  901    HB   ILE  51           HB       ILE  51 -13.284  -4.143   6.425
  902   1HG1  ILE  51          1HG1      ILE  51 -12.789  -6.412   5.313
  903   2HG1  ILE  51          2HG1      ILE  51 -14.326  -6.982   5.960
  904   1HG2  ILE  51          1HG2      ILE  51 -12.414  -4.981   8.553
  905   2HG2  ILE  51          2HG2      ILE  51 -12.955  -6.634   8.139
  906   3HG2  ILE  51          3HG2      ILE  51 -11.682  -5.829   7.193
  907   1HD1  ILE  51          1HD1      ILE  51 -15.484  -5.215   4.612
  908   2HD1  ILE  51          2HD1      ILE  51 -13.889  -4.743   3.959
  909   3HD1  ILE  51          3HD1      ILE  51 -14.554  -6.356   3.641
  910    H    ASN  52           H        ASN  52 -15.163  -2.694   8.709
  911    HA   ASN  52           HA       ASN  52 -14.394  -3.592  11.383
  912   1HB   ASN  52          1HB       ASN  52 -13.658  -1.439  10.428
  913   2HB   ASN  52          2HB       ASN  52 -15.328  -0.869  10.398
  914   1HD2  ASN  52          2HD2      ASN  52 -13.690   0.754  11.680
  915   2HD2  ASN  52          1HD2      ASN  52 -13.828   0.566  13.422
  916    H    GLY  53           H        GLY  53 -15.945  -5.056  12.071
  917   1HA   GLY  53          1HA       GLY  53 -18.079  -4.002  13.651
  918   2HA   GLY  53          2HA       GLY  53 -18.765  -4.731  12.199
  Start of MODEL   19
    1   1H    MET   1          1H        MET   1  13.120  18.387   0.275
    2   2H    MET   1          2H        MET   1  12.641  16.884   0.695
    3   3H    MET   1          3H        MET   1  13.414  17.132  -0.738
    4    HA   MET   1           HA       MET   1  11.619  18.420  -1.598
    5   1HB   MET   1          1HB       MET   1  10.568  15.797  -0.449
    6   2HB   MET   1          2HB       MET   1   9.874  16.710  -1.792
    7   1HG   MET   1          1HG       MET   1  12.549  15.295  -1.786
    8   2HG   MET   1          2HG       MET   1  11.086  14.845  -2.658
    9   1HE   MET   1          1HE       MET   1  13.900  14.953  -4.006
   10   2HE   MET   1          2HE       MET   1  12.419  14.568  -4.914
   11   3HE   MET   1          3HE       MET   1  13.550  15.790  -5.535
   12    H    ASP   2           H        ASP   2   8.864  18.142  -0.925
   13    HA   ASP   2           HA       ASP   2   8.617  19.404   1.772
   14   1HB   ASP   2          1HB       ASP   2   8.949  21.110  -0.075
   15   2HB   ASP   2          2HB       ASP   2   7.398  20.612  -0.734
   16    H    TYR   3           H        TYR   3   6.635  18.251  -1.067
   17    HA   TYR   3           HA       TYR   3   4.889  16.817   0.840
   18   1HB   TYR   3          1HB       TYR   3   2.861  17.851  -0.025
   19   2HB   TYR   3          2HB       TYR   3   3.925  19.040   0.676
   20    HD1  TYR   3           1HD      TYR   3   5.096  20.711  -0.730
   21    HD2  TYR   3           2HD      TYR   3   2.255  17.945  -2.410
   22    HE1  TYR   3           1HE      TYR   3   4.967  22.101  -2.795
   23    HE2  TYR   3           2HE      TYR   3   2.146  19.316  -4.478
   24    HH   TYR   3           HH       TYR   3   2.904  21.181  -5.575
   25    H    LEU   4           H        LEU   4   6.647  15.491  -0.728
   26    HA   LEU   4           HA       LEU   4   4.657  13.801  -2.095
   27   1HB   LEU   4          1HB       LEU   4   5.849  13.377  -4.053
   28   2HB   LEU   4          2HB       LEU   4   5.651  15.104  -3.860
   29    HG   LEU   4           HG       LEU   4   8.111  14.790  -2.711
   30   1HD1  LEU   4          1HD1      LEU   4   8.219  12.356  -3.297
   31   2HD1  LEU   4          2HD1      LEU   4   7.945  12.770  -4.987
   32   3HD1  LEU   4          3HD1      LEU   4   9.442  13.288  -4.175
   33   1HD2  LEU   4          1HD2      LEU   4   7.572  15.148  -5.685
   34   2HD2  LEU   4          2HD2      LEU   4   7.555  16.429  -4.453
   35   3HD2  LEU   4          3HD2      LEU   4   9.070  15.595  -4.835
   36    H    ARG   5           H        ARG   5   8.112  13.699  -1.007
   37    HA   ARG   5           HA       ARG   5   8.128  10.869  -0.547
   38   1HB   ARG   5          1HB       ARG   5   9.712  13.141   0.733
   39   2HB   ARG   5          2HB       ARG   5   9.996  11.435   1.095
   40   1HG   ARG   5          1HG       ARG   5  10.541  10.955  -1.246
   41   2HG   ARG   5          2HG       ARG   5  10.138  12.609  -1.711
   42   1HD   ARG   5          1HD       ARG   5  12.524  12.416  -1.603
   43   2HD   ARG   5          2HD       ARG   5  11.966  13.477  -0.295
   44    HE   ARG   5           HE       ARG   5  12.195  10.800   0.693
   45   1HH1  ARG   5          1HH2      ARG   5  14.347  13.359  -0.364
   46   2HH1  ARG   5          2HH2      ARG   5  15.612  12.869   0.727
   47   1HH2  ARG   5          1HH1      ARG   5  13.880  10.213   2.037
   48   2HH2  ARG   5          2HH1      ARG   5  15.351  11.138   2.034
   49    H    GLU   6           H        GLU   6   6.990  13.498   1.482
   50    HA   GLU   6           HA       GLU   6   6.545  11.994   3.838
   51   1HB   GLU   6          1HB       GLU   6   6.501  14.576   3.488
   52   2HB   GLU   6          2HB       GLU   6   4.899  14.373   2.808
   53   1HG   GLU   6          1HG       GLU   6   4.552  15.021   5.046
   54   2HG   GLU   6          2HG       GLU   6   4.192  13.304   5.034
   55    H    LEU   7           H        LEU   7   4.439  12.569   1.040
   56    HA   LEU   7           HA       LEU   7   2.044  11.354   2.083
   57   1HB   LEU   7          1HB       LEU   7   2.914  11.567  -0.838
   58   2HB   LEU   7          2HB       LEU   7   1.281  11.346  -0.230
   59    HG   LEU   7           HG       LEU   7   3.019  13.830  -0.020
   60   1HD1  LEU   7          1HD1      LEU   7   1.933  13.415  -2.204
   61   2HD1  LEU   7          2HD1      LEU   7   0.352  13.292  -1.399
   62   3HD1  LEU   7          3HD1      LEU   7   1.242  14.830  -1.397
   63   1HD2  LEU   7          1HD2      LEU   7   0.216  13.425   1.086
   64   2HD2  LEU   7          2HD2      LEU   7   1.701  13.628   2.057
   65   3HD2  LEU   7          3HD2      LEU   7   1.135  14.952   1.042
   66    H    TYR   8           H        TYR   8   4.600  10.158  -0.021
   67    HA   TYR   8           HA       TYR   8   3.831   7.507  -0.538
   68   1HB   TYR   8          1HB       TYR   8   5.963   9.238  -1.057
   69   2HB   TYR   8          2HB       TYR   8   6.732   8.249   0.113
   70    HD1  TYR   8           1HD      TYR   8   7.861   8.693  -2.472
   71    HD2  TYR   8           2HD      TYR   8   5.074   5.639  -1.221
   72    HE1  TYR   8           1HE      TYR   8   8.745   7.164  -4.227
   73    HE2  TYR   8           2HE      TYR   8   5.992   4.123  -2.968
   74    HH   TYR   8           HH       TYR   8   7.481   3.829  -4.637
   75    H    LYS   9           H        LYS   9   5.671   8.713   2.273
   76    HA   LYS   9           HA       LYS   9   6.205   6.082   3.254
   77   1HB   LYS   9          1HB       LYS   9   6.362   8.881   4.459
   78   2HB   LYS   9          2HB       LYS   9   6.631   7.465   5.488
   79   1HG   LYS   9          1HG       LYS   9   8.387   6.647   3.936
   80   2HG   LYS   9          2HG       LYS   9   8.169   8.087   2.926
   81   1HD   LYS   9          1HD       LYS   9   8.873   9.532   4.796
   82   2HD   LYS   9          2HD       LYS   9   9.001   8.113   5.863
   83   1HE   LYS   9          1HE       LYS   9  10.708   7.137   4.313
   84   2HE   LYS   9          2HE       LYS   9  10.627   8.601   3.325
   85   1HZ   LYS   9          1HZ       LYS   9  11.408   9.864   5.266
   86   2HZ   LYS   9          2HZ       LYS   9  11.460   8.511   6.181
   87   3HZ   LYS   9          3HZ       LYS   9  12.475   8.675   4.919
   88    H    LEU  10           H        LEU  10   3.725   8.295   4.603
   89    HA   LEU  10           HA       LEU  10   2.505   6.274   6.086
   90   1HB   LEU  10          1HB       LEU  10   1.331   8.831   4.929
   91   2HB   LEU  10          2HB       LEU  10   0.496   7.750   6.045
   92    HG   LEU  10           HG       LEU  10   2.779   8.002   7.441
   93   1HD1  LEU  10          1HD1      LEU  10   4.033   9.483   6.076
   94   2HD1  LEU  10          2HD1      LEU  10   2.664  10.585   5.885
   95   3HD1  LEU  10          3HD1      LEU  10   3.475  10.417   7.455
   96   1HD2  LEU  10          1HD2      LEU  10   0.534  10.061   7.448
   97   2HD2  LEU  10          2HD2      LEU  10   0.523   8.490   8.281
   98   3HD2  LEU  10          3HD2      LEU  10   1.659   9.743   8.788
   99    H    GLU  11           H        GLU  11   1.988   7.119   2.646
  100    HA   GLU  11           HA       GLU  11  -0.032   5.208   2.047
  101   1HB   GLU  11          1HB       GLU  11   2.085   6.757   0.649
  102   2HB   GLU  11          2HB       GLU  11   1.729   5.354  -0.217
  103   1HG   GLU  11          1HG       GLU  11  -0.335   7.409   0.744
  104   2HG   GLU  11          2HG       GLU  11   0.441   7.427  -0.832
  105    H    GLN  12           H        GLN  12   3.587   4.664   2.240
  106    HA   GLN  12           HA       GLN  12   3.118   1.894   1.641
  107   1HB   GLN  12          1HB       GLN  12   5.551   3.556   2.283
  108   2HB   GLN  12          2HB       GLN  12   5.630   1.787   2.136
  109   1HG   GLN  12          1HG       GLN  12   4.551   1.905  -0.069
  110   2HG   GLN  12          2HG       GLN  12   4.560   3.655  -0.010
  111   1HE2  GLN  12          2HE2      GLN  12   6.097   1.388  -1.672
  112   2HE2  GLN  12          1HE2      GLN  12   7.740   2.006  -1.638
  113    H    GLN  13           H        GLN  13   3.387   3.620   4.637
  114    HA   GLN  13           HA       GLN  13   3.876   1.246   6.252
  115   1HB   GLN  13          1HB       GLN  13   2.692   3.989   6.871
  116   2HB   GLN  13          2HB       GLN  13   2.867   2.733   8.104
  117   1HG   GLN  13          1HG       GLN  13   5.268   2.631   7.792
  118   2HG   GLN  13          2HG       GLN  13   5.217   3.764   6.451
  119   1HE2  GLN  13          2HE2      GLN  13   6.288   3.727   9.484
  120   2HE2  GLN  13          1HE2      GLN  13   5.849   5.354   9.982
  121    H    ALA  14           H        ALA  14   0.855   2.695   4.956
  122    HA   ALA  14           HA       ALA  14  -0.837   0.703   6.307
  123   1HB   ALA  14          1HB       ALA  14  -1.736   2.875   5.522
  124   2HB   ALA  14          2HB       ALA  14  -1.290   2.477   3.847
  125   3HB   ALA  14          3HB       ALA  14  -2.528   1.522   4.690
  126    H    MET  15           H        MET  15   0.735   0.965   3.094
  127    HA   MET  15           HA       MET  15  -0.208  -1.527   2.001
  128   1HB   MET  15          1HB       MET  15   0.932   0.266   0.676
  129   2HB   MET  15          2HB       MET  15   2.384   0.005   1.630
  130   1HG   MET  15          1HG       MET  15   3.016  -0.954  -0.251
  131   2HG   MET  15          2HG       MET  15   2.471  -2.366   0.622
  132   1HE   MET  15          1HE       MET  15   0.517  -3.799   0.011
  133   2HE   MET  15          2HE       MET  15  -0.744  -2.540   0.097
  134   3HE   MET  15          3HE       MET  15  -0.576  -3.538  -1.363
  135    H    LYS  16           H        LYS  16   2.696  -0.908   4.054
  136    HA   LYS  16           HA       LYS  16   3.611  -3.636   4.011
  137   1HB   LYS  16          1HB       LYS  16   4.706  -1.341   4.789
  138   2HB   LYS  16          2HB       LYS  16   3.973  -1.738   6.335
  139   1HG   LYS  16          1HG       LYS  16   6.231  -2.542   6.427
  140   2HG   LYS  16          2HG       LYS  16   5.214  -3.964   6.247
  141   1HD   LYS  16          1HD       LYS  16   7.145  -4.241   4.826
  142   2HD   LYS  16          2HD       LYS  16   5.746  -4.011   3.796
  143   1HE   LYS  16          1HE       LYS  16   7.473  -2.738   2.810
  144   2HE   LYS  16          2HE       LYS  16   6.400  -1.560   3.569
  145   1HZ   LYS  16          1HZ       LYS  16   7.994  -1.462   5.437
  146   2HZ   LYS  16          2HZ       LYS  16   8.967  -2.556   4.704
  147   3HZ   LYS  16          3HZ       LYS  16   8.741  -1.089   4.033
  148    H    LEU  17           H        LEU  17   1.490  -1.826   6.220
  149    HA   LEU  17           HA       LEU  17   0.905  -3.958   8.021
  150   1HB   LEU  17          1HB       LEU  17  -0.191  -1.286   7.271
  151   2HB   LEU  17          2HB       LEU  17  -1.364  -2.332   7.947
  152    HG   LEU  17           HG       LEU  17   1.320  -1.643   9.238
  153   1HD1  LEU  17          1HD1      LEU  17  -0.236   0.261   9.079
  154   2HD1  LEU  17          2HD1      LEU  17  -1.497  -0.685   9.903
  155   3HD1  LEU  17          3HD1      LEU  17   0.002  -0.255  10.759
  156   1HD2  LEU  17          1HD2      LEU  17  -1.078  -3.139  10.397
  157   2HD2  LEU  17          2HD2      LEU  17   0.537  -3.814  10.106
  158   3HD2  LEU  17          3HD2      LEU  17   0.321  -2.565  11.327
  159    H    TYR  18           H        TYR  18  -0.898  -2.927   5.059
  160    HA   TYR  18           HA       TYR  18  -2.600  -5.098   4.812
  161   1HB   TYR  18          1HB       TYR  18  -1.290  -3.162   2.947
  162   2HB   TYR  18          2HB       TYR  18  -2.040  -4.521   2.201
  163    HD1  TYR  18           1HD      TYR  18  -4.480  -5.112   3.322
  164    HD2  TYR  18           2HD      TYR  18  -2.625  -1.234   3.145
  165    HE1  TYR  18           1HE      TYR  18  -6.652  -4.043   3.937
  166    HE2  TYR  18           2HE      TYR  18  -4.767  -0.172   3.773
  167    HH   TYR  18           HH       TYR  18  -6.937  -0.502   4.381
  168    H    ARG  19           H        ARG  19   0.837  -5.112   3.670
  169    HA   ARG  19           HA       ARG  19   0.737  -7.793   2.633
  170   1HB   ARG  19          1HB       ARG  19   3.034  -6.074   3.647
  171   2HB   ARG  19          2HB       ARG  19   3.269  -7.720   3.058
  172   1HG   ARG  19          1HG       ARG  19   2.277  -7.122   0.871
  173   2HG   ARG  19          2HG       ARG  19   2.007  -5.473   1.434
  174   1HD   ARG  19          1HD       ARG  19   3.991  -5.510   0.074
  175   2HD   ARG  19          2HD       ARG  19   4.458  -5.183   1.752
  176    HE   ARG  19           HE       ARG  19   4.611  -7.998   1.290
  177   1HH1  ARG  19          1HH2      ARG  19   6.345  -5.147   0.222
  178   2HH1  ARG  19          2HH2      ARG  19   7.837  -6.025   0.014
  179   1HH2  ARG  19          1HH1      ARG  19   6.545  -9.050   1.012
  180   2HH2  ARG  19          2HH1      ARG  19   7.936  -8.176   0.445
  181    H    GLU  20           H        GLU  20   1.208  -6.732   5.987
  182    HA   GLU  20           HA       GLU  20   1.808  -9.490   6.874
  183   1HB   GLU  20          1HB       GLU  20   2.465  -6.934   7.739
  184   2HB   GLU  20          2HB       GLU  20   1.197  -7.362   8.859
  185   1HG   GLU  20          1HG       GLU  20   3.726  -8.980   8.266
  186   2HG   GLU  20          2HG       GLU  20   3.529  -7.889   9.630
  187    H    ALA  21           H        ALA  21  -0.871  -7.193   7.151
  188    HA   ALA  21           HA       ALA  21  -2.763  -8.853   8.459
  189   1HB   ALA  21          1HB       ALA  21  -3.102  -6.452   8.021
  190   2HB   ALA  21          2HB       ALA  21  -3.198  -6.776   6.274
  191   3HB   ALA  21          3HB       ALA  21  -4.438  -7.417   7.368
  192    H    SER  22           H        SER  22  -1.719  -8.826   5.025
  193    HA   SER  22           HA       SER  22  -3.546 -10.705   3.984
  194   1HB   SER  22          1HB       SER  22  -1.910  -9.336   2.693
  195   2HB   SER  22          2HB       SER  22  -0.616 -10.417   3.250
  196    HG   SER  22           HG       SER  22  -1.406 -11.028   1.206
  197    H    GLU  23           H        GLU  23  -0.519 -11.405   5.853
  198    HA   GLU  23           HA       GLU  23  -0.783 -14.309   5.552
  199   1HB   GLU  23          1HB       GLU  23   1.301 -12.964   6.163
  200   2HB   GLU  23          2HB       GLU  23   0.639 -12.828   7.780
  201   1HG   GLU  23          1HG       GLU  23   1.192 -15.444   6.309
  202   2HG   GLU  23          2HG       GLU  23   2.306 -14.687   7.435
  203    H    LYS  24           H        LYS  24  -1.555 -11.927   8.107
  204    HA   LYS  24           HA       LYS  24  -2.743 -13.651   9.990
  205   1HB   LYS  24          1HB       LYS  24  -2.385 -10.806   9.581
  206   2HB   LYS  24          2HB       LYS  24  -4.039 -11.066  10.070
  207   1HG   LYS  24          1HG       LYS  24  -1.565 -12.003  11.584
  208   2HG   LYS  24          2HG       LYS  24  -2.542 -10.583  11.940
  209   1HD   LYS  24          1HD       LYS  24  -3.651 -11.866  13.373
  210   2HD   LYS  24          2HD       LYS  24  -4.487 -12.527  11.961
  211   1HE   LYS  24          1HE       LYS  24  -2.790 -14.369  11.860
  212   2HE   LYS  24          2HE       LYS  24  -1.962 -13.672  13.255
  213   1HZ   LYS  24          1HZ       LYS  24  -3.963 -14.081  14.574
  214   2HZ   LYS  24          2HZ       LYS  24  -4.749 -14.707  13.281
  215   3HZ   LYS  24          3HZ       LYS  24  -3.452 -15.476  13.906
  216    H    ALA  25           H        ALA  25  -4.263 -12.107   7.235
  217    HA   ALA  25           HA       ALA  25  -6.963 -13.013   7.899
  218   1HB   ALA  25          1HB       ALA  25  -6.435 -10.704   7.055
  219   2HB   ALA  25          2HB       ALA  25  -5.895 -11.424   5.518
  220   3HB   ALA  25          3HB       ALA  25  -7.584 -11.583   6.026
  221    H    ARG  26           H        ARG  26  -4.833 -15.035   6.990
  222    HA   ARG  26           HA       ARG  26  -5.182 -15.944   4.429
  223   1HB   ARG  26          1HB       ARG  26  -4.243 -17.998   5.078
  224   2HB   ARG  26          2HB       ARG  26  -3.497 -16.748   6.033
  225   1HG   ARG  26          1HG       ARG  26  -5.683 -18.643   7.030
  226   2HG   ARG  26          2HG       ARG  26  -3.951 -18.853   7.268
  227   1HD   ARG  26          1HD       ARG  26  -3.924 -16.635   8.511
  228   2HD   ARG  26          2HD       ARG  26  -5.687 -16.642   8.425
  229    HE   ARG  26           HE       ARG  26  -5.801 -18.406   9.953
  230   1HH1  ARG  26          1HH2      ARG  26  -2.408 -17.758   9.286
  231   2HH1  ARG  26          2HH2      ARG  26  -1.881 -18.717  10.639
  232   1HH2  ARG  26          1HH1      ARG  26  -5.043 -19.603  11.652
  233   2HH2  ARG  26          2HH1      ARG  26  -3.334 -19.727  11.940
  234    H    ASN  27           H        ASN  27  -7.786 -16.130   6.660
  235    HA   ASN  27           HA       ASN  27  -9.341 -18.194   5.383
  236   1HB   ASN  27          1HB       ASN  27  -9.864 -17.271   7.617
  237   2HB   ASN  27          2HB       ASN  27 -10.215 -15.697   6.898
  238   1HD2  ASN  27          2HD2      ASN  27 -11.541 -18.780   7.701
  239   2HD2  ASN  27          1HD2      ASN  27 -13.074 -18.548   6.876
  240    HA   PRO  28           HA       PRO  28  -9.099 -16.238   1.571
  241   1HB   PRO  28          1HB       PRO  28 -10.804 -17.656  -0.035
  242   2HB   PRO  28          2HB       PRO  28  -9.321 -18.341   0.697
  243   1HG   PRO  28          1HG       PRO  28 -12.161 -18.495   1.770
  244   2HG   PRO  28          2HG       PRO  28 -11.007 -19.847   1.512
  245   1HD   PRO  28          1HD       PRO  28 -11.292 -18.700   3.941
  246   2HD   PRO  28          2HD       PRO  28  -9.660 -19.155   3.342
  247    H    GLU  29           H        GLU  29 -12.153 -15.922   3.102
  248    HA   GLU  29           HA       GLU  29 -13.597 -14.445   1.077
  249   1HB   GLU  29          1HB       GLU  29 -14.620 -15.705   2.998
  250   2HB   GLU  29          2HB       GLU  29 -13.968 -14.501   4.098
  251   1HG   GLU  29          1HG       GLU  29 -16.235 -13.924   3.754
  252   2HG   GLU  29          2HG       GLU  29 -15.310 -12.740   2.842
  253    H    LYS  30           H        LYS  30 -12.469 -13.222   4.180
  254    HA   LYS  30           HA       LYS  30 -11.949 -10.480   3.491
  255   1HB   LYS  30          1HB       LYS  30 -12.047 -11.797   5.776
  256   2HB   LYS  30          2HB       LYS  30 -10.349 -12.137   5.491
  257   1HG   LYS  30          1HG       LYS  30 -11.663  -9.400   5.847
  258   2HG   LYS  30          2HG       LYS  30 -10.683 -10.285   7.013
  259   1HD   LYS  30          1HD       LYS  30  -8.906 -10.152   4.957
  260   2HD   LYS  30          2HD       LYS  30  -9.820  -8.675   4.633
  261   1HE   LYS  30          1HE       LYS  30  -8.663  -9.485   7.328
  262   2HE   LYS  30          2HE       LYS  30  -7.764  -8.531   6.135
  263   1HZ   LYS  30          1HZ       LYS  30  -9.496  -6.810   6.306
  264   2HZ   LYS  30          2HZ       LYS  30 -10.312  -7.692   7.425
  265   3HZ   LYS  30          3HZ       LYS  30  -8.839  -7.088   7.775
  266    H    LYS  31           H        LYS  31  -9.785 -13.309   3.164
  267    HA   LYS  31           HA       LYS  31  -7.534 -11.867   2.256
  268   1HB   LYS  31          1HB       LYS  31  -8.055 -14.526   2.647
  269   2HB   LYS  31          2HB       LYS  31  -7.928 -14.472   0.896
  270   1HG   LYS  31          1HG       LYS  31  -5.842 -13.629   2.959
  271   2HG   LYS  31          2HG       LYS  31  -5.829 -15.079   1.949
  272   1HD   LYS  31          1HD       LYS  31  -5.773 -13.512  -0.075
  273   2HD   LYS  31          2HD       LYS  31  -5.541 -12.192   1.083
  274   1HE   LYS  31          1HE       LYS  31  -3.375 -12.712   0.325
  275   2HE   LYS  31          2HE       LYS  31  -3.490 -13.356   1.959
  276   1HZ   LYS  31          1HZ       LYS  31  -3.850 -15.572   0.970
  277   2HZ   LYS  31          2HZ       LYS  31  -3.766 -14.951  -0.543
  278   3HZ   LYS  31          3HZ       LYS  31  -2.454 -14.932   0.423
  279    H    SER  32           H        SER  32 -10.412 -12.615   0.454
  280    HA   SER  32           HA       SER  32  -9.249 -11.499  -2.041
  281   1HB   SER  32          1HB       SER  32 -12.024 -12.674  -1.568
  282   2HB   SER  32          2HB       SER  32 -11.295 -12.272  -3.133
  283    HG   SER  32           HG       SER  32 -10.591 -14.317  -1.302
  284    H    VAL  33           H        VAL  33 -10.509 -10.107   0.583
  285    HA   VAL  33           HA       VAL  33 -11.809  -7.861  -0.933
  286    HB   VAL  33           HB       VAL  33 -11.857  -8.501   2.043
  287   1HG1  VAL  33          1HG1      VAL  33 -11.828  -6.065   1.780
  288   2HG1  VAL  33          2HG1      VAL  33 -13.071  -6.158   0.511
  289   3HG1  VAL  33          3HG1      VAL  33 -13.457  -6.587   2.189
  290   1HG2  VAL  33          1HG2      VAL  33 -14.086  -8.431  -0.041
  291   2HG2  VAL  33          2HG2      VAL  33 -13.381  -9.901   0.652
  292   3HG2  VAL  33          3HG2      VAL  33 -14.273  -8.788   1.692
  293    H    LEU  34           H        LEU  34  -9.268  -8.443   1.668
  294    HA   LEU  34           HA       LEU  34  -8.322  -5.730   1.327
  295   1HB   LEU  34          1HB       LEU  34  -6.898  -6.085   2.964
  296   2HB   LEU  34          2HB       LEU  34  -8.060  -7.336   3.370
  297    HG   LEU  34           HG       LEU  34  -5.548  -7.717   1.783
  298   1HD1  LEU  34          1HD1      LEU  34  -5.142  -7.013   4.215
  299   2HD1  LEU  34          2HD1      LEU  34  -5.951  -8.507   4.706
  300   3HD1  LEU  34          3HD1      LEU  34  -4.448  -8.569   3.762
  301   1HD2  LEU  34          1HD2      LEU  34  -7.266  -9.794   3.161
  302   2HD2  LEU  34          2HD2      LEU  34  -7.147  -9.526   1.407
  303   3HD2  LEU  34          3HD2      LEU  34  -5.739 -10.112   2.304
  304    H    GLN  35           H        GLN  35  -7.808  -8.546  -0.634
  305    HA   GLN  35           HA       GLN  35  -5.385  -7.866  -1.896
  306   1HB   GLN  35          1HB       GLN  35  -6.575  -9.999  -2.153
  307   2HB   GLN  35          2HB       GLN  35  -7.868  -9.190  -3.054
  308   1HG   GLN  35          1HG       GLN  35  -6.243  -8.614  -4.851
  309   2HG   GLN  35          2HG       GLN  35  -4.938  -9.329  -3.901
  310   1HE2  GLN  35          2HE2      GLN  35  -4.587 -10.656  -5.904
  311   2HE2  GLN  35          1HE2      GLN  35  -5.593 -12.082  -6.121
  312    H    LYS  36           H        LYS  36  -8.679  -6.586  -2.563
  313    HA   LYS  36           HA       LYS  36  -7.897  -5.199  -4.986
  314   1HB   LYS  36          1HB       LYS  36 -10.210  -4.766  -3.013
  315   2HB   LYS  36          2HB       LYS  36 -10.078  -3.911  -4.537
  316   1HG   LYS  36          1HG       LYS  36  -9.865  -6.834  -4.935
  317   2HG   LYS  36          2HG       LYS  36 -11.325  -6.395  -4.056
  318   1HD   LYS  36          1HD       LYS  36 -11.800  -6.467  -6.426
  319   2HD   LYS  36          2HD       LYS  36 -11.958  -4.805  -5.840
  320   1HE   LYS  36          1HE       LYS  36  -9.672  -4.294  -6.717
  321   2HE   LYS  36          2HE       LYS  36  -9.532  -5.960  -7.299
  322   1HZ   LYS  36          1HZ       LYS  36 -11.436  -5.535  -8.764
  323   2HZ   LYS  36          2HZ       LYS  36 -11.569  -3.998  -8.222
  324   3HZ   LYS  36          3HZ       LYS  36 -10.251  -4.456  -9.067
  325    H    ILE  37           H        ILE  37  -8.009  -4.158  -1.612
  326    HA   ILE  37           HA       ILE  37  -7.157  -1.407  -2.118
  327    HB   ILE  37           HB       ILE  37  -6.868  -3.258   0.286
  328   1HG1  ILE  37          1HG1      ILE  37  -8.910  -1.118  -0.225
  329   2HG1  ILE  37          2HG1      ILE  37  -9.134  -2.878  -0.207
  330   1HG2  ILE  37          1HG2      ILE  37  -5.150  -1.626   0.583
  331   2HG2  ILE  37          2HG2      ILE  37  -6.170  -0.326  -0.059
  332   3HG2  ILE  37          3HG2      ILE  37  -6.484  -0.998   1.539
  333   1HD1  ILE  37          1HD1      ILE  37  -8.492  -2.875   2.225
  334   2HD1  ILE  37          2HD1      ILE  37  -8.601  -1.092   2.171
  335   3HD1  ILE  37          3HD1      ILE  37 -10.023  -2.073   1.827
  336    H    LEU  38           H        LEU  38  -5.313  -4.466  -1.356
  337    HA   LEU  38           HA       LEU  38  -2.810  -3.160  -1.477
  338   1HB   LEU  38          1HB       LEU  38  -2.047  -5.058  -0.729
  339   2HB   LEU  38          2HB       LEU  38  -3.680  -5.642  -0.781
  340    HG   LEU  38           HG       LEU  38  -3.186  -6.322  -3.184
  341   1HD1  LEU  38          1HD1      LEU  38  -0.962  -5.253  -3.544
  342   2HD1  LEU  38          2HD1      LEU  38  -0.309  -6.139  -2.161
  343   3HD1  LEU  38          3HD1      LEU  38  -0.814  -7.000  -3.630
  344   1HD2  LEU  38          1HD2      LEU  38  -3.395  -7.888  -1.191
  345   2HD2  LEU  38          2HD2      LEU  38  -2.290  -8.496  -2.433
  346   3HD2  LEU  38          3HD2      LEU  38  -1.654  -7.748  -0.951
  347    H    GLU  39           H        GLU  39  -4.727  -4.505  -4.205
  348    HA   GLU  39           HA       GLU  39  -2.593  -3.954  -6.070
  349   1HB   GLU  39          1HB       GLU  39  -4.548  -5.615  -6.249
  350   2HB   GLU  39          2HB       GLU  39  -5.563  -4.263  -6.717
  351   1HG   GLU  39          1HG       GLU  39  -2.985  -5.063  -8.154
  352   2HG   GLU  39          2HG       GLU  39  -4.544  -5.775  -8.538
  353    H    ASP  40           H        ASP  40  -5.381  -2.007  -5.018
  354    HA   ASP  40           HA       ASP  40  -4.937   0.276  -6.733
  355   1HB   ASP  40          1HB       ASP  40  -6.299  -0.434  -4.110
  356   2HB   ASP  40          2HB       ASP  40  -6.045   1.207  -4.442
  357    H    GLU  41           H        GLU  41  -3.523  -0.732  -3.575
  358    HA   GLU  41           HA       GLU  41  -2.229   1.869  -3.208
  359   1HB   GLU  41          1HB       GLU  41  -1.618  -0.790  -1.861
  360   2HB   GLU  41          2HB       GLU  41  -0.843   0.735  -1.477
  361   1HG   GLU  41          1HG       GLU  41  -3.652  -0.138  -0.768
  362   2HG   GLU  41          2HG       GLU  41  -2.353   0.317   0.278
  363    H    GLU  42           H        GLU  42  -1.194  -1.250  -4.610
  364    HA   GLU  42           HA       GLU  42   1.475  -0.494  -5.204
  365   1HB   GLU  42          1HB       GLU  42   0.511  -2.780  -5.418
  366   2HB   GLU  42          2HB       GLU  42  -0.346  -2.264  -6.879
  367   1HG   GLU  42          1HG       GLU  42   1.797  -1.781  -7.994
  368   2HG   GLU  42          2HG       GLU  42   2.679  -2.147  -6.510
  369    H    LYS  43           H        LYS  43  -1.510   0.250  -7.028
  370    HA   LYS  43           HA       LYS  43  -0.171   1.543  -9.239
  371   1HB   LYS  43          1HB       LYS  43  -2.713   0.752  -8.889
  372   2HB   LYS  43          2HB       LYS  43  -2.935   2.420  -8.400
  373   1HG   LYS  43          1HG       LYS  43  -3.463   2.358 -10.670
  374   2HG   LYS  43          2HG       LYS  43  -1.821   3.016 -10.654
  375   1HD   LYS  43          1HD       LYS  43  -0.886   0.841 -11.269
  376   2HD   LYS  43          2HD       LYS  43  -2.466   0.067 -11.139
  377   1HE   LYS  43          1HE       LYS  43  -1.811   2.300 -13.114
  378   2HE   LYS  43          2HE       LYS  43  -1.662   0.582 -13.486
  379   1HZ   LYS  43          1HZ       LYS  43  -4.040   0.326 -13.048
  380   2HZ   LYS  43          2HZ       LYS  43  -4.204   1.921 -12.726
  381   3HZ   LYS  43          3HZ       LYS  43  -3.797   1.426 -14.226
  382    H    HIS  44           H        HIS  44  -1.514   2.918  -6.130
  383    HA   HIS  44           HA       HIS  44  -0.828   5.591  -6.613
  384   1HB   HIS  44          1HB       HIS  44  -0.815   3.990  -4.012
  385   2HB   HIS  44          2HB       HIS  44  -0.934   5.706  -4.239
  386    HD2  HIS  44           2HD      HIS  44  -3.259   4.882  -6.735
  387    HE1  HIS  44           1HE      HIS  44  -5.627   4.424  -3.237
  388    HE2  HIS  44           2HE      HIS  44  -5.667   4.550  -5.786
  389    H    ILE  45           H        ILE  45   1.076   2.915  -5.175
  390    HA   ILE  45           HA       ILE  45   3.377   4.436  -4.462
  391    HB   ILE  45           HB       ILE  45   2.652   1.551  -4.763
  392   1HG1  ILE  45          1HG1      ILE  45   3.799   1.430  -2.529
  393   2HG1  ILE  45          2HG1      ILE  45   4.157   3.144  -2.651
  394   1HG2  ILE  45          1HG2      ILE  45   4.736   1.459  -5.998
  395   2HG2  ILE  45          2HG2      ILE  45   5.572   2.387  -4.728
  396   3HG2  ILE  45          3HG2      ILE  45   4.954   0.751  -4.406
  397   1HD1  ILE  45          1HD1      ILE  45   1.655   3.582  -2.656
  398   2HD1  ILE  45          2HD1      ILE  45   1.459   1.843  -2.282
  399   3HD1  ILE  45          3HD1      ILE  45   2.329   2.895  -1.170
  400    H    GLU  46           H        GLU  46   2.653   2.744  -7.582
  401    HA   GLU  46           HA       GLU  46   5.077   3.442  -8.911
  402   1HB   GLU  46          1HB       GLU  46   2.226   2.940  -9.851
  403   2HB   GLU  46          2HB       GLU  46   3.517   3.306 -10.971
  404   1HG   GLU  46          1HG       GLU  46   3.655   0.975  -9.030
  405   2HG   GLU  46          2HG       GLU  46   2.940   0.863 -10.638
  406    H    TRP  47           H        TRP  47   2.041   5.286  -8.533
  407    HA   TRP  47           HA       TRP  47   2.801   7.422 -10.319
  408   1HB   TRP  47          1HB       TRP  47   0.703   7.271  -8.140
  409   2HB   TRP  47          2HB       TRP  47   0.825   8.500  -9.364
  410    HD1  TRP  47           1HD      TRP  47   1.303   5.725 -11.547
  411    HE1  TRP  47           1HE      TRP  47  -0.869   4.660 -12.370
  412    HE3  TRP  47           3HE      TRP  47  -1.837   7.770  -8.138
  413    HZ2  TRP  47           2HZ      TRP  47  -3.755   4.865 -11.670
  414    HZ3  TRP  47           3HZ      TRP  47  -4.276   7.368  -8.149
  415    HH2  TRP  47           2HH      TRP  47  -5.252   5.883  -9.945
  416    H    LEU  48           H        LEU  48   2.989   6.914  -6.785
  417    HA   LEU  48           HA       LEU  48   3.837   9.497  -6.031
  418   1HB   LEU  48          1HB       LEU  48   3.561   6.867  -4.860
  419   2HB   LEU  48          2HB       LEU  48   5.196   7.349  -4.551
  420    HG   LEU  48           HG       LEU  48   3.908   7.947  -2.746
  421   1HD1  LEU  48          1HD1      LEU  48   5.582   9.689  -3.434
  422   2HD1  LEU  48          2HD1      LEU  48   4.275  10.593  -4.224
  423   3HD1  LEU  48          3HD1      LEU  48   4.229  10.325  -2.481
  424   1HD2  LEU  48          1HD2      LEU  48   2.027   9.505  -4.545
  425   2HD2  LEU  48          2HD2      LEU  48   1.681   7.964  -3.729
  426   3HD2  LEU  48          3HD2      LEU  48   1.973   9.430  -2.772
  427    H    GLU  49           H        GLU  49   5.787   6.660  -6.906
  428    HA   GLU  49           HA       GLU  49   8.341   8.010  -6.942
  429   1HB   GLU  49          1HB       GLU  49   7.385   5.394  -7.390
  430   2HB   GLU  49          2HB       GLU  49   8.063   5.836  -8.933
  431   1HG   GLU  49          1HG       GLU  49   9.523   5.989  -6.257
  432   2HG   GLU  49          2HG       GLU  49   9.695   4.696  -7.437
  433    H    THR  50           H        THR  50   5.711   8.021  -9.166
  434    HA   THR  50           HA       THR  50   7.267   9.042 -11.454
  435    HB   THR  50           HB       THR  50   4.288   8.708 -10.997
  436    HG1  THR  50           1HG      THR  50   5.335   6.774 -11.235
  437   1HG2  THR  50          1HG2      THR  50   4.517  10.450 -12.579
  438   2HG2  THR  50          2HG2      THR  50   5.782   9.541 -13.465
  439   3HG2  THR  50          3HG2      THR  50   4.089   8.950 -13.423
  440    H    ILE  51           H        ILE  51   5.341  10.381  -8.869
  441    HA   ILE  51           HA       ILE  51   5.607  13.144  -9.783
  442    HB   ILE  51           HB       ILE  51   4.506  11.825  -7.286
  443   1HG1  ILE  51          1HG1      ILE  51   3.102  11.677  -9.311
  444   2HG1  ILE  51          2HG1      ILE  51   2.348  12.604  -8.032
  445   1HG2  ILE  51          1HG2      ILE  51   5.376  13.882  -6.416
  446   2HG2  ILE  51          2HG2      ILE  51   4.699  14.822  -7.759
  447   3HG2  ILE  51          3HG2      ILE  51   3.628  14.053  -6.565
  448   1HD1  ILE  51          1HD1      ILE  51   2.915  14.717  -9.236
  449   2HD1  ILE  51          2HD1      ILE  51   3.651  13.757 -10.541
  450   3HD1  ILE  51          3HD1      ILE  51   1.922  13.622 -10.204
  451    H    ASN  52           H        ASN  52   7.476  11.039  -7.931
  452    HA   ASN  52           HA       ASN  52   9.306  12.988  -6.762
  453   1HB   ASN  52          1HB       ASN  52   9.000  10.631  -5.932
  454   2HB   ASN  52          2HB       ASN  52   9.720  10.049  -7.431
  455   1HD2  ASN  52          2HD2      ASN  52  11.570   9.089  -6.614
  456   2HD2  ASN  52          1HD2      ASN  52  12.801  10.017  -5.747
  457    H    GLY  53           H        GLY  53  11.576  13.224  -7.388
  458   1HA   GLY  53          1HA       GLY  53  12.651  12.638  -9.960
  459   2HA   GLY  53          2HA       GLY  53  11.924  14.242 -10.029
  460   1H    MET   1          1H        MET   1  -6.618 -10.655  19.092
  461   2H    MET   1          2H        MET   1  -7.817 -11.273  18.167
  462   3H    MET   1          3H        MET   1  -6.438 -12.134  18.407
  463    HA   MET   1           HA       MET   1  -5.141 -10.475  17.268
  464   1HB   MET   1          1HB       MET   1  -5.717 -10.984  15.020
  465   2HB   MET   1          2HB       MET   1  -5.986 -12.418  15.995
  466   1HG   MET   1          1HG       MET   1  -8.462 -11.856  16.005
  467   2HG   MET   1          2HG       MET   1  -8.100 -10.540  14.880
  468   1HE   MET   1          1HE       MET   1 -10.306 -12.518  14.118
  469   2HE   MET   1          2HE       MET   1  -9.693 -11.268  13.010
  470   3HE   MET   1          3HE       MET   1  -9.872 -12.943  12.446
  471    H    ASP   2           H        ASP   2  -4.888  -8.425  16.597
  472    HA   ASP   2           HA       ASP   2  -7.176  -6.562  17.117
  473   1HB   ASP   2          1HB       ASP   2  -4.475  -6.748  18.520
  474   2HB   ASP   2          2HB       ASP   2  -5.635  -5.440  18.739
  475    H    TYR   3           H        TYR   3  -6.519  -6.771  14.578
  476    HA   TYR   3           HA       TYR   3  -4.630  -4.563  13.951
  477   1HB   TYR   3          1HB       TYR   3  -3.481  -5.883  12.354
  478   2HB   TYR   3          2HB       TYR   3  -3.551  -6.835  13.817
  479    HD1  TYR   3           1HD      TYR   3  -5.495  -8.665  13.935
  480    HD2  TYR   3           2HD      TYR   3  -4.093  -6.843  10.283
  481    HE1  TYR   3           1HE      TYR   3  -6.516 -10.507  12.607
  482    HE2  TYR   3           2HE      TYR   3  -5.103  -8.691   8.972
  483    HH   TYR   3           HH       TYR   3  -6.358 -10.603   9.041
  484    H    LEU   4           H        LEU   4  -7.196  -3.892  13.969
  485    HA   LEU   4           HA       LEU   4  -7.738  -3.490  11.079
  486   1HB   LEU   4          1HB       LEU   4 -10.090  -3.711  11.324
  487   2HB   LEU   4          2HB       LEU   4  -9.249  -5.153  11.852
  488    HG   LEU   4           HG       LEU   4  -9.474  -3.898  14.252
  489   1HD1  LEU   4          1HD1      LEU   4 -11.716  -2.922  14.475
  490   2HD1  LEU   4          2HD1      LEU   4 -10.793  -1.986  13.294
  491   3HD1  LEU   4          3HD1      LEU   4 -12.013  -3.141  12.740
  492   1HD2  LEU   4          1HD2      LEU   4 -11.630  -5.599  12.935
  493   2HD2  LEU   4          2HD2      LEU   4 -10.178  -6.199  13.771
  494   3HD2  LEU   4          3HD2      LEU   4 -11.430  -5.342  14.685
  495    H    ARG   5           H        ARG   5  -8.248  -2.006  14.285
  496    HA   ARG   5           HA       ARG   5  -8.918   0.596  13.247
  497   1HB   ARG   5          1HB       ARG   5  -9.038  -0.574  15.671
  498   2HB   ARG   5          2HB       ARG   5  -7.510   0.280  15.900
  499   1HG   ARG   5          1HG       ARG   5  -8.642   2.425  15.374
  500   2HG   ARG   5          2HG       ARG   5 -10.135   1.545  14.979
  501   1HD   ARG   5          1HD       ARG   5 -10.082   0.604  17.340
  502   2HD   ARG   5          2HD       ARG   5  -8.807   1.779  17.709
  503    HE   ARG   5           HE       ARG   5 -10.718   3.409  16.693
  504   1HH1  ARG   5          1HH2      ARG   5 -11.086   0.882  19.100
  505   2HH1  ARG   5          2HH2      ARG   5 -12.504   1.625  19.788
  506   1HH2  ARG   5          1HH1      ARG   5 -12.523   4.300  17.631
  507   2HH2  ARG   5          2HH1      ARG   5 -13.279   3.511  18.984
  508    H    GLU   6           H        GLU   6  -5.847  -0.928  14.035
  509    HA   GLU   6           HA       GLU   6  -4.092   1.267  13.715
  510   1HB   GLU   6          1HB       GLU   6  -3.635  -1.066  14.690
  511   2HB   GLU   6          2HB       GLU   6  -3.564  -1.668  13.043
  512   1HG   GLU   6          1HG       GLU   6  -1.323  -1.336  13.718
  513   2HG   GLU   6          2HG       GLU   6  -1.661  -0.018  12.611
  514    H    LEU   7           H        LEU   7  -5.313  -1.045  11.311
  515    HA   LEU   7           HA       LEU   7  -3.732  -0.217   9.064
  516   1HB   LEU   7          1HB       LEU   7  -6.547  -1.424   9.063
  517   2HB   LEU   7          2HB       LEU   7  -5.419  -1.393   7.716
  518    HG   LEU   7           HG       LEU   7  -5.217  -2.987  10.282
  519   1HD1  LEU   7          1HD1      LEU   7  -6.757  -3.851   8.541
  520   2HD1  LEU   7          2HD1      LEU   7  -5.443  -3.799   7.342
  521   3HD1  LEU   7          3HD1      LEU   7  -5.351  -4.912   8.726
  522   1HD2  LEU   7          1HD2      LEU   7  -3.199  -4.035   9.364
  523   2HD2  LEU   7          2HD2      LEU   7  -3.214  -2.877   8.009
  524   3HD2  LEU   7          3HD2      LEU   7  -2.951  -2.315   9.687
  525    H    TYR   8           H        TYR   8  -7.069   0.506   9.911
  526    HA   TYR   8           HA       TYR   8  -7.841   2.356   7.940
  527   1HB   TYR   8          1HB       TYR   8  -8.859   1.058  10.219
  528   2HB   TYR   8          2HB       TYR   8  -8.745   2.643  10.854
  529    HD1  TYR   8           1HD      TYR   8 -11.062   0.530  10.043
  530    HD2  TYR   8           2HD      TYR   8  -9.728   4.375   8.599
  531    HE1  TYR   8           1HE      TYR   8 -13.380   1.065   9.315
  532    HE2  TYR   8           2HE      TYR   8 -12.049   4.900   7.879
  533    HH   TYR   8           HH       TYR   8 -14.230   4.190   7.801
  534    H    LYS   9           H        LYS   9  -6.344   3.077  11.128
  535    HA   LYS   9           HA       LYS   9  -6.485   5.905  10.751
  536   1HB   LYS   9          1HB       LYS   9  -4.805   4.112  12.563
  537   2HB   LYS   9          2HB       LYS   9  -4.609   5.872  12.584
  538   1HG   LYS   9          1HG       LYS   9  -6.945   6.210  13.158
  539   2HG   LYS   9          2HG       LYS   9  -7.280   4.474  13.051
  540   1HD   LYS   9          1HD       LYS   9  -5.738   4.017  14.902
  541   2HD   LYS   9          2HD       LYS   9  -5.304   5.727  15.021
  542   1HE   LYS   9          1HE       LYS   9  -8.131   4.636  15.401
  543   2HE   LYS   9          2HE       LYS   9  -6.986   4.879  16.725
  544   1HZ   LYS   9          1HZ       LYS   9  -6.920   7.249  16.156
  545   2HZ   LYS   9          2HZ       LYS   9  -8.011   7.037  14.956
  546   3HZ   LYS   9          3HZ       LYS   9  -8.442   6.791  16.508
  547    H    LEU  10           H        LEU  10  -3.649   3.818  10.105
  548    HA   LEU  10           HA       LEU  10  -2.180   5.977   9.023
  549   1HB   LEU  10          1HB       LEU  10  -1.923   2.984   8.867
  550   2HB   LEU  10          2HB       LEU  10  -0.898   3.990   7.842
  551    HG   LEU  10           HG       LEU  10  -1.092   4.474  10.844
  552   1HD1  LEU  10          1HD1      LEU  10   1.020   3.213  11.062
  553   2HD1  LEU  10          2HD1      LEU  10  -0.336   2.200  10.557
  554   3HD1  LEU  10          3HD1      LEU  10   0.888   2.706   9.359
  555   1HD2  LEU  10          1HD2      LEU  10   1.042   5.183   8.773
  556   2HD2  LEU  10          2HD2      LEU  10  -0.103   6.325   9.509
  557   3HD2  LEU  10          3HD2      LEU  10   1.116   5.539  10.511
  558    H    GLU  11           H        GLU  11  -4.437   3.688   7.487
  559    HA   GLU  11           HA       GLU  11  -4.323   4.688   4.841
  560   1HB   GLU  11          1HB       GLU  11  -6.106   3.089   6.577
  561   2HB   GLU  11          2HB       GLU  11  -7.047   3.886   5.436
  562   1HG   GLU  11          1HG       GLU  11  -4.572   2.167   4.854
  563   2HG   GLU  11          2HG       GLU  11  -6.218   1.585   4.821
  564    H    GLN  12           H        GLN  12  -6.161   6.116   7.649
  565    HA   GLN  12           HA       GLN  12  -7.099   8.238   5.894
  566   1HB   GLN  12          1HB       GLN  12  -7.418   7.574   8.822
  567   2HB   GLN  12          2HB       GLN  12  -8.028   9.081   8.102
  568   1HG   GLN  12          1HG       GLN  12  -9.229   7.799   6.386
  569   2HG   GLN  12          2HG       GLN  12  -8.721   6.291   7.118
  570   1HE2  GLN  12          2HE2      GLN  12 -11.454   8.011   6.846
  571   2HE2  GLN  12          1HE2      GLN  12 -12.127   7.783   8.451
  572    H    GLN  13           H        GLN  13  -4.389   7.928   8.048
  573    HA   GLN  13           HA       GLN  13  -3.838  10.775   8.198
  574   1HB   GLN  13          1HB       GLN  13  -2.095   8.293   8.533
  575   2HB   GLN  13          2HB       GLN  13  -1.430   9.919   8.652
  576   1HG   GLN  13          1HG       GLN  13  -3.708   8.913  10.405
  577   2HG   GLN  13          2HG       GLN  13  -2.010   8.886  10.864
  578   1HE2  GLN  13          2HE2      GLN  13  -4.837  10.740  11.091
  579   2HE2  GLN  13          1HE2      GLN  13  -4.060  12.274  11.466
  580    H    ALA  14           H        ALA  14  -3.011   8.313   5.711
  581    HA   ALA  14           HA       ALA  14  -1.436  10.226   4.134
  582   1HB   ALA  14          1HB       ALA  14  -1.205   7.768   3.866
  583   2HB   ALA  14          2HB       ALA  14  -2.906   7.649   3.361
  584   3HB   ALA  14          3HB       ALA  14  -1.735   8.532   2.356
  585    H    MET  15           H        MET  15  -4.871   9.190   4.200
  586    HA   MET  15           HA       MET  15  -5.787  10.844   2.040
  587   1HB   MET  15          1HB       MET  15  -6.902   9.074   3.985
  588   2HB   MET  15          2HB       MET  15  -7.814  10.560   4.149
  589   1HG   MET  15          1HG       MET  15  -7.339   9.528   1.374
  590   2HG   MET  15          2HG       MET  15  -8.324   8.532   2.432
  591   1HE   MET  15          1HE       MET  15  -7.874  12.097   1.028
  592   2HE   MET  15          2HE       MET  15  -9.513  12.790   1.111
  593   3HE   MET  15          3HE       MET  15  -8.571  12.576   2.595
  594    H    LYS  16           H        LYS  16  -5.592  11.716   5.572
  595    HA   LYS  16           HA       LYS  16  -6.565  14.401   5.084
  596   1HB   LYS  16          1HB       LYS  16  -5.082  13.041   7.347
  597   2HB   LYS  16          2HB       LYS  16  -5.364  14.796   7.348
  598   1HG   LYS  16          1HG       LYS  16  -7.790  14.447   7.051
  599   2HG   LYS  16          2HG       LYS  16  -7.558  12.687   7.081
  600   1HD   LYS  16          1HD       LYS  16  -6.763  12.778   9.375
  601   2HD   LYS  16          2HD       LYS  16  -6.783  14.565   9.351
  602   1HE   LYS  16          1HE       LYS  16  -9.213  14.558   8.990
  603   2HE   LYS  16          2HE       LYS  16  -9.229  12.786   8.977
  604   1HZ   LYS  16          1HZ       LYS  16  -8.491  12.824  11.293
  605   2HZ   LYS  16          2HZ       LYS  16  -8.425  14.460  11.304
  606   3HZ   LYS  16          3HZ       LYS  16  -9.861  13.701  11.159
  607    H    LEU  17           H        LEU  17  -3.279  13.025   5.096
  608    HA   LEU  17           HA       LEU  17  -1.899  15.471   4.564
  609   1HB   LEU  17          1HB       LEU  17  -1.415  12.544   4.356
  610   2HB   LEU  17          2HB       LEU  17  -0.517  13.444   3.208
  611    HG   LEU  17           HG       LEU  17  -0.521  13.994   6.212
  612   1HD1  LEU  17          1HD1      LEU  17   0.456  11.805   5.594
  613   2HD1  LEU  17          2HD1      LEU  17   1.564  12.617   4.466
  614   3HD1  LEU  17          3HD1      LEU  17   1.678  12.928   6.215
  615   1HD2  LEU  17          1HD2      LEU  17   1.309  15.062   4.008
  616   2HD2  LEU  17          2HD2      LEU  17   0.144  16.019   4.945
  617   3HD2  LEU  17          3HD2      LEU  17   1.541  15.305   5.751
  618    H    TYR  18           H        TYR  18  -3.508  13.167   2.352
  619    HA   TYR  18           HA       TYR  18  -2.963  14.528  -0.087
  620   1HB   TYR  18          1HB       TYR  18  -4.849  12.422   0.904
  621   2HB   TYR  18          2HB       TYR  18  -5.332  13.188  -0.556
  622    HD1  TYR  18           1HD      TYR  18  -3.201  13.526  -2.269
  623    HD2  TYR  18           2HD      TYR  18  -3.693  10.402   0.642
  624    HE1  TYR  18           1HE      TYR  18  -1.428  12.186  -3.410
  625    HE2  TYR  18           2HE      TYR  18  -1.930   9.069  -0.477
  626    HH   TYR  18           HH       TYR  18  -0.405   8.992  -2.173
  627    H    ARG  19           H        ARG  19  -5.744  14.867   2.128
  628    HA   ARG  19           HA       ARG  19  -7.240  16.762   0.662
  629   1HB   ARG  19          1HB       ARG  19  -7.735  15.416   2.824
  630   2HB   ARG  19          2HB       ARG  19  -7.017  16.749   3.705
  631   1HG   ARG  19          1HG       ARG  19  -9.377  17.071   1.780
  632   2HG   ARG  19          2HG       ARG  19  -9.552  16.587   3.456
  633   1HD   ARG  19          1HD       ARG  19  -9.991  18.787   3.648
  634   2HD   ARG  19          2HD       ARG  19  -8.277  18.770   4.061
  635    HE   ARG  19           HE       ARG  19  -7.948  19.380   1.549
  636   1HH1  ARG  19          1HH2      ARG  19 -10.640  20.628   3.427
  637   2HH1  ARG  19          2HH2      ARG  19 -10.764  22.054   2.433
  638   1HH2  ARG  19          1HH1      ARG  19  -8.158  21.175   0.365
  639   2HH2  ARG  19          2HH1      ARG  19  -9.367  22.367   0.756
  640    H    GLU  20           H        GLU  20  -4.586  17.386   2.989
  641    HA   GLU  20           HA       GLU  20  -4.725  20.286   2.516
  642   1HB   GLU  20          1HB       GLU  20  -3.893  18.652   4.597
  643   2HB   GLU  20          2HB       GLU  20  -2.361  19.053   3.870
  644   1HG   GLU  20          1HG       GLU  20  -2.698  20.683   5.552
  645   2HG   GLU  20          2HG       GLU  20  -2.995  21.515   4.029
  646    H    ALA  21           H        ALA  21  -2.530  17.688   1.557
  647    HA   ALA  21           HA       ALA  21  -0.624  19.250   0.145
  648   1HB   ALA  21          1HB       ALA  21  -0.349  16.851   0.524
  649   2HB   ALA  21          2HB       ALA  21  -1.708  16.494  -0.570
  650   3HB   ALA  21          3HB       ALA  21  -0.220  17.227  -1.203
  651    H    SER  22           H        SER  22  -3.904  18.237  -0.877
  652    HA   SER  22           HA       SER  22  -3.918  19.246  -3.503
  653   1HB   SER  22          1HB       SER  22  -5.726  17.949  -2.305
  654   2HB   SER  22          2HB       SER  22  -6.219  19.476  -1.546
  655    HG   SER  22           HG       SER  22  -7.388  18.999  -3.477
  656    H    GLU  23           H        GLU  23  -4.016  21.138  -0.457
  657    HA   GLU  23           HA       GLU  23  -4.793  23.636  -1.697
  658   1HB   GLU  23          1HB       GLU  23  -4.800  22.891   0.816
  659   2HB   GLU  23          2HB       GLU  23  -3.118  23.383   0.803
  660   1HG   GLU  23          1HG       GLU  23  -4.408  25.217   1.635
  661   2HG   GLU  23          2HG       GLU  23  -3.781  25.665   0.056
  662    H    LYS  24           H        LYS  24  -1.617  22.226  -0.830
  663    HA   LYS  24           HA       LYS  24  -0.063  24.404  -2.035
  664   1HB   LYS  24          1HB       LYS  24   0.780  21.550  -1.342
  665   2HB   LYS  24          2HB       LYS  24   1.844  22.834  -1.923
  666   1HG   LYS  24          1HG       LYS  24   0.967  24.225   0.099
  667   2HG   LYS  24          2HG       LYS  24   0.399  22.668   0.736
  668   1HD   LYS  24          1HD       LYS  24   2.750  21.786   0.526
  669   2HD   LYS  24          2HD       LYS  24   3.257  23.376  -0.079
  670   1HE   LYS  24          1HE       LYS  24   2.258  24.317   2.131
  671   2HE   LYS  24          2HE       LYS  24   2.243  22.637   2.687
  672   1HZ   LYS  24          1HZ       LYS  24   4.707  22.628   2.091
  673   2HZ   LYS  24          2HZ       LYS  24   4.615  24.230   1.879
  674   3HZ   LYS  24          3HZ       LYS  24   4.312  23.603   3.355
  675    H    ALA  25           H        ALA  25  -1.115  21.239  -3.192
  676    HA   ALA  25           HA       ALA  25   0.036  21.498  -5.833
  677   1HB   ALA  25          1HB       ALA  25  -0.260  19.346  -4.550
  678   2HB   ALA  25          2HB       ALA  25  -2.015  19.516  -4.758
  679   3HB   ALA  25          3HB       ALA  25  -0.971  19.310  -6.172
  680    H    ARG  26           H        ARG  26  -2.148  23.518  -4.932
  681    HA   ARG  26           HA       ARG  26  -4.539  23.191  -6.250
  682   1HB   ARG  26          1HB       ARG  26  -4.918  25.497  -6.041
  683   2HB   ARG  26          2HB       ARG  26  -3.966  25.017  -4.660
  684   1HG   ARG  26          1HG       ARG  26  -2.964  26.522  -7.125
  685   2HG   ARG  26          2HG       ARG  26  -3.305  27.210  -5.540
  686   1HD   ARG  26          1HD       ARG  26  -1.480  25.859  -4.545
  687   2HD   ARG  26          2HD       ARG  26  -1.117  25.190  -6.153
  688    HE   ARG  26           HE       ARG  26  -1.059  28.055  -6.233
  689   1HH1  ARG  26          1HH2      ARG  26   0.899  25.357  -5.103
  690   2HH1  ARG  26          2HH2      ARG  26   2.385  26.240  -5.340
  691   1HH2  ARG  26          1HH1      ARG  26   0.880  29.110  -6.486
  692   2HH2  ARG  26          2HH1      ARG  26   2.368  28.308  -6.081
  693    H    ASN  27           H        ASN  27  -1.586  23.650  -7.958
  694    HA   ASN  27           HA       ASN  27  -2.581  24.710 -10.429
  695   1HB   ASN  27          1HB       ASN  27  -0.189  24.595  -9.780
  696   2HB   ASN  27          2HB       ASN  27  -0.247  22.832  -9.817
  697   1HD2  ASN  27          2HD2      ASN  27   0.706  25.474 -11.620
  698   2HD2  ASN  27          1HD2      ASN  27   0.601  24.725 -13.207
  699    HA   PRO  28           HA       PRO  28  -5.304  21.367 -11.326
  700   1HB   PRO  28          1HB       PRO  28  -5.697  21.597 -14.047
  701   2HB   PRO  28          2HB       PRO  28  -6.395  22.691 -12.816
  702   1HG   PRO  28          1HG       PRO  28  -3.875  23.093 -14.451
  703   2HG   PRO  28          2HG       PRO  28  -5.210  24.258 -14.165
  704   1HD   PRO  28          1HD       PRO  28  -2.927  24.347 -12.719
  705   2HD   PRO  28          2HD       PRO  28  -4.509  24.640 -11.930
  706    H    GLU  29           H        GLU  29  -2.186  21.434 -12.882
  707    HA   GLU  29           HA       GLU  29  -2.246  18.937 -14.273
  708   1HB   GLU  29          1HB       GLU  29  -0.543  20.885 -14.354
  709   2HB   GLU  29          2HB       GLU  29   0.173  20.189 -12.920
  710   1HG   GLU  29          1HG       GLU  29   1.455  19.405 -14.752
  711   2HG   GLU  29          2HG       GLU  29   0.512  18.028 -14.205
  712    H    LYS  30           H        LYS  30  -1.282  19.746 -11.017
  713    HA   LYS  30           HA       LYS  30  -0.989  16.893 -10.216
  714   1HB   LYS  30          1HB       LYS  30  -0.235  19.498  -8.831
  715   2HB   LYS  30          2HB       LYS  30  -0.338  17.959  -7.974
  716   1HG   LYS  30          1HG       LYS  30   1.909  18.162  -8.476
  717   2HG   LYS  30          2HG       LYS  30   1.285  16.957  -9.605
  718   1HD   LYS  30          1HD       LYS  30   1.230  18.705 -11.388
  719   2HD   LYS  30          2HD       LYS  30   1.909  19.881 -10.254
  720   1HE   LYS  30          1HE       LYS  30   3.214  17.271 -11.166
  721   2HE   LYS  30          2HE       LYS  30   3.564  18.868 -11.837
  722   1HZ   LYS  30          1HZ       LYS  30   4.369  19.551  -9.642
  723   2HZ   LYS  30          2HZ       LYS  30   4.084  18.057  -9.029
  724   3HZ   LYS  30          3HZ       LYS  30   5.208  18.268 -10.196
  725    H    LYS  31           H        LYS  31  -3.110  19.672  -9.452
  726    HA   LYS  31           HA       LYS  31  -4.672  18.368  -7.528
  727   1HB   LYS  31          1HB       LYS  31  -4.758  20.812  -8.289
  728   2HB   LYS  31          2HB       LYS  31  -5.852  20.261  -9.568
  729   1HG   LYS  31          1HG       LYS  31  -7.425  19.404  -7.880
  730   2HG   LYS  31          2HG       LYS  31  -6.283  19.806  -6.580
  731   1HD   LYS  31          1HD       LYS  31  -6.465  22.204  -7.156
  732   2HD   LYS  31          2HD       LYS  31  -7.597  21.808  -8.470
  733   1HE   LYS  31          1HE       LYS  31  -9.152  20.796  -6.813
  734   2HE   LYS  31          2HE       LYS  31  -8.024  21.181  -5.509
  735   1HZ   LYS  31          1HZ       LYS  31  -8.339  23.543  -6.017
  736   2HZ   LYS  31          2HZ       LYS  31  -9.367  23.192  -7.242
  737   3HZ   LYS  31          3HZ       LYS  31  -9.784  22.853  -5.703
  738    H    SER  32           H        SER  32  -4.754  17.870 -10.967
  739    HA   SER  32           HA       SER  32  -7.026  15.972 -10.712
  740   1HB   SER  32          1HB       SER  32  -5.530  16.751 -13.249
  741   2HB   SER  32          2HB       SER  32  -7.110  15.960 -13.122
  742    HG   SER  32           HG       SER  32  -6.374  18.627 -12.601
  743    H    VAL  33           H        VAL  33  -3.968  15.528  -9.949
  744    HA   VAL  33           HA       VAL  33  -3.956  12.694 -10.964
  745    HB   VAL  33           HB       VAL  33  -1.614  14.490 -10.253
  746   1HG1  VAL  33          1HG1      VAL  33  -1.103  12.301  -9.287
  747   2HG1  VAL  33          2HG1      VAL  33  -1.634  11.482 -10.774
  748   3HG1  VAL  33          3HG1      VAL  33  -0.182  12.501 -10.776
  749   1HG2  VAL  33          1HG2      VAL  33  -2.289  12.896 -12.771
  750   2HG2  VAL  33          2HG2      VAL  33  -2.537  14.639 -12.583
  751   3HG2  VAL  33          3HG2      VAL  33  -0.898  13.979 -12.541
  752    H    LEU  34           H        LEU  34  -3.237  14.784  -8.020
  753    HA   LEU  34           HA       LEU  34  -3.274  12.401  -6.364
  754   1HB   LEU  34          1HB       LEU  34  -2.614  13.669  -4.709
  755   2HB   LEU  34          2HB       LEU  34  -2.088  14.722  -6.006
  756    HG   LEU  34           HG       LEU  34  -4.686  14.925  -4.517
  757   1HD1  LEU  34          1HD1      LEU  34  -2.606  15.397  -3.074
  758   2HD1  LEU  34          2HD1      LEU  34  -2.232  16.724  -4.170
  759   3HD1  LEU  34          3HD1      LEU  34  -3.728  16.750  -3.209
  760   1HD2  LEU  34          1HD2      LEU  34  -3.342  17.017  -6.241
  761   2HD2  LEU  34          2HD2      LEU  34  -4.779  16.070  -6.690
  762   3HD2  LEU  34          3HD2      LEU  34  -4.869  17.219  -5.351
  763    H    GLN  35           H        GLN  35  -5.838  14.283  -7.770
  764    HA   GLN  35           HA       GLN  35  -7.910  13.744  -5.932
  765   1HB   GLN  35          1HB       GLN  35  -8.146  15.322  -7.733
  766   2HB   GLN  35          2HB       GLN  35  -7.892  14.064  -8.956
  767   1HG   GLN  35          1HG       GLN  35 -10.071  13.026  -8.281
  768   2HG   GLN  35          2HG       GLN  35 -10.265  14.282  -7.053
  769   1HE2  GLN  35          2HE2      GLN  35 -12.101  15.365  -7.908
  770   2HE2  GLN  35          1HE2      GLN  35 -12.099  16.089  -9.512
  771    H    LYS  36           H        LYS  36  -6.668  11.662  -8.606
  772    HA   LYS  36           HA       LYS  36  -8.774   9.678  -8.231
  773   1HB   LYS  36          1HB       LYS  36  -6.130   9.730  -9.751
  774   2HB   LYS  36          2HB       LYS  36  -7.052   8.231  -9.600
  775   1HG   LYS  36          1HG       LYS  36  -8.995   9.164 -10.649
  776   2HG   LYS  36          2HG       LYS  36  -8.302  10.786 -10.687
  777   1HD   LYS  36          1HD       LYS  36  -6.999   8.420 -12.101
  778   2HD   LYS  36          2HD       LYS  36  -8.252   9.383 -12.879
  779   1HE   LYS  36          1HE       LYS  36  -5.724  10.619 -11.711
  780   2HE   LYS  36          2HE       LYS  36  -5.806  10.025 -13.371
  781   1HZ   LYS  36          1HZ       LYS  36  -7.471  11.622 -13.895
  782   2HZ   LYS  36          2HZ       LYS  36  -7.722  12.035 -12.332
  783   3HZ   LYS  36          3HZ       LYS  36  -6.336  12.462 -13.050
  784    H    ILE  37           H        ILE  37  -5.507   9.967  -6.901
  785    HA   ILE  37           HA       ILE  37  -5.618   7.459  -5.409
  786    HB   ILE  37           HB       ILE  37  -4.178  10.081  -4.901
  787   1HG1  ILE  37          1HG1      ILE  37  -3.071   7.587  -6.127
  788   2HG1  ILE  37          2HG1      ILE  37  -3.391   9.153  -6.893
  789   1HG2  ILE  37          1HG2      ILE  37  -4.351   9.004  -2.745
  790   2HG2  ILE  37          2HG2      ILE  37  -4.081   7.402  -3.453
  791   3HG2  ILE  37          3HG2      ILE  37  -2.754   8.545  -3.306
  792   1HD1  ILE  37          1HD1      ILE  37  -1.719  10.185  -5.279
  793   2HD1  ILE  37          2HD1      ILE  37  -1.223   8.516  -4.885
  794   3HD1  ILE  37          3HD1      ILE  37  -1.056   9.124  -6.527
  795    H    LEU  38           H        LEU  38  -6.492  10.897  -4.419
  796    HA   LEU  38           HA       LEU  38  -7.405   9.995  -1.904
  797   1HB   LEU  38          1HB       LEU  38  -7.850  12.084  -1.349
  798   2HB   LEU  38          2HB       LEU  38  -6.810  12.359  -2.729
  799    HG   LEU  38           HG       LEU  38  -9.089  12.387  -4.025
  800   1HD1  LEU  38          1HD1      LEU  38 -10.585  11.890  -2.087
  801   2HD1  LEU  38          2HD1      LEU  38  -9.975  13.330  -1.261
  802   3HD1  LEU  38          3HD1      LEU  38 -10.915  13.485  -2.759
  803   1HD2  LEU  38          1HD2      LEU  38  -8.224  14.723  -2.254
  804   2HD2  LEU  38          2HD2      LEU  38  -7.479  14.297  -3.805
  805   3HD2  LEU  38          3HD2      LEU  38  -9.163  14.851  -3.760
  806    H    GLU  39           H        GLU  39  -9.238  10.067  -4.964
  807    HA   GLU  39           HA       GLU  39 -11.711   9.295  -3.665
  808   1HB   GLU  39          1HB       GLU  39 -11.527  10.415  -5.902
  809   2HB   GLU  39          2HB       GLU  39 -10.824   8.934  -6.565
  810   1HG   GLU  39          1HG       GLU  39 -12.910   7.707  -6.069
  811   2HG   GLU  39          2HG       GLU  39 -13.587   9.138  -5.286
  812    H    ASP  40           H        ASP  40  -9.027   7.384  -5.098
  813    HA   ASP  40           HA       ASP  40 -10.164   4.786  -4.703
  814   1HB   ASP  40          1HB       ASP  40  -7.437   6.065  -5.035
  815   2HB   ASP  40          2HB       ASP  40  -7.497   4.474  -4.459
  816    H    GLU  41           H        GLU  41  -8.421   7.038  -2.504
  817    HA   GLU  41           HA       GLU  41  -8.215   5.010  -0.397
  818   1HB   GLU  41          1HB       GLU  41  -8.001   8.024  -0.158
  819   2HB   GLU  41          2HB       GLU  41  -7.619   6.854   1.103
  820   1HG   GLU  41          1HG       GLU  41  -6.047   7.410  -1.418
  821   2HG   GLU  41          2HG       GLU  41  -5.587   7.711   0.236
  822    H    GLU  42           H        GLU  42 -10.540   7.639  -1.106
  823    HA   GLU  42           HA       GLU  42 -12.234   7.176   1.154
  824   1HB   GLU  42          1HB       GLU  42 -12.390   9.113  -0.399
  825   2HB   GLU  42          2HB       GLU  42 -13.042   8.045  -1.650
  826   1HG   GLU  42          1HG       GLU  42 -14.992   7.535  -0.234
  827   2HG   GLU  42          2HG       GLU  42 -14.303   8.472   1.094
  828    H    LYS  43           H        LYS  43 -12.026   5.494  -1.983
  829    HA   LYS  43           HA       LYS  43 -14.175   3.637  -1.559
  830   1HB   LYS  43          1HB       LYS  43 -12.190   4.192  -3.555
  831   2HB   LYS  43          2HB       LYS  43 -12.007   2.506  -3.141
  832   1HG   LYS  43          1HG       LYS  43 -14.430   2.144  -3.601
  833   2HG   LYS  43          2HG       LYS  43 -14.621   3.882  -3.918
  834   1HD   LYS  43          1HD       LYS  43 -12.886   3.656  -5.755
  835   2HD   LYS  43          2HD       LYS  43 -12.957   1.905  -5.548
  836   1HE   LYS  43          1HE       LYS  43 -15.303   3.733  -6.271
  837   2HE   LYS  43          2HE       LYS  43 -14.355   2.802  -7.431
  838   1HZ   LYS  43          1HZ       LYS  43 -15.117   0.763  -6.328
  839   2HZ   LYS  43          2HZ       LYS  43 -16.031   1.631  -5.275
  840   3HZ   LYS  43          3HZ       LYS  43 -16.383   1.637  -6.864
  841    H    HIS  44           H        HIS  44 -10.614   3.334  -0.681
  842    HA   HIS  44           HA       HIS  44 -10.819   0.766   0.426
  843   1HB   HIS  44          1HB       HIS  44  -9.054   3.161   1.132
  844   2HB   HIS  44          2HB       HIS  44  -8.811   1.501   1.563
  845    HD2  HIS  44           2HD      HIS  44  -9.850   0.990  -1.785
  846    HE1  HIS  44           1HE      HIS  44  -5.766   1.986  -2.340
  847    HE2  HIS  44           2HE      HIS  44  -7.876   1.097  -3.462
  848    H    ILE  45           H        ILE  45 -11.274   3.999   1.918
  849    HA   ILE  45           HA       ILE  45 -11.759   3.032   4.576
  850    HB   ILE  45           HB       ILE  45 -12.081   5.612   3.075
  851   1HG1  ILE  45          1HG1      ILE  45 -10.912   6.478   5.121
  852   2HG1  ILE  45          2HG1      ILE  45 -10.908   4.849   5.787
  853   1HG2  ILE  45          1HG2      ILE  45 -14.252   5.573   4.161
  854   2HG2  ILE  45          2HG2      ILE  45 -13.501   5.144   5.718
  855   3HG2  ILE  45          3HG2      ILE  45 -13.200   6.728   4.967
  856   1HD1  ILE  45          1HD1      ILE  45  -9.430   4.126   3.888
  857   2HD1  ILE  45          2HD1      ILE  45  -9.429   5.817   3.315
  858   3HD1  ILE  45          3HD1      ILE  45  -8.733   5.414   4.880
  859    H    GLU  46           H        GLU  46 -14.078   3.581   1.845
  860    HA   GLU  46           HA       GLU  46 -16.419   2.831   3.279
  861   1HB   GLU  46          1HB       GLU  46 -15.548   2.728   0.389
  862   2HB   GLU  46          2HB       GLU  46 -17.013   1.896   0.856
  863   1HG   GLU  46          1HG       GLU  46 -16.518   4.830   1.462
  864   2HG   GLU  46          2HG       GLU  46 -17.259   4.253  -0.034
  865    H    TRP  47           H        TRP  47 -14.043   0.720   1.591
  866    HA   TRP  47           HA       TRP  47 -15.481  -1.709   2.155
  867   1HB   TRP  47          1HB       TRP  47 -12.545  -1.323   1.543
  868   2HB   TRP  47          2HB       TRP  47 -13.493  -2.774   1.338
  869    HD1  TRP  47           1HD      TRP  47 -15.863  -0.751  -0.229
  870    HE1  TRP  47           1HE      TRP  47 -15.378  -0.235  -2.704
  871    HE3  TRP  47           3HE      TRP  47 -10.971  -1.999  -0.323
  872    HZ2  TRP  47           2HZ      TRP  47 -13.072  -0.359  -4.509
  873    HZ3  TRP  47           3HZ      TRP  47  -9.580  -1.776  -2.370
  874    HH2  TRP  47           2HH      TRP  47 -10.639  -0.941  -4.489
  875    H    LEU  48           H        LEU  48 -12.767  -0.049   3.752
  876    HA   LEU  48           HA       LEU  48 -12.206  -1.896   5.846
  877   1HB   LEU  48          1HB       LEU  48 -11.943   1.082   5.385
  878   2HB   LEU  48          2HB       LEU  48 -11.617   0.494   6.976
  879    HG   LEU  48           HG       LEU  48 -10.223  -0.616   4.525
  880   1HD1  LEU  48          1HD1      LEU  48  -9.710   1.764   4.704
  881   2HD1  LEU  48          2HD1      LEU  48  -9.381   1.601   6.442
  882   3HD1  LEU  48          3HD1      LEU  48  -8.313   0.830   5.248
  883   1HD2  LEU  48          1HD2      LEU  48  -9.551  -0.715   7.510
  884   2HD2  LEU  48          2HD2      LEU  48 -10.129  -2.083   6.533
  885   3HD2  LEU  48          3HD2      LEU  48  -8.547  -1.376   6.206
  886    H    GLU  49           H        GLU  49 -14.515   0.832   5.759
  887    HA   GLU  49           HA       GLU  49 -15.689   0.348   8.319
  888   1HB   GLU  49          1HB       GLU  49 -16.065   2.246   6.429
  889   2HB   GLU  49          2HB       GLU  49 -17.446   1.251   6.038
  890   1HG   GLU  49          1HG       GLU  49 -18.184   1.342   8.431
  891   2HG   GLU  49          2HG       GLU  49 -16.821   2.392   8.800
  892    H    THR  50           H        THR  50 -16.297  -1.153   5.151
  893    HA   THR  50           HA       THR  50 -18.643  -2.636   6.035
  894    HB   THR  50           HB       THR  50 -16.839  -2.707   3.613
  895    HG1  THR  50           1HG      THR  50 -18.663  -1.886   2.676
  896   1HG2  THR  50          1HG2      THR  50 -17.538  -4.997   3.818
  897   2HG2  THR  50          2HG2      THR  50 -19.221  -4.490   4.145
  898   3HG2  THR  50          3HG2      THR  50 -18.473  -4.201   2.545
  899    H    ILE  51           H        ILE  51 -15.242  -3.154   6.344
  900    HA   ILE  51           HA       ILE  51 -15.592  -5.953   7.244
  901    HB   ILE  51           HB       ILE  51 -13.429  -4.332   6.024
  902   1HG1  ILE  51          1HG1      ILE  51 -12.793  -6.492   5.024
  903   2HG1  ILE  51          2HG1      ILE  51 -13.905  -7.351   6.093
  904   1HG2  ILE  51          1HG2      ILE  51 -12.294  -4.712   8.145
  905   2HG2  ILE  51          2HG2      ILE  51 -12.583  -6.472   7.985
  906   3HG2  ILE  51          3HG2      ILE  51 -11.561  -5.607   6.810
  907   1HD1  ILE  51          1HD1      ILE  51 -15.821  -6.314   4.989
  908   2HD1  ILE  51          2HD1      ILE  51 -14.727  -5.319   3.987
  909   3HD1  ILE  51          3HD1      ILE  51 -14.769  -7.091   3.802
  910    H    ASN  52           H        ASN  52 -15.345  -2.924   8.624
  911    HA   ASN  52           HA       ASN  52 -14.258  -3.593  11.205
  912   1HB   ASN  52          1HB       ASN  52 -14.484  -1.280  10.258
  913   2HB   ASN  52          2HB       ASN  52 -16.236  -1.406  10.438
  914   1HD2  ASN  52          2HD2      ASN  52 -16.345   0.378  11.901
  915   2HD2  ASN  52          1HD2      ASN  52 -15.704   0.237  13.532
  916    H    GLY  53           H        GLY  53 -15.374  -3.801  13.236
  917   1HA   GLY  53          1HA       GLY  53 -18.140  -4.261  13.649
  918   2HA   GLY  53          2HA       GLY  53 -17.400  -5.827  13.318
  Start of MODEL   20
    1   1H    MET   1          1H        MET   1  12.865  15.699   0.115
    2   2H    MET   1          2H        MET   1  11.515  15.733   1.052
    3   3H    MET   1          3H        MET   1  12.350  17.106   0.769
    4    HA   MET   1           HA       MET   1  11.806  17.050  -1.572
    5   1HB   MET   1          1HB       MET   1  10.053  14.672  -0.822
    6   2HB   MET   1          2HB       MET   1  10.092  15.487  -2.388
    7   1HG   MET   1          1HG       MET   1  12.495  14.841  -2.641
    8   2HG   MET   1          2HG       MET   1  12.376  13.927  -1.130
    9   1HE   MET   1          1HE       MET   1  13.516  12.489  -3.589
   10   2HE   MET   1          2HE       MET   1  13.177  11.717  -2.021
   11   3HE   MET   1          3HE       MET   1  12.614  10.959  -3.525
   12    H    ASP   2           H        ASP   2   9.859  18.124  -2.364
   13    HA   ASP   2           HA       ASP   2   8.866  19.820  -0.300
   14   1HB   ASP   2          1HB       ASP   2   7.781  21.034  -2.058
   15   2HB   ASP   2          2HB       ASP   2   9.418  20.608  -2.531
   16    H    TYR   3           H        TYR   3   6.997  17.487  -2.359
   17    HA   TYR   3           HA       TYR   3   4.981  17.117  -0.273
   18   1HB   TYR   3          1HB       TYR   3   4.675  19.435  -1.771
   19   2HB   TYR   3          2HB       TYR   3   3.563  18.333  -2.537
   20    HD1  TYR   3           1HD      TYR   3   1.971  16.968  -0.967
   21    HD2  TYR   3           2HD      TYR   3   4.255  20.366   0.381
   22    HE1  TYR   3           1HE      TYR   3   0.682  17.012   1.158
   23    HE2  TYR   3           2HE      TYR   3   2.938  20.419   2.479
   24    HH   TYR   3           HH       TYR   3   1.250  19.427   3.718
   25    H    LEU   4           H        LEU   4   6.485  15.168  -1.416
   26    HA   LEU   4           HA       LEU   4   4.265  13.519  -2.393
   27   1HB   LEU   4          1HB       LEU   4   5.018  12.866  -4.392
   28   2HB   LEU   4          2HB       LEU   4   5.873  14.387  -4.341
   29    HG   LEU   4           HG       LEU   4   7.812  12.988  -3.304
   30   1HD1  LEU   4          1HD1      LEU   4   6.613  10.801  -3.067
   31   2HD1  LEU   4          2HD1      LEU   4   6.246  10.827  -4.789
   32   3HD1  LEU   4          3HD1      LEU   4   7.924  10.656  -4.236
   33   1HD2  LEU   4          1HD2      LEU   4   7.228  12.506  -6.222
   34   2HD2  LEU   4          2HD2      LEU   4   7.872  14.040  -5.564
   35   3HD2  LEU   4          3HD2      LEU   4   8.802  12.544  -5.412
   36    H    ARG   5           H        ARG   5   7.740  13.250  -1.347
   37    HA   ARG   5           HA       ARG   5   7.436  10.547  -0.466
   38   1HB   ARG   5          1HB       ARG   5   9.539  12.447  -0.655
   39   2HB   ARG   5          2HB       ARG   5   9.538  11.938   1.020
   40   1HG   ARG   5          1HG       ARG   5   9.473   9.975  -1.318
   41   2HG   ARG   5          2HG       ARG   5  10.980  10.620  -0.687
   42   1HD   ARG   5          1HD       ARG   5   8.996   9.146   1.089
   43   2HD   ARG   5          2HD       ARG   5  10.270   8.338   0.160
   44    HE   ARG   5           HE       ARG   5  11.327  10.523   1.747
   45   1HH1  ARG   5          1HH2      ARG   5  10.423   7.151   2.021
   46   2HH1  ARG   5          2HH2      ARG   5  11.586   6.851   3.284
   47   1HH2  ARG   5          1HH1      ARG   5  12.784  10.072   3.354
   48   2HH2  ARG   5          2HH1      ARG   5  12.880   8.468   4.017
   49    H    GLU   6           H        GLU   6   6.860  13.543   1.132
   50    HA   GLU   6           HA       GLU   6   6.333  12.763   3.771
   51   1HB   GLU   6          1HB       GLU   6   6.345  15.094   2.501
   52   2HB   GLU   6          2HB       GLU   6   4.643  14.822   2.255
   53   1HG   GLU   6          1HG       GLU   6   4.220  14.690   4.653
   54   2HG   GLU   6          2HG       GLU   6   5.941  14.593   5.016
   55    H    LEU   7           H        LEU   7   4.496  12.123   0.886
   56    HA   LEU   7           HA       LEU   7   2.114  11.109   2.369
   57   1HB   LEU   7          1HB       LEU   7   2.583  11.722  -0.599
   58   2HB   LEU   7          2HB       LEU   7   1.122  11.033   0.077
   59    HG   LEU   7           HG       LEU   7   1.308  13.203   1.702
   60   1HD1  LEU   7          1HD1      LEU   7   3.400  14.009   0.464
   61   2HD1  LEU   7          2HD1      LEU   7   2.382  14.208  -0.969
   62   3HD1  LEU   7          3HD1      LEU   7   2.056  15.137   0.514
   63   1HD2  LEU   7          1HD2      LEU   7   0.168  13.190  -1.118
   64   2HD2  LEU   7          2HD2      LEU   7  -0.646  12.641   0.366
   65   3HD2  LEU   7          3HD2      LEU   7  -0.249  14.353   0.164
   66    H    TYR   8           H        TYR   8   4.441  10.045  -0.123
   67    HA   TYR   8           HA       TYR   8   3.882   7.323  -0.470
   68   1HB   TYR   8          1HB       TYR   8   5.859   9.097  -1.150
   69   2HB   TYR   8          2HB       TYR   8   6.735   8.248   0.064
   70    HD1  TYR   8           1HD      TYR   8   5.853   5.358  -0.524
   71    HD2  TYR   8           2HD      TYR   8   7.126   8.587  -3.060
   72    HE1  TYR   8           1HE      TYR   8   6.725   3.724  -2.169
   73    HE2  TYR   8           2HE      TYR   8   7.945   6.953  -4.733
   74    HH   TYR   8           HH       TYR   8   8.216   4.724  -5.250
   75    H    LYS   9           H        LYS   9   5.622   8.803   2.259
   76    HA   LYS   9           HA       LYS   9   6.381   6.291   3.368
   77   1HB   LYS   9          1HB       LYS   9   7.384   8.627   3.862
   78   2HB   LYS   9          2HB       LYS   9   6.031   8.920   4.946
   79   1HG   LYS   9          1HG       LYS   9   6.682   6.970   6.331
   80   2HG   LYS   9          2HG       LYS   9   7.922   6.513   5.150
   81   1HD   LYS   9          1HD       LYS   9   9.134   8.633   5.604
   82   2HD   LYS   9          2HD       LYS   9   7.914   9.054   6.829
   83   1HE   LYS   9          1HE       LYS   9   8.459   6.967   8.077
   84   2HE   LYS   9          2HE       LYS   9   9.653   6.537   6.848
   85   1HZ   LYS   9          1HZ       LYS   9  10.903   8.545   7.454
   86   2HZ   LYS   9          2HZ       LYS   9   9.800   8.937   8.597
   87   3HZ   LYS   9          3HZ       LYS   9  10.704   7.589   8.761
   88    H    LEU  10           H        LEU  10   3.661   8.273   4.578
   89    HA   LEU  10           HA       LEU  10   2.613   6.227   6.179
   90   1HB   LEU  10          1HB       LEU  10   1.195   8.569   4.842
   91   2HB   LEU  10          2HB       LEU  10   0.481   7.492   6.041
   92    HG   LEU  10           HG       LEU  10   2.718   8.144   7.407
   93   1HD1  LEU  10          1HD1      LEU  10   3.704   9.682   5.830
   94   2HD1  LEU  10          2HD1      LEU  10   2.187  10.581   5.687
   95   3HD1  LEU  10          3HD1      LEU  10   3.107  10.601   7.205
   96   1HD2  LEU  10          1HD2      LEU  10   0.206   9.868   7.248
   97   2HD2  LEU  10          2HD2      LEU  10   0.405   8.393   8.221
   98   3HD2  LEU  10          3HD2      LEU  10   1.356   9.833   8.605
   99    H    GLU  11           H        GLU  11   2.108   6.921   2.731
  100    HA   GLU  11           HA       GLU  11   0.225   4.892   2.088
  101   1HB   GLU  11          1HB       GLU  11   2.335   6.490   0.731
  102   2HB   GLU  11          2HB       GLU  11   1.839   5.144  -0.172
  103   1HG   GLU  11          1HG       GLU  11  -0.042   7.278   0.982
  104   2HG   GLU  11          2HG       GLU  11   0.683   7.364  -0.616
  105    H    GLN  12           H        GLN  12   3.898   4.541   2.433
  106    HA   GLN  12           HA       GLN  12   3.643   1.704   1.939
  107   1HB   GLN  12          1HB       GLN  12   5.887   3.529   2.778
  108   2HB   GLN  12          2HB       GLN  12   6.061   1.764   2.756
  109   1HG   GLN  12          1HG       GLN  12   5.259   1.723   0.401
  110   2HG   GLN  12          2HG       GLN  12   5.239   3.470   0.390
  111   1HE2  GLN  12          2HE2      GLN  12   7.563   4.414   1.269
  112   2HE2  GLN  12          1HE2      GLN  12   8.944   3.603   0.542
  113    H    GLN  13           H        GLN  13   3.548   3.587   4.874
  114    HA   GLN  13           HA       GLN  13   4.014   1.358   6.684
  115   1HB   GLN  13          1HB       GLN  13   2.464   3.973   7.009
  116   2HB   GLN  13          2HB       GLN  13   2.673   2.824   8.324
  117   1HG   GLN  13          1HG       GLN  13   5.062   4.028   6.872
  118   2HG   GLN  13          2HG       GLN  13   4.280   4.813   8.239
  119   1HE2  GLN  13          2HE2      GLN  13   4.789   4.094  10.348
  120   2HE2  GLN  13          1HE2      GLN  13   5.851   2.724  10.637
  121    H    ALA  14           H        ALA  14   1.079   2.429   4.985
  122    HA   ALA  14           HA       ALA  14  -0.618   0.395   6.251
  123   1HB   ALA  14          1HB       ALA  14  -1.548   2.452   5.200
  124   2HB   ALA  14          2HB       ALA  14  -0.898   1.947   3.622
  125   3HB   ALA  14          3HB       ALA  14  -2.163   0.983   4.417
  126    H    MET  15           H        MET  15   1.474   0.535   3.307
  127    HA   MET  15           HA       MET  15   0.706  -2.092   2.326
  128   1HB   MET  15          1HB       MET  15   3.324  -0.609   1.875
  129   2HB   MET  15          2HB       MET  15   2.744  -2.006   0.989
  130   1HG   MET  15          1HG       MET  15   0.635  -0.097   0.840
  131   2HG   MET  15          2HG       MET  15   2.127   0.803   0.609
  132   1HE   MET  15          1HE       MET  15   1.040  -2.882  -0.467
  133   2HE   MET  15          2HE       MET  15  -0.346  -1.801  -0.723
  134   3HE   MET  15          3HE       MET  15   0.482  -2.529  -2.118
  135    H    LYS  16           H        LYS  16   3.248  -1.082   4.629
  136    HA   LYS  16           HA       LYS  16   4.340  -3.728   4.985
  137   1HB   LYS  16          1HB       LYS  16   5.180  -1.235   5.654
  138   2HB   LYS  16          2HB       LYS  16   4.364  -1.607   7.155
  139   1HG   LYS  16          1HG       LYS  16   6.639  -2.195   7.482
  140   2HG   LYS  16          2HG       LYS  16   5.778  -3.721   7.310
  141   1HD   LYS  16          1HD       LYS  16   7.886  -3.808   6.108
  142   2HD   LYS  16          2HD       LYS  16   6.566  -3.884   4.939
  143   1HE   LYS  16          1HE       LYS  16   6.857  -1.467   4.440
  144   2HE   LYS  16          2HE       LYS  16   8.127  -1.359   5.665
  145   1HZ   LYS  16          1HZ       LYS  16   9.448  -2.921   4.336
  146   2HZ   LYS  16          2HZ       LYS  16   8.272  -3.024   3.204
  147   3HZ   LYS  16          3HZ       LYS  16   9.062  -1.615   3.440
  148    H    LEU  17           H        LEU  17   1.847  -1.900   6.759
  149    HA   LEU  17           HA       LEU  17   1.112  -3.975   8.585
  150   1HB   LEU  17          1HB       LEU  17  -0.033  -1.446   7.449
  151   2HB   LEU  17          2HB       LEU  17  -1.203  -2.528   8.078
  152    HG   LEU  17           HG       LEU  17   1.190  -1.414   9.609
  153   1HD1  LEU  17          1HD1      LEU  17  -0.611   0.202   9.057
  154   2HD1  LEU  17          2HD1      LEU  17  -1.795  -0.849   9.860
  155   3HD1  LEU  17          3HD1      LEU  17  -0.484  -0.104  10.799
  156   1HD2  LEU  17          1HD2      LEU  17  -1.109  -3.164  10.607
  157   2HD2  LEU  17          2HD2      LEU  17   0.615  -3.591  10.601
  158   3HD2  LEU  17          3HD2      LEU  17   0.045  -2.298  11.645
  159    H    TYR  18           H        TYR  18  -0.053  -3.286   5.279
  160    HA   TYR  18           HA       TYR  18  -1.986  -5.323   5.131
  161   1HB   TYR  18          1HB       TYR  18  -0.473  -3.605   3.191
  162   2HB   TYR  18          2HB       TYR  18  -1.296  -4.964   2.539
  163    HD1  TYR  18           1HD      TYR  18  -3.782  -5.232   3.833
  164    HD2  TYR  18           2HD      TYR  18  -1.746  -1.610   2.762
  165    HE1  TYR  18           1HE      TYR  18  -5.950  -4.013   3.887
  166    HE2  TYR  18           2HE      TYR  18  -3.885  -0.354   2.922
  167    HH   TYR  18           HH       TYR  18  -6.149  -0.463   3.434
  168    H    ARG  19           H        ARG  19   1.527  -5.529   4.463
  169    HA   ARG  19           HA       ARG  19   1.624  -8.198   3.461
  170   1HB   ARG  19          1HB       ARG  19   3.494  -6.280   4.709
  171   2HB   ARG  19          2HB       ARG  19   3.808  -7.917   5.249
  172   1HG   ARG  19          1HG       ARG  19   5.176  -7.536   3.368
  173   2HG   ARG  19          2HG       ARG  19   3.913  -8.662   2.856
  174   1HD   ARG  19          1HD       ARG  19   2.698  -6.800   1.758
  175   2HD   ARG  19          2HD       ARG  19   3.908  -5.654   2.367
  176    HE   ARG  19           HE       ARG  19   4.984  -7.870   0.757
  177   1HH1  ARG  19          1HH2      ARG  19   3.812  -4.584   0.560
  178   2HH1  ARG  19          2HH2      ARG  19   4.708  -4.253  -0.902
  179   1HH2  ARG  19          1HH1      ARG  19   6.099  -7.393  -1.095
  180   2HH2  ARG  19          2HH1      ARG  19   5.962  -5.817  -1.815
  181    H    GLU  20           H        GLU  20   1.403  -7.106   6.838
  182    HA   GLU  20           HA       GLU  20   1.450  -9.855   7.867
  183   1HB   GLU  20          1HB       GLU  20   2.163  -7.377   8.877
  184   2HB   GLU  20          2HB       GLU  20   0.581  -7.574   9.592
  185   1HG   GLU  20          1HG       GLU  20   1.981  -8.480  11.210
  186   2HG   GLU  20          2HG       GLU  20   1.396  -9.914  10.376
  187    H    ALA  21           H        ALA  21  -0.994  -7.323   7.512
  188    HA   ALA  21           HA       ALA  21  -3.174  -8.665   8.709
  189   1HB   ALA  21          1HB       ALA  21  -3.176  -6.307   7.988
  190   2HB   ALA  21          2HB       ALA  21  -3.211  -6.825   6.284
  191   3HB   ALA  21          3HB       ALA  21  -4.580  -7.185   7.353
  192    H    SER  22           H        SER  22  -1.926  -9.031   5.356
  193    HA   SER  22           HA       SER  22  -3.834 -10.947   4.444
  194   1HB   SER  22          1HB       SER  22  -2.140  -9.736   3.050
  195   2HB   SER  22          2HB       SER  22  -0.878 -10.772   3.740
  196    HG   SER  22           HG       SER  22  -1.686 -11.561   1.730
  197    H    GLU  23           H        GLU  23  -0.798 -11.439   6.339
  198    HA   GLU  23           HA       GLU  23  -0.959 -14.330   6.294
  199   1HB   GLU  23          1HB       GLU  23   1.075 -12.818   6.774
  200   2HB   GLU  23          2HB       GLU  23   0.435 -12.665   8.405
  201   1HG   GLU  23          1HG       GLU  23   0.469 -15.138   8.665
  202   2HG   GLU  23          2HG       GLU  23   1.084 -15.305   7.022
  203    H    LYS  24           H        LYS  24  -1.890 -11.866   8.676
  204    HA   LYS  24           HA       LYS  24  -3.016 -13.704  10.612
  205   1HB   LYS  24          1HB       LYS  24  -3.402 -10.709  10.213
  206   2HB   LYS  24          2HB       LYS  24  -4.060 -11.633  11.575
  207   1HG   LYS  24          1HG       LYS  24  -1.784 -12.382  12.199
  208   2HG   LYS  24          2HG       LYS  24  -1.096 -11.427  10.879
  209   1HD   LYS  24          1HD       LYS  24  -1.982  -9.352  11.912
  210   2HD   LYS  24          2HD       LYS  24  -2.665 -10.317  13.245
  211   1HE   LYS  24          1HE       LYS  24  -0.377 -11.168  13.775
  212   2HE   LYS  24          2HE       LYS  24   0.290 -10.178  12.474
  213   1HZ   LYS  24          1HZ       LYS  24  -0.487  -8.197  13.681
  214   2HZ   LYS  24          2HZ       LYS  24  -1.086  -9.122  14.890
  215   3HZ   LYS  24          3HZ       LYS  24   0.519  -9.075  14.617
  216    H    ALA  25           H        ALA  25  -4.487 -12.107   7.810
  217    HA   ALA  25           HA       ALA  25  -7.194 -12.965   8.238
  218   1HB   ALA  25          1HB       ALA  25  -6.687 -11.289   6.579
  219   2HB   ALA  25          2HB       ALA  25  -5.585 -12.382   5.722
  220   3HB   ALA  25          3HB       ALA  25  -7.314 -12.728   5.742
  221    H    ARG  26           H        ARG  26  -4.634 -14.481   6.292
  222    HA   ARG  26           HA       ARG  26  -4.722 -16.323   4.984
  223   1HB   ARG  26          1HB       ARG  26  -4.133 -18.279   6.108
  224   2HB   ARG  26          2HB       ARG  26  -3.436 -16.930   6.953
  225   1HG   ARG  26          1HG       ARG  26  -5.977 -18.311   7.942
  226   2HG   ARG  26          2HG       ARG  26  -4.359 -18.905   8.293
  227   1HD   ARG  26          1HD       ARG  26  -3.847 -16.587   9.267
  228   2HD   ARG  26          2HD       ARG  26  -5.575 -16.289   9.200
  229    HE   ARG  26           HE       ARG  26  -5.973 -17.928  10.847
  230   1HH1  ARG  26          1HH2      ARG  26  -2.530 -17.640  10.255
  231   2HH1  ARG  26          2HH2      ARG  26  -2.113 -18.464  11.734
  232   1HH2  ARG  26          1HH1      ARG  26  -5.370 -18.968  12.717
  233   2HH2  ARG  26          2HH1      ARG  26  -3.684 -19.188  13.087
  234    H    ASN  27           H        ASN  27  -7.403 -15.283   5.152
  235    HA   ASN  27           HA       ASN  27  -8.981 -17.742   4.516
  236   1HB   ASN  27          1HB       ASN  27  -9.451 -16.829   6.763
  237   2HB   ASN  27          2HB       ASN  27  -9.821 -15.253   6.072
  238   1HD2  ASN  27          2HD2      ASN  27 -11.338 -17.804   7.410
  239   2HD2  ASN  27          1HD2      ASN  27 -12.827 -17.754   6.477
  240    HA   PRO  28           HA       PRO  28  -9.351 -15.652   0.642
  241   1HB   PRO  28          1HB       PRO  28 -11.353 -17.059  -0.598
  242   2HB   PRO  28          2HB       PRO  28  -9.711 -17.702  -0.296
  243   1HG   PRO  28          1HG       PRO  28 -12.204 -18.109   1.385
  244   2HG   PRO  28          2HG       PRO  28 -11.049 -19.351   0.797
  245   1HD   PRO  28          1HD       PRO  28 -10.872 -18.336   3.297
  246   2HD   PRO  28          2HD       PRO  28  -9.394 -18.672   2.347
  247    H    GLU  29           H        GLU  29 -12.158 -15.708   2.759
  248    HA   GLU  29           HA       GLU  29 -13.967 -14.129   1.215
  249   1HB   GLU  29          1HB       GLU  29 -14.062 -15.485   3.550
  250   2HB   GLU  29          2HB       GLU  29 -13.924 -13.877   4.216
  251   1HG   GLU  29          1HG       GLU  29 -16.026 -14.783   2.185
  252   2HG   GLU  29          2HG       GLU  29 -16.265 -14.808   3.923
  253    H    LYS  30           H        LYS  30 -11.264 -13.260   3.163
  254    HA   LYS  30           HA       LYS  30 -11.586 -10.363   2.533
  255   1HB   LYS  30          1HB       LYS  30 -10.639  -9.778   4.644
  256   2HB   LYS  30          2HB       LYS  30 -11.943 -10.941   4.918
  257   1HG   LYS  30          1HG       LYS  30 -10.015 -12.733   4.886
  258   2HG   LYS  30          2HG       LYS  30  -8.955 -11.344   5.117
  259   1HD   LYS  30          1HD       LYS  30 -11.196 -12.280   6.975
  260   2HD   LYS  30          2HD       LYS  30  -9.476 -12.521   7.202
  261   1HE   LYS  30          1HE       LYS  30  -9.655 -10.743   8.556
  262   2HE   LYS  30          2HE       LYS  30  -9.387  -9.851   7.057
  263   1HZ   LYS  30          1HZ       LYS  30 -11.835  -9.586   6.909
  264   2HZ   LYS  30          2HZ       LYS  30 -12.038 -10.437   8.292
  265   3HZ   LYS  30          3HZ       LYS  30 -11.284  -8.995   8.335
  266    H    LYS  31           H        LYS  31  -9.228 -13.015   2.483
  267    HA   LYS  31           HA       LYS  31  -7.048 -11.506   1.505
  268   1HB   LYS  31          1HB       LYS  31  -7.033 -13.888   2.265
  269   2HB   LYS  31          2HB       LYS  31  -7.685 -14.332   0.678
  270   1HG   LYS  31          1HG       LYS  31  -5.706 -13.431  -0.433
  271   2HG   LYS  31          2HG       LYS  31  -5.109 -12.753   1.096
  272   1HD   LYS  31          1HD       LYS  31  -4.864 -15.030   2.022
  273   2HD   LYS  31          2HD       LYS  31  -5.484 -15.720   0.502
  274   1HE   LYS  31          1HE       LYS  31  -3.607 -14.649  -0.738
  275   2HE   LYS  31          2HE       LYS  31  -2.993 -13.969   0.775
  276   1HZ   LYS  31          1HZ       LYS  31  -2.630 -16.237   1.577
  277   2HZ   LYS  31          2HZ       LYS  31  -3.218 -16.877   0.190
  278   3HZ   LYS  31          3HZ       LYS  31  -1.832 -16.019   0.172
  279    H    SER  32           H        SER  32  -9.993 -12.276  -0.121
  280    HA   SER  32           HA       SER  32  -8.946 -11.161  -2.679
  281   1HB   SER  32          1HB       SER  32 -10.258 -13.409  -2.432
  282   2HB   SER  32          2HB       SER  32 -11.693 -12.380  -2.290
  283    HG   SER  32           HG       SER  32 -11.251 -13.025  -4.464
  284    H    VAL  33           H        VAL  33  -9.987  -9.721  -0.042
  285    HA   VAL  33           HA       VAL  33 -11.498  -7.586  -1.527
  286    HB   VAL  33           HB       VAL  33 -11.622  -8.262   1.431
  287   1HG1  VAL  33          1HG1      VAL  33 -11.783  -5.832   1.174
  288   2HG1  VAL  33          2HG1      VAL  33 -12.945  -6.015  -0.158
  289   3HG1  VAL  33          3HG1      VAL  33 -13.390  -6.482   1.495
  290   1HG2  VAL  33          1HG2      VAL  33 -13.743  -8.369  -0.767
  291   2HG2  VAL  33          2HG2      VAL  33 -12.963  -9.778  -0.019
  292   3HG2  VAL  33          3HG2      VAL  33 -13.997  -8.731   0.956
  293    H    LEU  34           H        LEU  34  -8.906  -8.138   1.020
  294    HA   LEU  34           HA       LEU  34  -8.022  -5.393   0.763
  295   1HB   LEU  34          1HB       LEU  34  -6.540  -5.823   2.346
  296   2HB   LEU  34          2HB       LEU  34  -7.683  -7.103   2.721
  297    HG   LEU  34           HG       LEU  34  -5.188  -7.330   1.094
  298   1HD1  LEU  34          1HD1      LEU  34  -4.884  -6.949   3.619
  299   2HD1  LEU  34          2HD1      LEU  34  -5.700  -8.478   3.889
  300   3HD1  LEU  34          3HD1      LEU  34  -4.150  -8.443   3.018
  301   1HD2  LEU  34          1HD2      LEU  34  -6.890  -9.546   2.217
  302   2HD2  LEU  34          2HD2      LEU  34  -6.782  -9.121   0.492
  303   3HD2  LEU  34          3HD2      LEU  34  -5.366  -9.772   1.324
  304    H    GLN  35           H        GLN  35  -7.624  -8.119  -1.351
  305    HA   GLN  35           HA       GLN  35  -5.185  -7.354  -2.583
  306   1HB   GLN  35          1HB       GLN  35  -6.255  -9.571  -2.759
  307   2HB   GLN  35          2HB       GLN  35  -7.561  -8.878  -3.724
  308   1HG   GLN  35          1HG       GLN  35  -5.930 -10.039  -5.132
  309   2HG   GLN  35          2HG       GLN  35  -5.962  -8.327  -5.523
  310   1HE2  GLN  35          2HE2      GLN  35  -4.026  -7.125  -5.263
  311   2HE2  GLN  35          1HE2      GLN  35  -2.520  -7.886  -4.737
  312    H    LYS  36           H        LYS  36  -8.519  -6.196  -3.227
  313    HA   LYS  36           HA       LYS  36  -7.768  -4.723  -5.640
  314   1HB   LYS  36          1HB       LYS  36 -10.181  -4.676  -3.779
  315   2HB   LYS  36          2HB       LYS  36  -9.942  -3.431  -5.014
  316   1HG   LYS  36          1HG       LYS  36  -9.853  -5.101  -6.788
  317   2HG   LYS  36          2HG       LYS  36 -10.104  -6.406  -5.606
  318   1HD   LYS  36          1HD       LYS  36 -12.330  -5.617  -5.085
  319   2HD   LYS  36          2HD       LYS  36 -12.046  -4.074  -5.890
  320   1HE   LYS  36          1HE       LYS  36 -13.488  -5.388  -7.282
  321   2HE   LYS  36          2HE       LYS  36 -11.932  -5.167  -8.084
  322   1HZ   LYS  36          1HZ       LYS  36 -11.336  -7.432  -7.411
  323   2HZ   LYS  36          2HZ       LYS  36 -12.764  -7.628  -6.632
  324   3HZ   LYS  36          3HZ       LYS  36 -12.730  -7.458  -8.254
  325    H    ILE  37           H        ILE  37  -7.944  -3.829  -2.196
  326    HA   ILE  37           HA       ILE  37  -7.070  -1.070  -2.569
  327    HB   ILE  37           HB       ILE  37  -6.874  -3.064  -0.294
  328   1HG1  ILE  37          1HG1      ILE  37  -8.288  -0.465   0.051
  329   2HG1  ILE  37          2HG1      ILE  37  -9.044  -1.661  -0.966
  330   1HG2  ILE  37          1HG2      ILE  37  -4.932  -1.604   0.024
  331   2HG2  ILE  37          2HG2      ILE  37  -5.899  -0.171  -0.421
  332   3HG2  ILE  37          3HG2      ILE  37  -6.190  -1.000   1.105
  333   1HD1  ILE  37          1HD1      ILE  37  -9.071  -3.294   0.842
  334   2HD1  ILE  37          2HD1      ILE  37  -8.116  -2.213   1.879
  335   3HD1  ILE  37          3HD1      ILE  37  -9.770  -1.771   1.429
  336    H    LEU  38           H        LEU  38  -5.175  -4.147  -1.959
  337    HA   LEU  38           HA       LEU  38  -2.637  -2.979  -2.120
  338   1HB   LEU  38          1HB       LEU  38  -3.632  -5.705  -2.995
  339   2HB   LEU  38          2HB       LEU  38  -1.943  -5.266  -3.126
  340    HG   LEU  38           HG       LEU  38  -3.481  -5.248  -0.492
  341   1HD1  LEU  38          1HD1      LEU  38  -3.272  -7.538  -1.426
  342   2HD1  LEU  38          2HD1      LEU  38  -1.523  -7.297  -1.617
  343   3HD1  LEU  38          3HD1      LEU  38  -2.258  -7.321   0.002
  344   1HD2  LEU  38          1HD2      LEU  38  -0.546  -4.901  -1.225
  345   2HD2  LEU  38          2HD2      LEU  38  -1.597  -3.784  -0.310
  346   3HD2  LEU  38          3HD2      LEU  38  -1.092  -5.317   0.402
  347    H    GLU  39           H        GLU  39  -4.665  -3.919  -4.956
  348    HA   GLU  39           HA       GLU  39  -2.593  -3.103  -6.819
  349   1HB   GLU  39          1HB       GLU  39  -5.572  -3.703  -7.131
  350   2HB   GLU  39          2HB       GLU  39  -4.531  -3.258  -8.487
  351   1HG   GLU  39          1HG       GLU  39  -3.093  -5.210  -8.084
  352   2HG   GLU  39          2HG       GLU  39  -4.059  -5.668  -6.683
  353    H    ASP  40           H        ASP  40  -5.386  -1.358  -5.459
  354    HA   ASP  40           HA       ASP  40  -5.090   1.086  -6.991
  355   1HB   ASP  40          1HB       ASP  40  -6.292   0.104  -4.375
  356   2HB   ASP  40          2HB       ASP  40  -6.166   1.785  -4.630
  357    H    GLU  41           H        GLU  41  -3.558  -0.169  -3.980
  358    HA   GLU  41           HA       GLU  41  -2.239   2.403  -3.452
  359   1HB   GLU  41          1HB       GLU  41  -1.572  -0.316  -2.280
  360   2HB   GLU  41          2HB       GLU  41  -0.949   1.230  -1.736
  361   1HG   GLU  41          1HG       GLU  41  -3.750   0.147  -1.367
  362   2HG   GLU  41          2HG       GLU  41  -2.545   0.452  -0.153
  363    H    GLU  42           H        GLU  42  -1.339  -0.609  -5.127
  364    HA   GLU  42           HA       GLU  42   1.358   0.136  -5.722
  365   1HB   GLU  42          1HB       GLU  42   0.399  -2.136  -6.004
  366   2HB   GLU  42          2HB       GLU  42  -0.541  -1.561  -7.387
  367   1HG   GLU  42          1HG       GLU  42   1.533  -1.035  -8.606
  368   2HG   GLU  42          2HG       GLU  42   2.499  -1.455  -7.189
  369    H    LYS  43           H        LYS  43  -1.701   1.024  -7.366
  370    HA   LYS  43           HA       LYS  43  -0.391   2.446  -9.526
  371   1HB   LYS  43          1HB       LYS  43  -2.957   1.711  -9.188
  372   2HB   LYS  43          2HB       LYS  43  -3.120   3.344  -8.604
  373   1HG   LYS  43          1HG       LYS  43  -3.600   3.480 -10.890
  374   2HG   LYS  43          2HG       LYS  43  -1.901   3.984 -10.841
  375   1HD   LYS  43          1HD       LYS  43  -1.208   1.692 -11.522
  376   2HD   LYS  43          2HD       LYS  43  -2.907   1.178 -11.500
  377   1HE   LYS  43          1HE       LYS  43  -3.416   2.920 -13.234
  378   2HE   LYS  43          2HE       LYS  43  -1.693   3.315 -13.308
  379   1HZ   LYS  43          1HZ       LYS  43  -1.276   1.013 -14.022
  380   2HZ   LYS  43          2HZ       LYS  43  -2.871   0.662 -13.957
  381   3HZ   LYS  43          3HZ       LYS  43  -2.316   1.739 -15.048
  382    H    HIS  44           H        HIS  44  -1.539   3.551  -6.259
  383    HA   HIS  44           HA       HIS  44  -0.851   6.244  -6.566
  384   1HB   HIS  44          1HB       HIS  44  -0.693   4.484  -4.076
  385   2HB   HIS  44          2HB       HIS  44  -0.834   6.204  -4.197
  386    HD2  HIS  44           2HD      HIS  44  -3.236   5.409  -6.658
  387    HE1  HIS  44           1HE      HIS  44  -5.522   4.787  -3.151
  388    HE2  HIS  44           2HE      HIS  44  -5.592   4.961  -5.685
  389    H    ILE  45           H        ILE  45   1.143   3.486  -5.406
  390    HA   ILE  45           HA       ILE  45   3.579   4.976  -5.094
  391    HB   ILE  45           HB       ILE  45   2.739   2.098  -5.171
  392   1HG1  ILE  45          1HG1      ILE  45   4.251   2.023  -3.162
  393   2HG1  ILE  45          2HG1      ILE  45   4.640   3.718  -3.435
  394   1HG2  ILE  45          1HG2      ILE  45   4.585   1.904  -6.744
  395   2HG2  ILE  45          2HG2      ILE  45   5.647   2.839  -5.658
  396   3HG2  ILE  45          3HG2      ILE  45   5.047   1.235  -5.185
  397   1HD1  ILE  45          1HD1      ILE  45   2.268   4.325  -2.976
  398   2HD1  ILE  45          2HD1      ILE  45   1.908   2.600  -2.708
  399   3HD1  ILE  45          3HD1      ILE  45   3.021   3.455  -1.632
  400    H    GLU  46           H        GLU  46   2.284   3.291  -8.039
  401    HA   GLU  46           HA       GLU  46   4.479   3.814  -9.746
  402   1HB   GLU  46          1HB       GLU  46   1.519   3.486 -10.113
  403   2HB   GLU  46          2HB       GLU  46   2.354   4.309 -11.405
  404   1HG   GLU  46          1HG       GLU  46   3.005   1.552 -10.369
  405   2HG   GLU  46          2HG       GLU  46   2.039   1.943 -11.801
  406    H    TRP  47           H        TRP  47   1.725   5.982  -8.966
  407    HA   TRP  47           HA       TRP  47   2.693   8.065 -10.688
  408   1HB   TRP  47          1HB       TRP  47   0.754   8.224  -8.332
  409   2HB   TRP  47          2HB       TRP  47   0.894   9.367  -9.640
  410    HD1  TRP  47           1HD      TRP  47   0.728   6.946 -11.960
  411    HE1  TRP  47           1HE      TRP  47  -1.678   6.047 -12.482
  412    HE3  TRP  47           3HE      TRP  47  -1.715   8.369  -7.701
  413    HZ2  TRP  47           2HZ      TRP  47  -4.188   5.858 -11.211
  414    HZ3  TRP  47           3HZ      TRP  47  -4.109   7.742  -7.350
  415    HH2  TRP  47           2HH      TRP  47  -5.331   6.450  -9.072
  416    H    LEU  48           H        LEU  48   2.920   7.485  -7.182
  417    HA   LEU  48           HA       LEU  48   4.276   9.869  -6.430
  418   1HB   LEU  48          1HB       LEU  48   4.104   7.009  -5.437
  419   2HB   LEU  48          2HB       LEU  48   5.160   8.093  -4.616
  420    HG   LEU  48           HG       LEU  48   2.208   8.689  -5.030
  421   1HD1  LEU  48          1HD1      LEU  48   1.944   7.981  -2.649
  422   2HD1  LEU  48          2HD1      LEU  48   2.419   6.648  -3.707
  423   3HD1  LEU  48          3HD1      LEU  48   3.632   7.408  -2.667
  424   1HD2  LEU  48          1HD2      LEU  48   4.241   9.847  -3.072
  425   2HD2  LEU  48          2HD2      LEU  48   3.578  10.685  -4.492
  426   3HD2  LEU  48          3HD2      LEU  48   2.516  10.258  -3.148
  427    H    GLU  49           H        GLU  49   5.670   6.749  -7.520
  428    HA   GLU  49           HA       GLU  49   8.395   7.804  -7.464
  429   1HB   GLU  49          1HB       GLU  49   7.242   5.251  -7.751
  430   2HB   GLU  49          2HB       GLU  49   7.963   5.545  -9.320
  431   1HG   GLU  49          1HG       GLU  49   9.346   5.724  -6.605
  432   2HG   GLU  49          2HG       GLU  49   9.462   4.372  -7.722
  433    H    THR  50           H        THR  50   5.906   7.611 -10.011
  434    HA   THR  50           HA       THR  50   7.486   8.661 -12.134
  435    HB   THR  50           HB       THR  50   4.517   8.874 -11.548
  436    HG1  THR  50           1HG      THR  50   5.115   6.812 -11.886
  437   1HG2  THR  50          1HG2      THR  50   5.012  10.595 -13.130
  438   2HG2  THR  50          2HG2      THR  50   6.035   9.478 -14.084
  439   3HG2  THR  50          3HG2      THR  50   4.267   9.223 -13.972
  440    H    ILE  51           H        ILE  51   5.747  10.344  -9.587
  441    HA   ILE  51           HA       ILE  51   6.380  13.004 -10.574
  442    HB   ILE  51           HB       ILE  51   5.131  11.957  -8.012
  443   1HG1  ILE  51          1HG1      ILE  51   3.806  11.838 -10.173
  444   2HG1  ILE  51          2HG1      ILE  51   3.055  12.726  -8.862
  445   1HG2  ILE  51          1HG2      ILE  51   6.135  14.058  -7.315
  446   2HG2  ILE  51          2HG2      ILE  51   5.531  14.890  -8.743
  447   3HG2  ILE  51          3HG2      ILE  51   4.404  14.294  -7.498
  448   1HD1  ILE  51          1HD1      ILE  51   3.549  14.855  -9.975
  449   2HD1  ILE  51          2HD1      ILE  51   4.482  14.011 -11.236
  450   3HD1  ILE  51          3HD1      ILE  51   2.734  13.758 -11.093
  451    H    ASN  52           H        ASN  52   8.173  10.796  -8.853
  452    HA   ASN  52           HA       ASN  52   9.953  12.586  -7.427
  453   1HB   ASN  52          1HB       ASN  52   9.435  10.203  -6.798
  454   2HB   ASN  52          2HB       ASN  52  10.363   9.683  -8.208
  455   1HD2  ASN  52          2HD2      ASN  52  11.810   8.503  -6.927
  456   2HD2  ASN  52          1HD2      ASN  52  13.025   9.336  -5.943
  457    H    GLY  53           H        GLY  53   9.807  13.584 -10.027
  458   1HA   GLY  53          1HA       GLY  53  12.266  14.500 -10.610
  459   2HA   GLY  53          2HA       GLY  53  12.316  12.972 -11.490
  460   1H    MET   1          1H        MET   1  -5.800  -8.917  19.432
  461   2H    MET   1          2H        MET   1  -6.488 -10.353  19.066
  462   3H    MET   1          3H        MET   1  -4.866 -10.253  19.294
  463    HA   MET   1           HA       MET   1  -4.620  -8.857  17.342
  464   1HB   MET   1          1HB       MET   1  -6.086 -11.486  16.841
  465   2HB   MET   1          2HB       MET   1  -5.348 -10.507  15.572
  466   1HG   MET   1          1HG       MET   1  -3.149 -10.682  16.729
  467   2HG   MET   1          2HG       MET   1  -3.868 -11.802  17.888
  468   1HE   MET   1          1HE       MET   1  -4.515 -14.271  17.402
  469   2HE   MET   1          2HE       MET   1  -5.727 -13.746  16.208
  470   3HE   MET   1          3HE       MET   1  -4.549 -15.004  15.785
  471    H    ASP   2           H        ASP   2  -5.512  -7.362  16.030
  472    HA   ASP   2           HA       ASP   2  -8.496  -7.238  15.720
  473   1HB   ASP   2          1HB       ASP   2  -6.650  -5.001  16.651
  474   2HB   ASP   2          2HB       ASP   2  -8.326  -4.783  16.159
  475    H    TYR   3           H        TYR   3  -5.458  -5.631  14.686
  476    HA   TYR   3           HA       TYR   3  -4.788  -4.766  12.727
  477   1HB   TYR   3          1HB       TYR   3  -4.225  -6.488  11.142
  478   2HB   TYR   3          2HB       TYR   3  -4.008  -7.042  12.783
  479    HD1  TYR   3           1HD      TYR   3  -5.804  -7.576   9.639
  480    HD2  TYR   3           2HD      TYR   3  -5.534  -8.752  13.775
  481    HE1  TYR   3           1HE      TYR   3  -7.247  -9.543   9.176
  482    HE2  TYR   3           2HE      TYR   3  -7.008 -10.708  13.317
  483    HH   TYR   3           HH       TYR   3  -8.275 -11.805  11.759
  484    H    LEU   4           H        LEU   4  -7.358  -3.819  13.009
  485    HA   LEU   4           HA       LEU   4  -7.798  -3.181  10.157
  486   1HB   LEU   4          1HB       LEU   4 -10.159  -3.251  10.238
  487   2HB   LEU   4          2HB       LEU   4  -9.490  -4.786  10.749
  488    HG   LEU   4           HG       LEU   4  -9.795  -3.658  13.183
  489   1HD1  LEU   4          1HD1      LEU   4 -10.846  -1.549  12.318
  490   2HD1  LEU   4          2HD1      LEU   4 -12.082  -2.511  11.512
  491   3HD1  LEU   4          3HD1      LEU   4 -11.983  -2.486  13.288
  492   1HD2  LEU   4          1HD2      LEU   4 -12.022  -5.009  11.601
  493   2HD2  LEU   4          2HD2      LEU   4 -10.720  -5.828  12.490
  494   3HD2  LEU   4          3HD2      LEU   4 -11.929  -4.891  13.376
  495    H    ARG   5           H        ARG   5  -8.525  -1.946  13.476
  496    HA   ARG   5           HA       ARG   5  -8.964   0.744  12.621
  497   1HB   ARG   5          1HB       ARG   5  -9.517  -0.324  14.881
  498   2HB   ARG   5          2HB       ARG   5  -7.816  -0.113  15.317
  499   1HG   ARG   5          1HG       ARG   5  -8.083   2.373  14.924
  500   2HG   ARG   5          2HG       ARG   5  -9.774   2.085  14.501
  501   1HD   ARG   5          1HD       ARG   5  -9.806   2.829  16.732
  502   2HD   ARG   5          2HD       ARG   5 -10.093   1.083  16.818
  503    HE   ARG   5           HE       ARG   5  -7.288   1.573  17.089
  504   1HH1  ARG   5          1HH2      ARG   5 -10.199   2.054  18.973
  505   2HH1  ARG   5          2HH2      ARG   5  -9.328   2.094  20.483
  506   1HH2  ARG   5          1HH1      ARG   5  -6.235   1.655  19.053
  507   2HH2  ARG   5          2HH1      ARG   5  -7.148   1.878  20.516
  508    H    GLU   6           H        GLU   6  -6.029  -0.959  13.459
  509    HA   GLU   6           HA       GLU   6  -4.158   1.134  13.487
  510   1HB   GLU   6          1HB       GLU   6  -3.954  -1.406  14.112
  511   2HB   GLU   6          2HB       GLU   6  -3.650  -1.683  12.416
  512   1HG   GLU   6          1HG       GLU   6  -1.525  -1.532  13.456
  513   2HG   GLU   6          2HG       GLU   6  -1.713  -0.014  12.586
  514    H    LEU   7           H        LEU   7  -5.135  -0.899  10.729
  515    HA   LEU   7           HA       LEU   7  -3.670   0.423   8.684
  516   1HB   LEU   7          1HB       LEU   7  -6.135  -1.384   8.745
  517   2HB   LEU   7          2HB       LEU   7  -5.453  -0.744   7.254
  518    HG   LEU   7           HG       LEU   7  -3.308  -1.797   7.736
  519   1HD1  LEU   7          1HD1      LEU   7  -3.192  -2.100  10.114
  520   2HD1  LEU   7          2HD1      LEU   7  -4.678  -3.085  10.115
  521   3HD1  LEU   7          3HD1      LEU   7  -3.183  -3.690   9.373
  522   1HD2  LEU   7          1HD2      LEU   7  -5.558  -3.840   7.896
  523   2HD2  LEU   7          2HD2      LEU   7  -5.223  -2.879   6.447
  524   3HD2  LEU   7          3HD2      LEU   7  -3.991  -3.986   7.055
  525    H    TYR   8           H        TYR   8  -7.142   0.670   9.545
  526    HA   TYR   8           HA       TYR   8  -8.056   2.537   7.652
  527   1HB   TYR   8          1HB       TYR   8  -9.145   1.161   9.683
  528   2HB   TYR   8          2HB       TYR   8  -8.812   2.544  10.639
  529    HD1  TYR   8           1HD      TYR   8  -9.725   4.252   7.790
  530    HD2  TYR   8           2HD      TYR   8 -11.402   1.492  10.659
  531    HE1  TYR   8           1HE      TYR   8 -11.965   5.200   7.404
  532    HE2  TYR   8           2HE      TYR   8 -13.669   2.427  10.218
  533    HH   TYR   8           HH       TYR   8 -14.189   5.157   7.954
  534    H    LYS   9           H        LYS   9  -6.811   3.296  10.908
  535    HA   LYS   9           HA       LYS   9  -6.912   6.073  10.574
  536   1HB   LYS   9          1HB       LYS   9  -6.531   4.648  12.686
  537   2HB   LYS   9          2HB       LYS   9  -4.810   4.657  12.294
  538   1HG   LYS   9          1HG       LYS   9  -4.607   6.980  12.741
  539   2HG   LYS   9          2HG       LYS   9  -6.290   7.290  12.326
  540   1HD   LYS   9          1HD       LYS   9  -6.422   7.592  14.537
  541   2HD   LYS   9          2HD       LYS   9  -6.892   5.907  14.458
  542   1HE   LYS   9          1HE       LYS   9  -4.090   6.949  15.139
  543   2HE   LYS   9          2HE       LYS   9  -5.321   6.532  16.328
  544   1HZ   LYS   9          1HZ       LYS   9  -5.285   4.240  15.459
  545   2HZ   LYS   9          2HZ       LYS   9  -4.054   4.624  14.442
  546   3HZ   LYS   9          3HZ       LYS   9  -3.834   4.688  16.052
  547    H    LEU  10           H        LEU  10  -4.040   4.101   9.777
  548    HA   LEU  10           HA       LEU  10  -2.631   6.338   8.756
  549   1HB   LEU  10          1HB       LEU  10  -2.306   3.370   8.598
  550   2HB   LEU  10          2HB       LEU  10  -1.430   4.335   7.410
  551    HG   LEU  10           HG       LEU  10  -1.313   5.017  10.366
  552   1HD1  LEU  10          1HD1      LEU  10  -0.553   2.757  10.237
  553   2HD1  LEU  10          2HD1      LEU  10   0.479   3.103   8.824
  554   3HD1  LEU  10          3HD1      LEU  10   0.865   3.791  10.423
  555   1HD2  LEU  10          1HD2      LEU  10   0.607   5.544   8.041
  556   2HD2  LEU  10          2HD2      LEU  10  -0.484   6.746   8.758
  557   3HD2  LEU  10          3HD2      LEU  10   0.835   6.074   9.721
  558    H    GLU  11           H        GLU  11  -4.823   4.041   7.197
  559    HA   GLU  11           HA       GLU  11  -4.851   5.079   4.554
  560   1HB   GLU  11          1HB       GLU  11  -6.530   3.411   6.330
  561   2HB   GLU  11          2HB       GLU  11  -7.479   4.128   5.131
  562   1HG   GLU  11          1HG       GLU  11  -4.923   2.468   4.710
  563   2HG   GLU  11          2HG       GLU  11  -6.562   1.845   4.620
  564    H    GLN  12           H        GLN  12  -6.614   6.348   7.481
  565    HA   GLN  12           HA       GLN  12  -7.751   8.535   5.949
  566   1HB   GLN  12          1HB       GLN  12  -7.709   7.742   8.860
  567   2HB   GLN  12          2HB       GLN  12  -8.415   9.266   8.287
  568   1HG   GLN  12          1HG       GLN  12  -9.828   8.041   6.694
  569   2HG   GLN  12          2HG       GLN  12  -9.214   6.512   7.281
  570   1HE2  GLN  12          2HE2      GLN  12 -11.963   8.199   7.442
  571   2HE2  GLN  12          1HE2      GLN  12 -12.419   7.909   9.114
  572    H    GLN  13           H        GLN  13  -4.865   8.174   7.903
  573    HA   GLN  13           HA       GLN  13  -4.224  11.003   8.105
  574   1HB   GLN  13          1HB       GLN  13  -2.491   8.485   8.066
  575   2HB   GLN  13          2HB       GLN  13  -1.801  10.084   8.257
  576   1HG   GLN  13          1HG       GLN  13  -3.993   9.300  10.175
  577   2HG   GLN  13          2HG       GLN  13  -2.416   8.535  10.347
  578   1HE2  GLN  13          2HE2      GLN  13  -0.691   9.741  11.244
  579   2HE2  GLN  13          1HE2      GLN  13  -0.889  11.414  11.742
  580    H    ALA  14           H        ALA  14  -3.710   8.598   5.531
  581    HA   ALA  14           HA       ALA  14  -2.231  10.412   3.795
  582   1HB   ALA  14          1HB       ALA  14  -2.125   7.945   3.572
  583   2HB   ALA  14          2HB       ALA  14  -3.863   7.892   3.199
  584   3HB   ALA  14          3HB       ALA  14  -2.736   8.702   2.089
  585    H    MET  15           H        MET  15  -5.716   9.529   4.189
  586    HA   MET  15           HA       MET  15  -6.711  11.214   2.075
  587   1HB   MET  15          1HB       MET  15  -7.960   9.355   3.291
  588   2HB   MET  15          2HB       MET  15  -8.021  10.391   4.709
  589   1HG   MET  15          1HG       MET  15 -10.062  10.816   3.962
  590   2HG   MET  15          2HG       MET  15  -9.250  12.078   3.056
  591   1HE   MET  15          1HE       MET  15  -8.727  11.987   0.562
  592   2HE   MET  15          2HE       MET  15  -7.943  10.383   0.500
  593   3HE   MET  15          3HE       MET  15  -9.309  10.749  -0.567
  594    H    LYS  16           H        LYS  16  -6.077  11.963   5.550
  595    HA   LYS  16           HA       LYS  16  -7.024  14.678   5.378
  596   1HB   LYS  16          1HB       LYS  16  -6.366  13.040   7.445
  597   2HB   LYS  16          2HB       LYS  16  -4.822  13.851   7.281
  598   1HG   LYS  16          1HG       LYS  16  -6.019  15.085   8.915
  599   2HG   LYS  16          2HG       LYS  16  -6.079  16.069   7.461
  600   1HD   LYS  16          1HD       LYS  16  -8.261  16.108   8.522
  601   2HD   LYS  16          2HD       LYS  16  -8.393  15.243   7.003
  602   1HE   LYS  16          1HE       LYS  16  -9.691  14.037   8.585
  603   2HE   LYS  16          2HE       LYS  16  -8.257  13.062   8.273
  604   1HZ   LYS  16          1HZ       LYS  16  -7.321  13.925  10.374
  605   2HZ   LYS  16          2HZ       LYS  16  -8.659  14.828  10.636
  606   3HZ   LYS  16          3HZ       LYS  16  -8.757  13.202  10.650
  607    H    LEU  17           H        LEU  17  -3.792  13.238   4.952
  608    HA   LEU  17           HA       LEU  17  -2.425  15.643   4.237
  609   1HB   LEU  17          1HB       LEU  17  -2.003  12.723   4.052
  610   2HB   LEU  17          2HB       LEU  17  -1.318  13.545   2.695
  611    HG   LEU  17           HG       LEU  17  -0.781  14.341   5.592
  612   1HD1  LEU  17          1HD1      LEU  17   0.006  12.051   5.124
  613   2HD1  LEU  17          2HD1      LEU  17   0.915  12.644   3.714
  614   3HD1  LEU  17          3HD1      LEU  17   1.358  13.171   5.353
  615   1HD2  LEU  17          1HD2      LEU  17   0.701  15.034   3.010
  616   2HD2  LEU  17          2HD2      LEU  17  -0.298  16.156   3.955
  617   3HD2  LEU  17          3HD2      LEU  17   1.190  15.504   4.651
  618    H    TYR  18           H        TYR  18  -4.375  13.397   2.214
  619    HA   TYR  18           HA       TYR  18  -3.832  14.718  -0.247
  620   1HB   TYR  18          1HB       TYR  18  -5.706  12.604   0.774
  621   2HB   TYR  18          2HB       TYR  18  -6.113  13.282  -0.748
  622    HD1  TYR  18           1HD      TYR  18  -3.756  13.635  -2.288
  623    HD2  TYR  18           2HD      TYR  18  -4.583  10.522   0.561
  624    HE1  TYR  18           1HE      TYR  18  -1.826  12.319  -3.162
  625    HE2  TYR  18           2HE      TYR  18  -2.633   9.231  -0.276
  626    HH   TYR  18           HH       TYR  18  -0.832   9.204  -1.704
  627    H    ARG  19           H        ARG  19  -6.311  15.424   2.178
  628    HA   ARG  19           HA       ARG  19  -7.732  17.403   0.588
  629   1HB   ARG  19          1HB       ARG  19  -7.491  16.682   3.495
  630   2HB   ARG  19          2HB       ARG  19  -7.898  18.355   3.154
  631   1HG   ARG  19          1HG       ARG  19  -9.918  17.099   3.466
  632   2HG   ARG  19          2HG       ARG  19  -9.822  17.686   1.805
  633   1HD   ARG  19          1HD       ARG  19  -9.096  15.429   1.051
  634   2HD   ARG  19          2HD       ARG  19  -9.194  14.838   2.710
  635    HE   ARG  19           HE       ARG  19 -11.415  15.461   0.870
  636   1HH1  ARG  19          1HH2      ARG  19 -10.648  14.729   4.210
  637   2HH1  ARG  19          2HH2      ARG  19 -12.304  14.350   4.599
  638   1HH2  ARG  19          1HH1      ARG  19 -13.502  14.991   1.444
  639   2HH2  ARG  19          2HH1      ARG  19 -13.870  14.496   3.069
  640    H    GLU  20           H        GLU  20  -4.895  17.736   2.747
  641    HA   GLU  20           HA       GLU  20  -4.716  20.611   2.265
  642   1HB   GLU  20          1HB       GLU  20  -3.953  18.810   4.240
  643   2HB   GLU  20          2HB       GLU  20  -2.420  19.133   3.477
  644   1HG   GLU  20          1HG       GLU  20  -4.339  21.249   4.562
  645   2HG   GLU  20          2HG       GLU  20  -3.003  20.566   5.473
  646    H    ALA  21           H        ALA  21  -2.945  17.772   1.151
  647    HA   ALA  21           HA       ALA  21  -0.861  18.908  -0.331
  648   1HB   ALA  21          1HB       ALA  21  -1.236  16.460   0.064
  649   2HB   ALA  21          2HB       ALA  21  -2.620  16.508  -1.033
  650   3HB   ALA  21          3HB       ALA  21  -0.986  16.815  -1.658
  651    H    SER  22           H        SER  22  -4.272  18.485  -1.279
  652    HA   SER  22           HA       SER  22  -4.047  19.497  -3.935
  653   1HB   SER  22          1HB       SER  22  -6.009  18.276  -2.893
  654   2HB   SER  22          2HB       SER  22  -6.429  19.777  -2.050
  655    HG   SER  22           HG       SER  22  -7.514  19.395  -4.099
  656    H    GLU  23           H        GLU  23  -4.509  21.281  -0.825
  657    HA   GLU  23           HA       GLU  23  -4.747  23.860  -2.171
  658   1HB   GLU  23          1HB       GLU  23  -5.559  23.160   0.195
  659   2HB   GLU  23          2HB       GLU  23  -3.896  23.436   0.700
  660   1HG   GLU  23          1HG       GLU  23  -4.000  25.761  -0.163
  661   2HG   GLU  23          2HG       GLU  23  -5.656  25.492  -0.709
  662    H    LYS  24           H        LYS  24  -2.122  22.159  -0.493
  663    HA   LYS  24           HA       LYS  24  -0.199  24.237  -0.961
  664   1HB   LYS  24          1HB       LYS  24  -0.271  22.256   0.771
  665   2HB   LYS  24          2HB       LYS  24   0.634  21.375  -0.454
  666   1HG   LYS  24          1HG       LYS  24   2.554  22.540   0.013
  667   2HG   LYS  24          2HG       LYS  24   1.734  24.097  -0.007
  668   1HD   LYS  24          1HD       LYS  24   0.891  23.756   2.272
  669   2HD   LYS  24          2HD       LYS  24   1.668  22.164   2.349
  670   1HE   LYS  24          1HE       LYS  24   3.888  23.222   2.065
  671   2HE   LYS  24          2HE       LYS  24   3.127  24.811   1.918
  672   1HZ   LYS  24          1HZ       LYS  24   2.300  24.561   4.194
  673   2HZ   LYS  24          2HZ       LYS  24   2.993  23.088   4.337
  674   3HZ   LYS  24          3HZ       LYS  24   3.925  24.419   4.180
  675    H    ALA  25           H        ALA  25  -1.167  21.563  -3.048
  676    HA   ALA  25           HA       ALA  25   0.885  21.958  -5.062
  677   1HB   ALA  25          1HB       ALA  25  -0.538  19.958  -5.049
  678   2HB   ALA  25          2HB       ALA  25  -1.991  20.955  -5.286
  679   3HB   ALA  25          3HB       ALA  25  -0.748  20.885  -6.546
  680    H    ARG  26           H        ARG  26  -2.386  23.315  -4.671
  681    HA   ARG  26           HA       ARG  26  -3.624  24.577  -6.112
  682   1HB   ARG  26          1HB       ARG  26  -3.194  26.887  -5.941
  683   2HB   ARG  26          2HB       ARG  26  -2.862  26.109  -4.421
  684   1HG   ARG  26          1HG       ARG  26  -0.570  26.706  -6.332
  685   2HG   ARG  26          2HG       ARG  26  -1.287  27.992  -5.363
  686   1HD   ARG  26          1HD       ARG  26  -0.834  26.745  -3.290
  687   2HD   ARG  26          2HD       ARG  26  -0.076  25.456  -4.191
  688    HE   ARG  26           HE       ARG  26   1.059  28.065  -3.566
  689   1HH1  ARG  26          1HH2      ARG  26   1.415  25.331  -5.769
  690   2HH1  ARG  26          2HH2      ARG  26   3.082  25.729  -6.095
  691   1HH2  ARG  26          1HH1      ARG  26   3.177  28.482  -4.050
  692   2HH2  ARG  26          2HH1      ARG  26   4.041  27.457  -5.157
  693    H    ASN  27           H        ASN  27  -1.828  22.926  -7.644
  694    HA   ASN  27           HA       ASN  27  -1.580  24.506 -10.172
  695   1HB   ASN  27          1HB       ASN  27   0.542  23.884  -9.028
  696   2HB   ASN  27          2HB       ASN  27   0.084  22.187  -9.096
  697   1HD2  ASN  27          2HD2      ASN  27   1.408  21.223 -10.628
  698   2HD2  ASN  27          1HD2      ASN  27   1.758  21.943 -12.190
  699    HA   PRO  28           HA       PRO  28  -4.870  21.886 -11.383
  700   1HB   PRO  28          1HB       PRO  28  -4.970  22.205 -14.118
  701   2HB   PRO  28          2HB       PRO  28  -5.469  23.437 -12.920
  702   1HG   PRO  28          1HG       PRO  28  -2.806  23.199 -14.347
  703   2HG   PRO  28          2HG       PRO  28  -3.829  24.658 -14.144
  704   1HD   PRO  28          1HD       PRO  28  -1.730  24.187 -12.524
  705   2HD   PRO  28          2HD       PRO  28  -3.249  24.854 -11.854
  706    H    GLU  29           H        GLU  29  -1.786  21.232 -12.999
  707    HA   GLU  29           HA       GLU  29  -2.370  18.641 -14.059
  708   1HB   GLU  29          1HB       GLU  29  -0.328  20.106 -14.449
  709   2HB   GLU  29          2HB       GLU  29   0.278  19.593 -12.884
  710   1HG   GLU  29          1HG       GLU  29   0.300  17.238 -13.617
  711   2HG   GLU  29          2HG       GLU  29  -0.432  17.688 -15.158
  712    H    LYS  30           H        LYS  30  -1.101  19.640 -10.968
  713    HA   LYS  30           HA       LYS  30  -0.858  17.046  -9.731
  714   1HB   LYS  30          1HB       LYS  30  -0.218  19.688  -8.998
  715   2HB   LYS  30          2HB       LYS  30  -1.483  19.251  -7.859
  716   1HG   LYS  30          1HG       LYS  30   1.117  17.745  -8.362
  717   2HG   LYS  30          2HG       LYS  30   0.777  18.798  -6.990
  718   1HD   LYS  30          1HD       LYS  30  -0.899  17.240  -6.120
  719   2HD   LYS  30          2HD       LYS  30  -0.777  16.241  -7.575
  720   1HE   LYS  30          1HE       LYS  30   0.489  15.113  -5.962
  721   2HE   LYS  30          2HE       LYS  30   1.626  15.834  -7.108
  722   1HZ   LYS  30          1HZ       LYS  30   2.052  17.597  -5.488
  723   2HZ   LYS  30          2HZ       LYS  30   0.960  16.972  -4.436
  724   3HZ   LYS  30          3HZ       LYS  30   2.336  16.157  -4.777
  725    H    LYS  31           H        LYS  31  -3.505  19.430  -9.700
  726    HA   LYS  31           HA       LYS  31  -5.415  17.975  -8.181
  727   1HB   LYS  31          1HB       LYS  31  -5.280  20.313 -10.038
  728   2HB   LYS  31          2HB       LYS  31  -6.821  19.532 -10.041
  729   1HG   LYS  31          1HG       LYS  31  -6.891  21.338  -8.532
  730   2HG   LYS  31          2HG       LYS  31  -7.010  19.855  -7.581
  731   1HD   LYS  31          1HD       LYS  31  -4.894  20.157  -6.605
  732   2HD   LYS  31          2HD       LYS  31  -4.284  21.097  -7.968
  733   1HE   LYS  31          1HE       LYS  31  -4.565  22.540  -6.045
  734   2HE   LYS  31          2HE       LYS  31  -5.637  23.030  -7.363
  735   1HZ   LYS  31          1HZ       LYS  31  -7.473  21.965  -6.192
  736   2HZ   LYS  31          2HZ       LYS  31  -6.475  21.398  -5.028
  737   3HZ   LYS  31          3HZ       LYS  31  -6.741  23.007  -5.166
  738    H    SER  32           H        SER  32  -4.166  16.949 -11.133
  739    HA   SER  32           HA       SER  32  -6.508  15.129 -11.449
  740   1HB   SER  32          1HB       SER  32  -6.029  16.937 -13.289
  741   2HB   SER  32          2HB       SER  32  -4.653  15.917 -13.721
  742    HG   SER  32           HG       SER  32  -7.441  15.286 -13.749
  743    H    VAL  33           H        VAL  33  -3.606  15.131 -10.152
  744    HA   VAL  33           HA       VAL  33  -3.096  12.253 -10.840
  745    HB   VAL  33           HB       VAL  33  -1.112  14.386  -9.942
  746   1HG1  VAL  33          1HG1      VAL  33  -0.498  12.268  -8.865
  747   2HG1  VAL  33          2HG1      VAL  33  -0.675  11.401 -10.408
  748   3HG1  VAL  33          3HG1      VAL  33   0.614  12.605 -10.188
  749   1HG2  VAL  33          1HG2      VAL  33  -1.639  14.465 -12.367
  750   2HG2  VAL  33          2HG2      VAL  33   0.011  13.905 -12.087
  751   3HG2  VAL  33          3HG2      VAL  33  -1.262  12.737 -12.506
  752    H    LEU  34           H        LEU  34  -3.231  14.695  -8.086
  753    HA   LEU  34           HA       LEU  34  -3.209  12.429  -6.234
  754   1HB   LEU  34          1HB       LEU  34  -2.782  13.852  -4.650
  755   2HB   LEU  34          2HB       LEU  34  -2.226  14.880  -5.951
  756    HG   LEU  34           HG       LEU  34  -4.973  14.942  -4.731
  757   1HD1  LEU  34          1HD1      LEU  34  -4.280  16.834  -3.395
  758   2HD1  LEU  34          2HD1      LEU  34  -3.102  15.551  -3.121
  759   3HD1  LEU  34          3HD1      LEU  34  -2.689  16.895  -4.194
  760   1HD2  LEU  34          1HD2      LEU  34  -3.625  17.090  -6.390
  761   2HD2  LEU  34          2HD2      LEU  34  -4.932  16.018  -6.951
  762   3HD2  LEU  34          3HD2      LEU  34  -5.239  17.185  -5.658
  763    H    GLN  35           H        GLN  35  -5.586  14.029  -8.165
  764    HA   GLN  35           HA       GLN  35  -7.893  13.605  -6.531
  765   1HB   GLN  35          1HB       GLN  35  -7.677  15.083  -8.513
  766   2HB   GLN  35          2HB       GLN  35  -7.702  13.656  -9.567
  767   1HG   GLN  35          1HG       GLN  35  -9.972  13.098  -8.509
  768   2HG   GLN  35          2HG       GLN  35  -9.894  14.668  -7.701
  769   1HE2  GLN  35          2HE2      GLN  35  -8.800  16.252  -9.956
  770   2HE2  GLN  35          1HE2      GLN  35 -10.097  16.270 -11.142
  771    H    LYS  36           H        LYS  36  -6.297  11.470  -8.992
  772    HA   LYS  36           HA       LYS  36  -8.367   9.439  -8.725
  773   1HB   LYS  36          1HB       LYS  36  -5.503   9.281  -9.815
  774   2HB   LYS  36          2HB       LYS  36  -6.692   7.971  -9.910
  775   1HG   LYS  36          1HG       LYS  36  -8.196   9.368 -11.249
  776   2HG   LYS  36          2HG       LYS  36  -7.035  10.709 -11.197
  777   1HD   LYS  36          1HD       LYS  36  -5.346   9.355 -12.343
  778   2HD   LYS  36          2HD       LYS  36  -6.410   7.946 -12.353
  779   1HE   LYS  36          1HE       LYS  36  -7.053  10.598 -13.724
  780   2HE   LYS  36          2HE       LYS  36  -6.261   9.240 -14.528
  781   1HZ   LYS  36          1HZ       LYS  36  -8.227   7.880 -14.055
  782   2HZ   LYS  36          2HZ       LYS  36  -8.983   9.143 -13.339
  783   3HZ   LYS  36          3HZ       LYS  36  -8.638   9.191 -14.932
  784    H    ILE  37           H        ILE  37  -5.299   9.941  -7.031
  785    HA   ILE  37           HA       ILE  37  -5.516   7.486  -5.444
  786    HB   ILE  37           HB       ILE  37  -4.214  10.172  -4.748
  787   1HG1  ILE  37          1HG1      ILE  37  -2.848   7.748  -5.914
  788   2HG1  ILE  37          2HG1      ILE  37  -3.209   9.268  -6.757
  789   1HG2  ILE  37          1HG2      ILE  37  -4.521   9.004  -2.711
  790   2HG2  ILE  37          2HG2      ILE  37  -4.199   7.432  -3.457
  791   3HG2  ILE  37          3HG2      ILE  37  -2.877   8.549  -3.158
  792   1HD1  ILE  37          1HD1      ILE  37  -1.740  10.454  -5.078
  793   2HD1  ILE  37          2HD1      ILE  37  -1.188   8.836  -4.557
  794   3HD1  ILE  37          3HD1      ILE  37  -0.928   9.364  -6.217
  795    H    LEU  38           H        LEU  38  -6.541  10.943  -4.739
  796    HA   LEU  38           HA       LEU  38  -7.688  10.147  -2.308
  797   1HB   LEU  38          1HB       LEU  38  -8.267  12.257  -1.915
  798   2HB   LEU  38          2HB       LEU  38  -7.058  12.472  -3.150
  799    HG   LEU  38           HG       LEU  38  -9.141  12.383  -4.745
  800   1HD1  LEU  38          1HD1      LEU  38 -10.882  11.943  -3.019
  801   2HD1  LEU  38          2HD1      LEU  38 -10.403  13.420  -2.166
  802   3HD1  LEU  38          3HD1      LEU  38 -11.136  13.512  -3.781
  803   1HD2  LEU  38          1HD2      LEU  38  -7.608  14.337  -4.416
  804   2HD2  LEU  38          2HD2      LEU  38  -9.292  14.857  -4.618
  805   3HD2  LEU  38          3HD2      LEU  38  -8.555  14.822  -2.999
  806    H    GLU  39           H        GLU  39  -9.259   9.958  -5.547
  807    HA   GLU  39           HA       GLU  39 -11.786   9.200  -4.323
  808   1HB   GLU  39          1HB       GLU  39 -10.655   8.859  -7.139
  809   2HB   GLU  39          2HB       GLU  39 -12.278   8.342  -6.672
  810   1HG   GLU  39          1HG       GLU  39 -12.814  10.676  -5.971
  811   2HG   GLU  39          2HG       GLU  39 -11.251  11.208  -6.586
  812    H    ASP  40           H        ASP  40  -8.983   7.294  -5.410
  813    HA   ASP  40           HA       ASP  40 -10.127   4.687  -4.935
  814   1HB   ASP  40          1HB       ASP  40  -7.403   6.009  -5.199
  815   2HB   ASP  40          2HB       ASP  40  -7.449   4.472  -4.521
  816    H    GLU  41           H        GLU  41  -8.474   7.091  -2.840
  817    HA   GLU  41           HA       GLU  41  -8.347   5.201  -0.592
  818   1HB   GLU  41          1HB       GLU  41  -8.033   8.221  -0.527
  819   2HB   GLU  41          2HB       GLU  41  -7.704   7.123   0.802
  820   1HG   GLU  41          1HG       GLU  41  -6.106   7.443  -1.744
  821   2HG   GLU  41          2HG       GLU  41  -5.643   7.887  -0.125
  822    H    GLU  42           H        GLU  42 -10.608   7.758  -1.618
  823    HA   GLU  42           HA       GLU  42 -12.293   7.619   0.685
  824   1HB   GLU  42          1HB       GLU  42 -12.238   9.383  -1.104
  825   2HB   GLU  42          2HB       GLU  42 -13.133   8.300  -2.159
  826   1HG   GLU  42          1HG       GLU  42 -14.050   9.222   0.608
  827   2HG   GLU  42          2HG       GLU  42 -14.417  10.101  -0.869
  828    H    LYS  43           H        LYS  43 -12.292   5.650  -2.316
  829    HA   LYS  43           HA       LYS  43 -14.648   4.130  -1.637
  830   1HB   LYS  43          1HB       LYS  43 -13.258   4.198  -3.878
  831   2HB   LYS  43          2HB       LYS  43 -12.316   2.903  -3.176
  832   1HG   LYS  43          1HG       LYS  43 -14.124   1.435  -3.060
  833   2HG   LYS  43          2HG       LYS  43 -15.343   2.694  -3.177
  834   1HD   LYS  43          1HD       LYS  43 -13.452   1.966  -5.449
  835   2HD   LYS  43          2HD       LYS  43 -15.046   1.241  -5.248
  836   1HE   LYS  43          1HE       LYS  43 -14.545   4.236  -5.580
  837   2HE   LYS  43          2HE       LYS  43 -14.963   3.138  -6.896
  838   1HZ   LYS  43          1HZ       LYS  43 -17.059   2.651  -5.759
  839   2HZ   LYS  43          2HZ       LYS  43 -16.692   3.681  -4.541
  840   3HZ   LYS  43          3HZ       LYS  43 -16.933   4.249  -6.049
  841    H    HIS  44           H        HIS  44 -11.130   3.554  -0.868
  842    HA   HIS  44           HA       HIS  44 -11.450   1.192   0.546
  843   1HB   HIS  44          1HB       HIS  44  -9.490   3.461   1.116
  844   2HB   HIS  44          2HB       HIS  44  -9.392   1.794   1.523
  845    HD2  HIS  44           2HD      HIS  44 -10.349   1.073  -1.723
  846    HE1  HIS  44           1HE      HIS  44  -6.281   2.113  -2.366
  847    HE2  HIS  44           2HE      HIS  44  -8.366   1.092  -3.416
  848    H    ILE  45           H        ILE  45 -12.934   4.284   1.537
  849    HA   ILE  45           HA       ILE  45 -12.480   3.727   4.428
  850    HB   ILE  45           HB       ILE  45 -14.120   5.837   2.922
  851   1HG1  ILE  45          1HG1      ILE  45 -11.886   6.396   2.498
  852   2HG1  ILE  45          2HG1      ILE  45 -12.425   7.473   3.754
  853   1HG2  ILE  45          1HG2      ILE  45 -15.118   5.475   5.046
  854   2HG2  ILE  45          2HG2      ILE  45 -13.535   5.504   5.856
  855   3HG2  ILE  45          3HG2      ILE  45 -14.206   6.986   5.119
  856   1HD1  ILE  45          1HD1      ILE  45 -11.221   6.068   5.440
  857   2HD1  ILE  45          2HD1      ILE  45 -10.622   5.040   4.112
  858   3HD1  ILE  45          3HD1      ILE  45 -10.154   6.747   4.194
  859    H    GLU  46           H        GLU  46 -15.055   3.763   1.966
  860    HA   GLU  46           HA       GLU  46 -17.202   2.734   3.499
  861   1HB   GLU  46          1HB       GLU  46 -16.405   2.544   0.560
  862   2HB   GLU  46          2HB       GLU  46 -17.922   1.904   1.162
  863   1HG   GLU  46          1HG       GLU  46 -17.057   4.817   1.423
  864   2HG   GLU  46          2HG       GLU  46 -18.078   4.183   0.141
  865    H    TRP  47           H        TRP  47 -14.436   1.055   1.994
  866    HA   TRP  47           HA       TRP  47 -15.462  -1.601   2.576
  867   1HB   TRP  47          1HB       TRP  47 -12.689  -0.605   1.796
  868   2HB   TRP  47          2HB       TRP  47 -13.212  -2.268   1.820
  869    HD1  TRP  47           1HD      TRP  47 -16.003  -0.587   0.227
  870    HE1  TRP  47           1HE      TRP  47 -15.773  -0.491  -2.337
  871    HE3  TRP  47           3HE      TRP  47 -11.134  -2.013  -0.225
  872    HZ2  TRP  47           2HZ      TRP  47 -13.769  -1.036  -4.324
  873    HZ3  TRP  47           3HZ      TRP  47 -10.069  -2.251  -2.455
  874    HH2  TRP  47           2HH      TRP  47 -11.375  -1.707  -4.520
  875    H    LEU  48           H        LEU  48 -12.972   0.560   4.039
  876    HA   LEU  48           HA       LEU  48 -12.059  -1.223   6.019
  877   1HB   LEU  48          1HB       LEU  48 -11.868   1.633   5.389
  878   2HB   LEU  48          2HB       LEU  48 -12.145   1.477   7.068
  879    HG   LEU  48           HG       LEU  48  -9.885   1.598   6.718
  880   1HD1  LEU  48          1HD1      LEU  48 -10.626  -0.130   8.423
  881   2HD1  LEU  48          2HD1      LEU  48 -10.283  -1.388   7.223
  882   3HD1  LEU  48          3HD1      LEU  48  -8.974  -0.362   7.812
  883   1HD2  LEU  48          1HD2      LEU  48  -9.998  -0.768   4.810
  884   2HD2  LEU  48          2HD2      LEU  48  -9.666   0.926   4.389
  885   3HD2  LEU  48          3HD2      LEU  48  -8.513   0.022   5.381
  886    H    GLU  49           H        GLU  49 -14.623   1.219   6.262
  887    HA   GLU  49           HA       GLU  49 -15.569   0.445   8.861
  888   1HB   GLU  49          1HB       GLU  49 -16.220   2.386   6.924
  889   2HB   GLU  49          2HB       GLU  49 -17.683   1.456   7.083
  890   1HG   GLU  49          1HG       GLU  49 -16.130   2.738   9.380
  891   2HG   GLU  49          2HG       GLU  49 -17.565   3.420   8.625
  892    H    THR  50           H        THR  50 -16.206  -0.975   5.674
  893    HA   THR  50           HA       THR  50 -18.378  -2.690   6.622
  894    HB   THR  50           HB       THR  50 -16.798  -2.361   4.129
  895    HG1  THR  50           1HG      THR  50 -19.518  -2.999   4.621
  896   1HG2  THR  50          1HG2      THR  50 -16.470  -4.741   4.314
  897   2HG2  THR  50          2HG2      THR  50 -18.200  -4.989   4.679
  898   3HG2  THR  50          3HG2      THR  50 -17.684  -4.383   3.082
  899    H    ILE  51           H        ILE  51 -14.902  -2.965   6.536
  900    HA   ILE  51           HA       ILE  51 -14.882  -5.738   7.457
  901    HB   ILE  51           HB       ILE  51 -12.747  -3.655   6.924
  902   1HG1  ILE  51          1HG1      ILE  51 -13.818  -4.682   4.943
  903   2HG1  ILE  51          2HG1      ILE  51 -12.106  -5.026   5.053
  904   1HG2  ILE  51          1HG2      ILE  51 -11.742  -4.900   8.692
  905   2HG2  ILE  51          2HG2      ILE  51 -12.256  -6.447   7.990
  906   3HG2  ILE  51          3HG2      ILE  51 -11.019  -5.452   7.180
  907   1HD1  ILE  51          1HD1      ILE  51 -12.606  -7.332   5.831
  908   2HD1  ILE  51          2HD1      ILE  51 -14.351  -6.978   5.747
  909   3HD1  ILE  51          3HD1      ILE  51 -13.370  -6.977   4.278
  910    H    ASN  52           H        ASN  52 -15.120  -2.795   9.019
  911    HA   ASN  52           HA       ASN  52 -14.121  -3.488  11.646
  912   1HB   ASN  52          1HB       ASN  52 -14.453  -1.158  10.927
  913   2HB   ASN  52          2HB       ASN  52 -16.184  -1.445  10.750
  914   1HD2  ASN  52          2HD2      ASN  52 -16.713   0.213  12.228
  915   2HD2  ASN  52          1HD2      ASN  52 -16.449  -0.023  13.963
  916    H    GLY  53           H        GLY  53 -14.806  -5.312  12.595
  917   1HA   GLY  53          1HA       GLY  53 -17.304  -5.543  13.898
  918   2HA   GLY  53          2HA       GLY  53 -17.403  -6.507  12.425